*HEADER    PROTEIN BINDING                         22-MAY-19   6RSS              
*TITLE     SOLUTION STRUCTURE OF THE FOURTH WW DOMAIN OF WWP2 WITH GB1-TAG       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEDD4-LIKE E3 UBIQUITIN-PROTEIN LIGASE WWP2;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: ATROPHIN-1-INTERACTING PROTEIN 2,AIP2,HECT-TYPE E3 UBIQUITIN
*COMPND   5 TRANSFERASE WWP2,WW DOMAIN-CONTAINING PROTEIN 2;                     
*COMPND   6 EC: 2.3.2.26;                                                        
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: WWP2;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_VARIANT: BL21 STAR(DE3);                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PSKDUET01                                 
*KEYWDS    THREE-STRANDED ANTIPARALLEL BETA-SHEET, PPXY MOTIF BINDING, E3        
*KEYWDS   2 UBIQUITIN LIGASE, NEDD4, PROTEIN BINDING                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.C.WAHL,J.E.WATT,J.TOLCHARD,T.M.A.BLUMENSCHEIN,A.CHANTRY             
*REVDAT   1   09-OCT-19 6RSS    0                                                
# Restraints file 1: GB1_WW4_restraints_ambig.tbl
 ASSI {  179}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      2.210     0.610     0.610 peak   179 spectrum    1 weight  0.11000E+01 volume  0.78417E-02 ppm1      8.284 ppm2      9.220 CV     1
 OR {  179}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
# Restraints file 2: GB1_WW4_restraints_unambig.tbl
 ASSI {    1}
   (( segid "    " and resid 13   and name HE2 ))
   (( segid "    " and resid 13   and name HD1 ))
      2.170     0.590     0.590 peak     1 spectrum    1 weight  0.11000E+01 volume  0.91241E-02 ppm1      3.004 ppm2      1.709 CV     1
 ASSI {    2}
   (  segid "    " and resid 29   and name HB% )
   (  segid "    " and resid 23   and name HB% )
      2.280     0.650     0.650 peak     2 spectrum    1 weight  0.11000E+01 volume  0.93926E-02 ppm1      0.496 ppm2      1.308 CV     1
 ASSI {    4}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB  ))
      2.400     0.720     0.720 peak     4 spectrum    1 weight  0.11000E+01 volume  0.50027E-02 ppm1      5.809 ppm2      4.335 CV     1
 ASSI {    6}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 20   and name HB  ))
      2.740     0.940     0.940 peak     6 spectrum    1 weight  0.11000E+01 volume  0.21379E-02 ppm1      2.395 ppm2      4.335 CV     1
 ASSI {    7}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 20   and name HB  ))
      3.230     1.300     1.300 peak     7 spectrum    1 weight  0.11000E+01 volume  0.13780E-02 ppm1      2.168 ppm2      4.336 CV     1
 ASSI {    8}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 20   and name HB  ))
      3.950     1.950     1.950 peak     8 spectrum    1 weight  0.11000E+01 volume  0.68296E-03 ppm1      5.219 ppm2      4.334 CV     1
 ASSI {   10}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB  ))
      2.470     0.760     0.760 peak    10 spectrum    1 weight  0.11000E+01 volume  0.53440E-02 ppm1      4.855 ppm2      4.267 CV     1
 ASSI {   14}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      2.910     1.060     1.060 peak    14 spectrum    1 weight  0.11000E+01 volume  0.23624E-02 ppm1      8.324 ppm2      3.978 CV     1
 ASSI {   15}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB  ))
      3.390     1.440     1.440 peak    15 spectrum    1 weight  0.11000E+01 volume  0.10578E-02 ppm1      7.430 ppm2      3.978 CV     1
 ASSI {   16}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB  ))
      2.760     0.950     0.950 peak    16 spectrum    1 weight  0.11000E+01 volume  0.28473E-02 ppm1      4.633 ppm2      3.978 CV     1
 ASSI {   17}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 98   and name HB  ))
      3.220     1.300     1.300 peak    17 spectrum    1 weight  0.11000E+01 volume  0.12130E-02 ppm1      1.967 ppm2      3.978 CV     1
 ASSI {   19}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB  ))
      3.200     1.280     1.280 peak    19 spectrum    1 weight  0.11000E+01 volume  0.11919E-02 ppm1      5.550 ppm2      3.764 CV     1
 ASSI {   20}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 54   and name HB  ))
      3.280     1.350     1.350 peak    20 spectrum    1 weight  0.11000E+01 volume  0.19275E-02 ppm1      4.347 ppm2      3.763 CV     1
 ASSI {   22}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 54   and name HB  ))
      3.210     1.290     1.290 peak    22 spectrum    1 weight  0.11000E+01 volume  0.11693E-02 ppm1      2.623 ppm2      3.763 CV     1
 ASSI {   23}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB  ))
      2.800     0.980     0.980 peak    23 spectrum    1 weight  0.11000E+01 volume  0.23735E-02 ppm1      5.304 ppm2      3.931 CV     1
 ASSI {   24}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 99   and name HB  ))
      3.080     1.190     1.190 peak    24 spectrum    1 weight  0.11000E+01 volume  0.13172E-02 ppm1      6.766 ppm2      3.931 CV     1
 ASSI {   25}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB  ))
      3.150     1.240     1.240 peak    25 spectrum    1 weight  0.11000E+01 volume  0.14310E-02 ppm1      9.265 ppm2      3.929 CV     1
 ASSI {   27}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB  ))
      2.890     1.040     1.040 peak    27 spectrum    1 weight  0.11000E+01 volume  0.20568E-02 ppm1      5.213 ppm2      3.846 CV     1
 ASSI {   28}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HB  ))
      3.760     1.770     1.770 peak    28 spectrum    1 weight  0.11000E+01 volume  0.12624E-02 ppm1      5.634 ppm2      3.847 CV     1
 ASSI {   29}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB  ))
      2.810     0.990     0.990 peak    29 spectrum    1 weight  0.11000E+01 volume  0.22427E-02 ppm1      9.118 ppm2      3.846 CV     1
 ASSI {   31}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      4.240     2.240     2.240 peak    31 spectrum    1 weight  0.11000E+01 volume  0.35929E-03 ppm1      8.044 ppm2      4.319 CV     1
 ASSI {   32}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.990     1.990     1.990 peak    32 spectrum    1 weight  0.11000E+01 volume  0.48372E-03 ppm1      6.630 ppm2      4.321 CV     1
 ASSI {   33}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HB  ))
      2.240     0.630     0.630 peak    33 spectrum    1 weight  0.11000E+01 volume  0.10288E-01 ppm1      1.153 ppm2      4.319 CV     1
 ASSI {   34}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HB  ))
      2.290     0.660     0.660 peak    34 spectrum    1 weight  0.11000E+01 volume  0.87410E-02 ppm1      1.095 ppm2      4.428 CV     1
 ASSI {   35}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      3.920     1.920     1.920 peak    35 spectrum    1 weight  0.11000E+01 volume  0.52699E-03 ppm1      7.010 ppm2      4.429 CV     1
 ASSI {   37}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 58   and name HB  ))
      2.950     1.090     1.090 peak    37 spectrum    1 weight  0.11000E+01 volume  0.14693E-02 ppm1      2.040 ppm2      3.883 CV     1
 ASSI {   38}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
      2.610     0.850     0.850 peak    38 spectrum    1 weight  0.11000E+01 volume  0.34682E-02 ppm1      8.389 ppm2      3.882 CV     1
 ASSI {   44}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
      3.620     1.640     1.640 peak    44 spectrum    1 weight  0.11000E+01 volume  0.68771E-03 ppm1      9.265 ppm2      4.388 CV     1
 ASSI {   47}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB  ))
      2.530     0.800     0.800 peak    47 spectrum    1 weight  0.11000E+01 volume  0.42144E-02 ppm1      4.729 ppm2      3.945 CV     1
 ASSI {   48}
   (( segid "    " and resid 33   and name HZ  ))
   (( segid "    " and resid 21   and name HB  ))
      2.800     0.980     0.980 peak    48 spectrum    1 weight  0.11000E+01 volume  0.21463E-02 ppm1      7.146 ppm2      3.944 CV     1
 ASSI {   49}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB  ))
      4.220     2.230     2.230 peak    49 spectrum    1 weight  0.11000E+01 volume  0.60925E-03 ppm1      8.090 ppm2      3.943 CV     1
 ASSI {   50}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB  ))
      3.600     1.620     1.620 peak    50 spectrum    1 weight  0.11000E+01 volume  0.62558E-03 ppm1      8.997 ppm2      3.945 CV     1
 ASSI {   52}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 19   and name HB  ))
      3.950     1.950     1.950 peak    52 spectrum    1 weight  0.11000E+01 volume  0.52928E-03 ppm1      6.746 ppm2      3.868 CV     1
 ASSI {   55}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 19   and name HB  ))
      3.620     1.640     1.640 peak    55 spectrum    1 weight  0.11000E+01 volume  0.89756E-03 ppm1      0.790 ppm2      3.864 CV     1
 ASSI {   57}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 28   and name HB  ))
      3.640     1.660     1.660 peak    57 spectrum    1 weight  0.11000E+01 volume  0.80621E-03 ppm1      0.878 ppm2      4.007 CV     1
 ASSI {   61}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 28   and name HA  ))
      2.400     0.720     0.720 peak    61 spectrum    1 weight  0.11000E+01 volume  0.69905E-02 ppm1      1.234 ppm2      3.705 CV     1
 ASSI {   62}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 28   and name HA  ))
      3.130     1.230     1.230 peak    62 spectrum    1 weight  0.11000E+01 volume  0.15098E-02 ppm1      1.594 ppm2      3.705 CV     1
 ASSI {   63}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 28   and name HA  ))
      2.580     0.830     0.830 peak    63 spectrum    1 weight  0.11000E+01 volume  0.29233E-02 ppm1      1.854 ppm2      3.704 CV     1
 ASSI {   65}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      3.100     1.200     1.200 peak    65 spectrum    1 weight  0.11000E+01 volume  0.14536E-02 ppm1      7.066 ppm2      3.705 CV     1
 ASSI {   66}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 28   and name HA  ))
      2.930     1.070     1.070 peak    66 spectrum    1 weight  0.11000E+01 volume  0.23056E-02 ppm1      4.021 ppm2      3.705 CV     1
 ASSI {   67}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 32   and name HA  ))
      2.840     1.010     1.010 peak    67 spectrum    1 weight  0.11000E+01 volume  0.26808E-02 ppm1      1.796 ppm2      3.657 CV     1
 ASSI {   68}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.660     0.880     0.880 peak    68 spectrum    1 weight  0.11000E+01 volume  0.35831E-02 ppm1      7.459 ppm2      3.657 CV     1
 ASSI {   69}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      3.590     1.610     1.610 peak    69 spectrum    1 weight  0.11000E+01 volume  0.79736E-03 ppm1      8.485 ppm2      3.657 CV     1
 ASSI {   70}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
      2.340     0.690     0.690 peak    70 spectrum    1 weight  0.11000E+01 volume  0.51135E-02 ppm1      2.411 ppm2      4.464 CV     1
 ASSI {   71}
   (( segid "    " and resid 77   and name HG2 ))
   (( segid "    " and resid 77   and name HA  ))
      3.080     1.190     1.190 peak    71 spectrum    1 weight  0.11000E+01 volume  0.40411E-02 ppm1      2.062 ppm2      4.464 CV     1
 ASSI {   72}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.500     1.530     1.530 peak    72 spectrum    1 weight  0.11000E+01 volume  0.96308E-03 ppm1      7.823 ppm2      4.463 CV     1
 ASSI {   73}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      2.570     0.830     0.830 peak    73 spectrum    1 weight  0.11000E+01 volume  0.33443E-02 ppm1      8.998 ppm2      4.464 CV     1
 ASSI {   74}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
      2.550     0.810     0.810 peak    74 spectrum    1 weight  0.11000E+01 volume  0.63015E-02 ppm1      2.239 ppm2      4.336 CV     1
 ASSI {   75}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 106  and name HA  ))
      2.440     0.740     0.740 peak    75 spectrum    1 weight  0.11000E+01 volume  0.41396E-02 ppm1      1.884 ppm2      4.335 CV     1
 ASSI {   76}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.620     0.860     0.860 peak    76 spectrum    1 weight  0.11000E+01 volume  0.30142E-02 ppm1      8.604 ppm2      4.335 CV     1
 ASSI {   77}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 73   and name HA  ))
      3.360     1.410     1.410 peak    77 spectrum    1 weight  0.11000E+01 volume  0.17031E-02 ppm1      1.398 ppm2      4.415 CV     1
 ASSI {   78}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      2.530     0.800     0.800 peak    78 spectrum    1 weight  0.11000E+01 volume  0.36589E-02 ppm1      1.782 ppm2      4.415 CV     1
 ASSI {   79}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.380     1.430     1.430 peak    79 spectrum    1 weight  0.11000E+01 volume  0.25894E-02 ppm1      2.043 ppm2      4.414 CV     1
 OR {   79}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {   80}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
      2.510     0.790     0.790 peak    80 spectrum    1 weight  0.11000E+01 volume  0.70012E-02 ppm1      2.342 ppm2      4.415 CV     1
 ASSI {   83}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.680     0.900     0.900 peak    83 spectrum    1 weight  0.11000E+01 volume  0.26958E-02 ppm1      9.127 ppm2      5.546 CV     1
 ASSI {   84}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.210     0.610     0.610 peak    84 spectrum    1 weight  0.11000E+01 volume  0.72763E-02 ppm1     10.316 ppm2      5.546 CV     1
 ASSI {   85}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      3.080     1.190     1.190 peak    85 spectrum    1 weight  0.11000E+01 volume  0.17837E-02 ppm1      2.027 ppm2      5.547 CV     1
 ASSI {   88}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 76   and name HA  ))
      2.130     0.570     0.570 peak    88 spectrum    1 weight  0.11000E+01 volume  0.90784E-02 ppm1      3.929 ppm2      4.718 CV     1
 ASSI {   89}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 21   and name HA  ))
      3.350     1.400     1.400 peak    89 spectrum    1 weight  0.11000E+01 volume  0.16057E-02 ppm1      0.541 ppm2      4.722 CV     1
 ASSI {   91}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.020     1.140     1.140 peak    91 spectrum    1 weight  0.11000E+01 volume  0.14697E-02 ppm1      8.996 ppm2      4.721 CV     1
 ASSI {   92}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 24   and name HA  ))
      2.430     0.740     0.740 peak    92 spectrum    1 weight  0.11000E+01 volume  0.55892E-02 ppm1      2.089 ppm2      4.072 CV     1
 ASSI {   93}
   (  segid "    " and resid 24   and name HG1%)
   (( segid "    " and resid 24   and name HA  ))
      2.540     0.800     0.800 peak    93 spectrum    1 weight  0.11000E+01 volume  0.54567E-02 ppm1      0.866 ppm2      4.072 CV     1
 ASSI {   94}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 24   and name HA  ))
      4.220     2.230     2.230 peak    94 spectrum    1 weight  0.11000E+01 volume  0.83193E-03 ppm1      3.005 ppm2      4.074 CV     1
 ASSI {   96}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.360     1.410     1.410 peak    96 spectrum    1 weight  0.11000E+01 volume  0.95910E-03 ppm1      7.295 ppm2      4.072 CV     1
 ASSI {   97}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.920     1.060     1.060 peak    97 spectrum    1 weight  0.11000E+01 volume  0.18830E-02 ppm1      8.460 ppm2      4.072 CV     1
 ASSI {   98}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
      2.990     1.120     1.120 peak    98 spectrum    1 weight  0.11000E+01 volume  0.18801E-02 ppm1      2.300 ppm2      4.168 CV     1
 ASSI {   99}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
      2.520     0.800     0.800 peak    99 spectrum    1 weight  0.11000E+01 volume  0.53126E-02 ppm1      1.171 ppm2      4.167 CV     1
 ASSI {  102}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.220     0.610     0.610 peak   102 spectrum    1 weight  0.11000E+01 volume  0.81043E-02 ppm1      8.756 ppm2      4.167 CV     1
 ASSI {  104}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HA  ))
      2.930     1.070     1.070 peak   104 spectrum    1 weight  0.11000E+01 volume  0.20545E-02 ppm1      1.759 ppm2      4.179 CV     1
 ASSI {  107}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
      2.800     0.980     0.980 peak   107 spectrum    1 weight  0.11000E+01 volume  0.37327E-02 ppm1      0.786 ppm2      3.994 CV     1
 ASSI {  108}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HA  ))
      2.440     0.740     0.740 peak   108 spectrum    1 weight  0.11000E+01 volume  0.47112E-02 ppm1      0.571 ppm2      3.995 CV     1
 ASSI {  109}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HA  ))
      4.310     2.320     2.190 peak   109 spectrum    1 weight  0.11000E+01 volume  0.75210E-03 ppm1      0.212 ppm2      3.996 CV     1
 ASSI {  111}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      2.470     0.760     0.760 peak   111 spectrum    1 weight  0.11000E+01 volume  0.65777E-02 ppm1      1.173 ppm2      4.393 CV     1
 ASSI {  114}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 36   and name HA  ))
      2.860     1.020     1.020 peak   114 spectrum    1 weight  0.11000E+01 volume  0.24736E-02 ppm1      6.999 ppm2      4.284 CV     1
 ASSI {  115}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.710     0.920     0.920 peak   115 spectrum    1 weight  0.11000E+01 volume  0.30196E-02 ppm1      8.295 ppm2      4.286 CV     1
 ASSI {  116}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      3.390     1.440     1.440 peak   116 spectrum    1 weight  0.11000E+01 volume  0.77859E-03 ppm1      8.967 ppm2      4.283 CV     1
 ASSI {  118}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HA  ))
      2.550     0.810     0.810 peak   118 spectrum    1 weight  0.11000E+01 volume  0.69110E-02 ppm1      3.324 ppm2      4.284 CV     1
 ASSI {  119}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
      2.800     0.980     0.980 peak   119 spectrum    1 weight  0.11000E+01 volume  0.24964E-02 ppm1      2.738 ppm2      4.285 CV     1
 ASSI {  120}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.140     0.570     0.570 peak   120 spectrum    1 weight  0.11000E+01 volume  0.90190E-02 ppm1      8.261 ppm2      5.212 CV     1
 ASSI {  121}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.420     0.730     0.730 peak   121 spectrum    1 weight  0.11000E+01 volume  0.41221E-02 ppm1      9.112 ppm2      5.212 CV     1
 ASSI {  123}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 56   and name HA  ))
      2.630     0.860     0.860 peak   123 spectrum    1 weight  0.11000E+01 volume  0.33132E-02 ppm1      1.993 ppm2      5.213 CV     1
 ASSI {  126}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 56   and name HA  ))
      3.460     1.500     1.500 peak   126 spectrum    1 weight  0.11000E+01 volume  0.13523E-02 ppm1      0.791 ppm2      5.214 CV     1
 ASSI {  128}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.210     1.290     1.290 peak   128 spectrum    1 weight  0.11000E+01 volume  0.12974E-02 ppm1      8.216 ppm2      5.302 CV     1
 ASSI {  133}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 99   and name HA  ))
      3.660     1.680     1.680 peak   133 spectrum    1 weight  0.11000E+01 volume  0.78863E-03 ppm1      0.737 ppm2      5.304 CV     1
 ASSI {  134}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 99   and name HA  ))
      3.940     1.940     1.940 peak   134 spectrum    1 weight  0.11000E+01 volume  0.55863E-03 ppm1      0.240 ppm2      5.303 CV     1
 ASSI {  136}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
      2.300     0.660     0.660 peak   136 spectrum    1 weight  0.11000E+01 volume  0.56986E-02 ppm1      5.230 ppm2      5.808 CV     1
 ASSI {  137}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 20   and name HA  ))
      2.550     0.810     0.810 peak   137 spectrum    1 weight  0.11000E+01 volume  0.46336E-02 ppm1      1.208 ppm2      5.807 CV     1
 ASSI {  138}
   (( segid "    " and resid 33   and name HZ  ))
   (( segid "    " and resid 20   and name HA  ))
      2.560     0.820     0.820 peak   138 spectrum    1 weight  0.11000E+01 volume  0.31824E-02 ppm1      7.183 ppm2      5.807 CV     1
 ASSI {  140}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      3.300     1.360     1.360 peak   140 spectrum    1 weight  0.11000E+01 volume  0.16478E-02 ppm1      8.584 ppm2      5.808 CV     1
 ASSI {  141}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.330     0.680     0.680 peak   141 spectrum    1 weight  0.11000E+01 volume  0.58657E-02 ppm1      8.996 ppm2      5.807 CV     1
 ASSI {  144}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 19   and name HA  ))
      2.350     0.690     0.690 peak   144 spectrum    1 weight  0.11000E+01 volume  0.66573E-02 ppm1      3.880 ppm2      4.731 CV     1
 ASSI {  145}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HA  ))
      2.420     0.730     0.730 peak   145 spectrum    1 weight  0.11000E+01 volume  0.39385E-02 ppm1      2.419 ppm2      4.715 CV     1
 ASSI {  146}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
      3.090     1.190     1.190 peak   146 spectrum    1 weight  0.11000E+01 volume  0.22644E-02 ppm1      1.842 ppm2      4.715 CV     1
 ASSI {  149}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      3.110     1.210     1.210 peak   149 spectrum    1 weight  0.11000E+01 volume  0.26804E-02 ppm1      2.538 ppm2      4.728 CV     1
 ASSI {  152}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      2.600     0.840     0.840 peak   152 spectrum    1 weight  0.11000E+01 volume  0.40270E-02 ppm1      8.326 ppm2      4.631 CV     1
 ASSI {  154}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.990     1.120     1.120 peak   154 spectrum    1 weight  0.11000E+01 volume  0.15906E-02 ppm1      9.314 ppm2      4.865 CV     1
 ASSI {  156}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HA  ))
      2.320     0.670     0.670 peak   156 spectrum    1 weight  0.11000E+01 volume  0.95791E-02 ppm1      1.153 ppm2      4.327 CV     1
 ASSI {  157}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.950     1.090     1.090 peak   157 spectrum    1 weight  0.11000E+01 volume  0.17951E-02 ppm1      6.627 ppm2      4.327 CV     1
 ASSI {  158}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.380     1.430     1.430 peak   158 spectrum    1 weight  0.11000E+01 volume  0.95114E-03 ppm1      8.038 ppm2      4.327 CV     1
 ASSI {  161}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 92   and name HA  ))
      2.560     0.820     0.820 peak   161 spectrum    1 weight  0.11000E+01 volume  0.34362E-02 ppm1      5.304 ppm2      4.365 CV     1
 ASSI {  162}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.340     0.680     0.680 peak   162 spectrum    1 weight  0.11000E+01 volume  0.53727E-02 ppm1      8.204 ppm2      4.364 CV     1
 ASSI {  163}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
      2.220     0.610     0.610 peak   163 spectrum    1 weight  0.11000E+01 volume  0.10730E-01 ppm1      4.067 ppm2      4.296 CV     1
 ASSI {  164}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      2.270     0.640     0.640 peak   164 spectrum    1 weight  0.11000E+01 volume  0.80140E-02 ppm1      0.794 ppm2      4.338 CV     1
 ASSI {  165}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 9    and name HA  ))
      2.760     0.950     0.950 peak   165 spectrum    1 weight  0.11000E+01 volume  0.25307E-02 ppm1      1.994 ppm2      4.334 CV     1
 ASSI {  166}
   (( segid "    " and resid 9    and name HG12))
   (( segid "    " and resid 9    and name HA  ))
      2.680     0.900     0.900 peak   166 spectrum    1 weight  0.11000E+01 volume  0.24413E-02 ppm1      1.423 ppm2      4.336 CV     1
 ASSI {  168}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 70   and name HA  ))
      2.900     1.050     1.050 peak   168 spectrum    1 weight  0.11000E+01 volume  0.24126E-02 ppm1      1.888 ppm2      4.176 CV     1
 ASSI {  169}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.850     0.850 peak   169 spectrum    1 weight  0.11000E+01 volume  0.33625E-02 ppm1      9.170 ppm2      4.196 CV     1
 ASSI {  170}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.480     0.770     0.770 peak   170 spectrum    1 weight  0.11000E+01 volume  0.42393E-02 ppm1      7.374 ppm2      4.196 CV     1
 ASSI {  171}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.880     1.040     1.040 peak   171 spectrum    1 weight  0.11000E+01 volume  0.24643E-02 ppm1      6.779 ppm2      4.195 CV     1
 ASSI {  172}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HA  ))
      3.120     1.220     1.220 peak   172 spectrum    1 weight  0.11000E+01 volume  0.30895E-02 ppm1      0.530 ppm2      4.197 CV     1
 ASSI {  173}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HA  ))
      2.410     0.730     0.730 peak   173 spectrum    1 weight  0.11000E+01 volume  0.43352E-02 ppm1      1.617 ppm2      4.197 CV     1
 ASSI {  175}
   (( segid "    " and resid 34   and name HD2 ))
   (( segid "    " and resid 34   and name HA  ))
      4.060     2.060     2.060 peak   175 spectrum    1 weight  0.11000E+01 volume  0.15467E-02 ppm1      1.078 ppm2      4.198 CV     1
 ASSI {  176}
   (( segid "    " and resid 30   and name HG1 ))
   (( segid "    " and resid 30   and name HA  ))
      2.440     0.740     0.740 peak   176 spectrum    1 weight  0.11000E+01 volume  0.51929E-02 ppm1      1.569 ppm2      2.775 CV     1
 OR {  176}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HA  ))
 ASSI {  177}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
      2.570     0.820     0.820 peak   177 spectrum    1 weight  0.11000E+01 volume  0.37983E-02 ppm1      1.960 ppm2      2.775 CV     1
 ASSI {  178}
   (  segid "    " and resid 55   and name HE% )
   (( segid "    " and resid 30   and name HA  ))
      3.540     1.570     1.570 peak   178 spectrum    1 weight  0.11000E+01 volume  0.11544E-02 ppm1      6.757 ppm2      2.775 CV     1
 ASSI {  180}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 30   and name HA  ))
      3.180     1.270     1.270 peak   180 spectrum    1 weight  0.11000E+01 volume  0.88307E-03 ppm1      0.501 ppm2      2.777 CV     1
 ASSI {  181}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      3.510     1.540     1.540 peak   181 spectrum    1 weight  0.11000E+01 volume  0.67345E-03 ppm1      8.477 ppm2      2.773 CV     1
 ASSI {  182}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      3.790     1.800     1.800 peak   182 spectrum    1 weight  0.11000E+01 volume  0.41815E-03 ppm1      9.166 ppm2      2.775 CV     1
 ASSI {  187}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HA  ))
      2.400     0.720     0.720 peak   187 spectrum    1 weight  0.11000E+01 volume  0.79861E-02 ppm1      1.091 ppm2      4.410 CV     1
 ASSI {  188}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      2.230     0.620     0.620 peak   188 spectrum    1 weight  0.11000E+01 volume  0.91681E-02 ppm1      1.855 ppm2      3.747 CV     1
 OR {  188}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  189}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HA  ))
      2.610     0.850     0.850 peak   189 spectrum    1 weight  0.11000E+01 volume  0.38321E-02 ppm1      1.569 ppm2      3.747 CV     1
 ASSI {  190}
   (( segid "    " and resid 31   and name HG1 ))
   (( segid "    " and resid 31   and name HA  ))
      3.410     1.450     1.450 peak   190 spectrum    1 weight  0.11000E+01 volume  0.21298E-02 ppm1      1.343 ppm2      3.747 CV     1
 ASSI {  192}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.230     1.300     1.300 peak   192 spectrum    1 weight  0.11000E+01 volume  0.11628E-02 ppm1      7.456 ppm2      3.747 CV     1
 ASSI {  193}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.470     1.510     1.510 peak   193 spectrum    1 weight  0.11000E+01 volume  0.10105E-02 ppm1      9.160 ppm2      3.747 CV     1
 ASSI {  194}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 30   and name HA  ))
      4.230     2.230     2.230 peak   194 spectrum    1 weight  0.11000E+01 volume  0.66110E-03 ppm1      3.398 ppm2      2.773 CV     1
 ASSI {  195}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 31   and name HA  ))
      4.190     2.190     2.190 peak   195 spectrum    1 weight  0.11000E+01 volume  0.84648E-03 ppm1      0.877 ppm2      3.750 CV     1
 ASSI {  196}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.800     0.980     0.980 peak   196 spectrum    1 weight  0.11000E+01 volume  0.17020E-02 ppm1      9.119 ppm2      4.341 CV     1
 ASSI {  197}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
      3.290     1.350     1.350 peak   197 spectrum    1 weight  0.11000E+01 volume  0.18821E-02 ppm1      0.380 ppm2      4.730 CV     1
 ASSI {  198}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 101  and name HA  ))
      3.460     1.500     1.500 peak   198 spectrum    1 weight  0.11000E+01 volume  0.13040E-02 ppm1      6.986 ppm2      4.940 CV     1
 ASSI {  199}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 101  and name HA  ))
      2.940     1.080     1.080 peak   199 spectrum    1 weight  0.11000E+01 volume  0.20279E-02 ppm1      7.580 ppm2      4.940 CV     1
 ASSI {  200}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HA  ))
      2.690     0.910     0.910 peak   200 spectrum    1 weight  0.11000E+01 volume  0.28863E-02 ppm1      3.582 ppm2      4.939 CV     1
 ASSI {  201}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.360     1.410     1.410 peak   201 spectrum    1 weight  0.11000E+01 volume  0.84612E-03 ppm1      9.100 ppm2      4.939 CV     1
 ASSI {  202}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      2.990     1.120     1.120 peak   202 spectrum    1 weight  0.11000E+01 volume  0.20850E-02 ppm1      2.973 ppm2      4.937 CV     1
 ASSI {  203}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 101  and name HA  ))
      3.700     1.720     1.720 peak   203 spectrum    1 weight  0.11000E+01 volume  0.10683E-02 ppm1      2.297 ppm2      4.934 CV     1
 ASSI {  204}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      3.360     1.410     1.410 peak   204 spectrum    1 weight  0.11000E+01 volume  0.83353E-03 ppm1      2.571 ppm2      4.935 CV     1
 ASSI {  205}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.070     1.180     1.180 peak   205 spectrum    1 weight  0.11000E+01 volume  0.13075E-02 ppm1      8.044 ppm2      4.205 CV     1
 ASSI {  207}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 94   and name HA  ))
      2.760     0.950     0.950 peak   207 spectrum    1 weight  0.11000E+01 volume  0.35699E-02 ppm1      3.027 ppm2      4.207 CV     1
 ASSI {  208}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HA  ))
      2.770     0.960     0.960 peak   208 spectrum    1 weight  0.11000E+01 volume  0.24141E-02 ppm1      3.301 ppm2      4.207 CV     1
 ASSI {  209}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 94   and name HA  ))
      2.880     1.040     1.040 peak   209 spectrum    1 weight  0.11000E+01 volume  0.17427E-02 ppm1      3.760 ppm2      4.209 CV     1
 ASSI {  210}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 94   and name HA  ))
      4.010     2.010     2.010 peak   210 spectrum    1 weight  0.11000E+01 volume  0.99848E-03 ppm1      0.240 ppm2      4.206 CV     1
 ASSI {  211}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      2.990     1.110     1.110 peak   211 spectrum    1 weight  0.11000E+01 volume  0.19881E-02 ppm1      8.048 ppm2      4.141 CV     1
 ASSI {  212}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HA  ))
      3.110     1.210     1.210 peak   212 spectrum    1 weight  0.11000E+01 volume  0.21783E-02 ppm1      2.042 ppm2      4.141 CV     1
 ASSI {  213}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 109  and name HA  ))
      3.440     1.480     1.480 peak   213 spectrum    1 weight  0.11000E+01 volume  0.12931E-02 ppm1      2.215 ppm2      4.137 CV     1
 OR {  213}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name HA  ))
 ASSI {  214}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 13   and name HA  ))
      2.510     0.790     0.790 peak   214 spectrum    1 weight  0.11000E+01 volume  0.39058E-02 ppm1      1.468 ppm2      4.077 CV     1
 ASSI {  215}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
      2.510     0.790     0.790 peak   215 spectrum    1 weight  0.11000E+01 volume  0.85420E-02 ppm1      1.844 ppm2      4.077 CV     1
 ASSI {  216}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.440     0.740     0.740 peak   216 spectrum    1 weight  0.11000E+01 volume  0.89810E-02 ppm1      2.247 ppm2      4.072 CV     1
 ASSI {  217}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.750     0.950     0.950 peak   217 spectrum    1 weight  0.11000E+01 volume  0.35095E-02 ppm1      2.461 ppm2      4.072 CV     1
 ASSI {  219}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.990     1.120     1.120 peak   219 spectrum    1 weight  0.11000E+01 volume  0.19055E-02 ppm1      8.291 ppm2      4.072 CV     1
 ASSI {  220}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.810     0.990     0.990 peak   220 spectrum    1 weight  0.11000E+01 volume  0.22966E-02 ppm1      9.308 ppm2      4.077 CV     1
 ASSI {  221}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
      3.440     1.480     1.480 peak   221 spectrum    1 weight  0.11000E+01 volume  0.15269E-02 ppm1      1.537 ppm2      4.905 CV     1
 ASSI {  222}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.860     1.020     1.020 peak   222 spectrum    1 weight  0.11000E+01 volume  0.19047E-02 ppm1      8.921 ppm2      4.905 CV     1
 ASSI {  224}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      3.150     1.240     1.240 peak   224 spectrum    1 weight  0.11000E+01 volume  0.10696E-02 ppm1     10.315 ppm2      5.646 CV     1
 ASSI {  225}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HA  ))
      3.040     1.160     1.160 peak   225 spectrum    1 weight  0.11000E+01 volume  0.15661E-02 ppm1      7.609 ppm2      5.645 CV     1
 ASSI {  226}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 55   and name HA  ))
      2.560     0.820     0.820 peak   226 spectrum    1 weight  0.11000E+01 volume  0.36320E-02 ppm1      5.022 ppm2      5.644 CV     1
 ASSI {  227}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      2.600     0.840     0.840 peak   227 spectrum    1 weight  0.11000E+01 volume  0.35196E-02 ppm1      3.208 ppm2      5.645 CV     1
 OR {  227}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI {  228}
   (  segid "    " and resid 54   and name HG2%)
   (( segid "    " and resid 55   and name HA  ))
      3.650     1.660     1.660 peak   228 spectrum    1 weight  0.11000E+01 volume  0.69525E-03 ppm1      0.990 ppm2      5.646 CV     1
 ASSI {  229}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
      3.520     1.550     1.550 peak   229 spectrum    1 weight  0.11000E+01 volume  0.59642E-03 ppm1      2.946 ppm2      5.646 CV     1
 ASSI {  231}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.800     1.800     1.800 peak   231 spectrum    1 weight  0.11000E+01 volume  0.86085E-03 ppm1      8.392 ppm2      5.408 CV     1
 ASSI {  232}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HA  ))
      3.250     1.320     1.320 peak   232 spectrum    1 weight  0.11000E+01 volume  0.12835E-02 ppm1      7.592 ppm2      5.403 CV     1
 OR {  232}
   (( segid "    " and resid 46   and name HE3 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  233}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 46   and name HA  ))
      2.470     0.760     0.760 peak   233 spectrum    1 weight  0.11000E+01 volume  0.43578E-02 ppm1      4.509 ppm2      5.404 CV     1
 ASSI {  234}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HA  ))
      2.470     0.760     0.760 peak   234 spectrum    1 weight  0.11000E+01 volume  0.46463E-02 ppm1      3.344 ppm2      5.402 CV     1
 ASSI {  235}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.040     1.160     1.160 peak   235 spectrum    1 weight  0.11000E+01 volume  0.20432E-02 ppm1      3.189 ppm2      5.405 CV     1
 ASSI {  236}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      3.410     1.450     1.450 peak   236 spectrum    1 weight  0.11000E+01 volume  0.97448E-03 ppm1     -0.325 ppm2      5.404 CV     1
 ASSI {  237}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 57   and name HA  ))
      3.250     1.320     1.320 peak   237 spectrum    1 weight  0.11000E+01 volume  0.18836E-02 ppm1      0.394 ppm2      4.506 CV     1
 ASSI {  238}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HA  ))
      2.640     0.870     0.870 peak   238 spectrum    1 weight  0.11000E+01 volume  0.33669E-02 ppm1      2.887 ppm2      4.542 CV     1
 ASSI {  239}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 108  and name HA  ))
      2.560     0.820     0.820 peak   239 spectrum    1 weight  0.11000E+01 volume  0.51892E-02 ppm1      3.090 ppm2      4.543 CV     1
 ASSI {  241}
   (  segid "    " and resid 108  and name HD% )
   (( segid "    " and resid 108  and name HA  ))
      3.350     1.400     1.400 peak   241 spectrum    1 weight  0.11000E+01 volume  0.14913E-02 ppm1      7.163 ppm2      4.543 CV     1
 ASSI {  244}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.050     0.530     0.530 peak   244 spectrum    1 weight  0.11000E+01 volume  0.11840E-01 ppm1      8.389 ppm2      4.507 CV     1
 ASSI {  245}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.300     0.660     0.660 peak   245 spectrum    1 weight  0.11000E+01 volume  0.52443E-02 ppm1      8.044 ppm2      3.763 CV     1
 ASSI {  247}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HA  ))
      2.590     0.840     0.840 peak   247 spectrum    1 weight  0.11000E+01 volume  0.35369E-02 ppm1      1.550 ppm2      3.765 CV     1
 OR {  247}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  248}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HA  ))
      2.400     0.720     0.720 peak   248 spectrum    1 weight  0.11000E+01 volume  0.43153E-02 ppm1      1.893 ppm2      3.763 CV     1
 ASSI {  249}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
      2.990     1.120     1.120 peak   249 spectrum    1 weight  0.11000E+01 volume  0.26508E-02 ppm1      2.091 ppm2      3.761 CV     1
 ASSI {  250}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
      2.540     0.810     0.810 peak   250 spectrum    1 weight  0.11000E+01 volume  0.61976E-02 ppm1      2.575 ppm2      4.383 CV     1
 ASSI {  251}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HA  ))
      2.640     0.870     0.870 peak   251 spectrum    1 weight  0.11000E+01 volume  0.41094E-02 ppm1      2.740 ppm2      4.381 CV     1
 ASSI {  254}
   (( segid "    " and resid 53   and name HG1 ))
   (( segid "    " and resid 53   and name HA  ))
      2.470     0.760     0.760 peak   254 spectrum    1 weight  0.11000E+01 volume  0.34745E-02 ppm1      1.393 ppm2      4.160 CV     1
 ASSI {  255}
   (( segid "    " and resid 53   and name HG2 ))
   (( segid "    " and resid 53   and name HA  ))
      3.330     1.390     1.390 peak   255 spectrum    1 weight  0.11000E+01 volume  0.24053E-02 ppm1      1.265 ppm2      4.159 CV     1
 ASSI {  256}
   (  segid "    " and resid 48   and name HE% )
   (( segid "    " and resid 53   and name HA  ))
      2.950     1.090     1.090 peak   256 spectrum    1 weight  0.11000E+01 volume  0.13370E-02 ppm1      6.428 ppm2      4.160 CV     1
 ASSI {  260}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.130     1.220     1.220 peak   260 spectrum    1 weight  0.11000E+01 volume  0.12174E-02 ppm1      8.004 ppm2      5.442 CV     1
 ASSI {  261}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.380     1.430     1.430 peak   261 spectrum    1 weight  0.11000E+01 volume  0.10886E-02 ppm1      8.740 ppm2      5.443 CV     1
 ASSI {  262}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      2.310     0.670     0.670 peak   262 spectrum    1 weight  0.11000E+01 volume  0.58181E-02 ppm1      9.609 ppm2      5.442 CV     1
 ASSI {  264}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 83   and name HA  ))
      3.690     1.700     1.700 peak   264 spectrum    1 weight  0.11000E+01 volume  0.12222E-02 ppm1      1.480 ppm2      5.444 CV     1
 ASSI {  265}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HA  ))
      2.680     0.900     0.900 peak   265 spectrum    1 weight  0.11000E+01 volume  0.25009E-02 ppm1      2.797 ppm2      5.443 CV     1
 ASSI {  266}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HA  ))
      2.820     0.990     0.990 peak   266 spectrum    1 weight  0.11000E+01 volume  0.18288E-02 ppm1      3.026 ppm2      5.802 CV     1
 ASSI {  267}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      3.260     1.330     1.330 peak   267 spectrum    1 weight  0.11000E+01 volume  0.14175E-02 ppm1      3.316 ppm2      5.803 CV     1
 ASSI {  274}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HA  ))
      3.270     1.340     1.340 peak   274 spectrum    1 weight  0.11000E+01 volume  0.19537E-02 ppm1      2.586 ppm2      5.024 CV     1
 ASSI {  275}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      2.630     0.860     0.860 peak   275 spectrum    1 weight  0.11000E+01 volume  0.24696E-02 ppm1      2.940 ppm2      5.024 CV     1
 ASSI {  277}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.340     0.680     0.680 peak   277 spectrum    1 weight  0.11000E+01 volume  0.63502E-02 ppm1      9.155 ppm2      5.322 CV     1
 ASSI {  278}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.440     1.480     1.480 peak   278 spectrum    1 weight  0.11000E+01 volume  0.98702E-03 ppm1      8.321 ppm2      5.320 CV     1
 ASSI {  279}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 91   and name HA  ))
      3.030     1.150     1.150 peak   279 spectrum    1 weight  0.11000E+01 volume  0.16911E-02 ppm1      6.984 ppm2      5.323 CV     1
 ASSI {  280}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 91   and name HA  ))
      3.680     1.690     1.690 peak   280 spectrum    1 weight  0.11000E+01 volume  0.83912E-03 ppm1      1.742 ppm2      5.320 CV     1
 ASSI {  281}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 91   and name HA  ))
      4.340     2.350     2.160 peak   281 spectrum    1 weight  0.11000E+01 volume  0.78001E-03 ppm1      0.740 ppm2      5.323 CV     1
 ASSI {  282}
   (( segid "    " and resid 5    and name HB1 ))
   (( segid "    " and resid 5    and name HA  ))
      2.680     0.900     0.900 peak   282 spectrum    1 weight  0.11000E+01 volume  0.56622E-02 ppm1      2.047 ppm2      4.943 CV     1
 ASSI {  283}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HA  ))
      2.810     0.990     0.990 peak   283 spectrum    1 weight  0.11000E+01 volume  0.21231E-02 ppm1      2.390 ppm2      4.943 CV     1
 ASSI {  284}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 5    and name HA  ))
      2.500     0.780     0.780 peak   284 spectrum    1 weight  0.11000E+01 volume  0.37960E-02 ppm1      5.458 ppm2      4.943 CV     1
 ASSI {  286}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.170     0.590     0.590 peak   286 spectrum    1 weight  0.11000E+01 volume  0.84416E-02 ppm1      9.243 ppm2      4.942 CV     1
 ASSI {  289}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 45   and name HA  ))
      3.140     1.240     1.240 peak   289 spectrum    1 weight  0.11000E+01 volume  0.14437E-02 ppm1      7.604 ppm2      4.714 CV     1
 ASSI {  290}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.220     0.620     0.620 peak   290 spectrum    1 weight  0.11000E+01 volume  0.95061E-02 ppm1      9.364 ppm2      4.714 CV     1
 ASSI {  292}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HA  ))
      2.480     0.770     0.770 peak   292 spectrum    1 weight  0.11000E+01 volume  0.54915E-02 ppm1      2.991 ppm2      4.618 CV     1
 OR {  292}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI {  293}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 3    and name HA  ))
      2.700     0.910     0.910 peak   293 spectrum    1 weight  0.11000E+01 volume  0.31087E-02 ppm1      4.060 ppm2      4.618 CV     1
 ASSI {  295}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.600     0.840     0.840 peak   295 spectrum    1 weight  0.11000E+01 volume  0.34104E-02 ppm1      9.094 ppm2      4.556 CV     1
 ASSI {  296}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.720     0.920     0.920 peak   296 spectrum    1 weight  0.11000E+01 volume  0.27625E-02 ppm1      8.150 ppm2      4.560 CV     1
 ASSI {  297}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      2.640     0.870     0.870 peak   297 spectrum    1 weight  0.11000E+01 volume  0.36322E-02 ppm1      2.069 ppm2      4.558 CV     1
 ASSI {  298}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HA  ))
      2.830     1.000     1.000 peak   298 spectrum    1 weight  0.11000E+01 volume  0.63912E-02 ppm1      2.502 ppm2      4.557 CV     1
 ASSI {  299}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 59   and name HA  ))
      3.190     1.280     1.280 peak   299 spectrum    1 weight  0.11000E+01 volume  0.28974E-02 ppm1      3.812 ppm2      4.559 CV     1
 ASSI {  300}
   (( segid "    " and resid 95   and name HB1 ))
   (( segid "    " and resid 95   and name HA  ))
      2.430     0.740     0.740 peak   300 spectrum    1 weight  0.11000E+01 volume  0.59264E-02 ppm1      2.711 ppm2      4.455 CV     1
 ASSI {  301}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 95   and name HA  ))
      2.730     0.930     0.930 peak   301 spectrum    1 weight  0.11000E+01 volume  0.33296E-02 ppm1      3.282 ppm2      4.455 CV     1
 ASSI {  302}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.550     0.810     0.810 peak   302 spectrum    1 weight  0.11000E+01 volume  0.47399E-02 ppm1      8.285 ppm2      4.466 CV     1
 ASSI {  303}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      2.350     0.690     0.690 peak   303 spectrum    1 weight  0.11000E+01 volume  0.10345E-01 ppm1      2.314 ppm2      4.506 CV     1
 ASSI {  304}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      2.690     0.910     0.910 peak   304 spectrum    1 weight  0.11000E+01 volume  0.31142E-02 ppm1      1.911 ppm2      4.506 CV     1
 ASSI {  305}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.190     0.600     0.600 peak   305 spectrum    1 weight  0.11000E+01 volume  0.93504E-02 ppm1      8.246 ppm2      4.370 CV     1
 ASSI {  306}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.360     0.700     0.700 peak   306 spectrum    1 weight  0.11000E+01 volume  0.79403E-02 ppm1      8.488 ppm2      4.401 CV     1
 ASSI {  307}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.190     0.600     0.600 peak   307 spectrum    1 weight  0.11000E+01 volume  0.76695E-02 ppm1      8.741 ppm2      4.289 CV     1
 ASSI {  308}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
      2.510     0.790     0.790 peak   308 spectrum    1 weight  0.11000E+01 volume  0.35626E-02 ppm1      5.444 ppm2      4.289 CV     1
 ASSI {  309}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
      2.330     0.680     0.680 peak   309 spectrum    1 weight  0.11000E+01 volume  0.46877E-02 ppm1      1.644 ppm2      4.290 CV     1
 ASSI {  310}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.050     1.160     1.160 peak   310 spectrum    1 weight  0.11000E+01 volume  0.21992E-02 ppm1      1.140 ppm2      4.288 CV     1
 ASSI {  311}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      2.760     0.960     0.960 peak   311 spectrum    1 weight  0.11000E+01 volume  0.29826E-02 ppm1      2.822 ppm2      4.087 CV     1
 ASSI {  312}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      2.970     1.100     1.100 peak   312 spectrum    1 weight  0.11000E+01 volume  0.20625E-02 ppm1      2.554 ppm2      4.087 CV     1
 ASSI {  313}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      2.590     0.840     0.840 peak   313 spectrum    1 weight  0.11000E+01 volume  0.41081E-02 ppm1      0.789 ppm2      3.841 CV     1
 ASSI {  314}
   (  segid "    " and resid 37   and name HB% )
   (( segid "    " and resid 37   and name HA  ))
      2.250     0.630     0.630 peak   314 spectrum    1 weight  0.11000E+01 volume  0.87374E-02 ppm1      1.864 ppm2      3.841 CV     1
 ASSI {  315}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 37   and name HA  ))
      3.120     1.210     1.210 peak   315 spectrum    1 weight  0.11000E+01 volume  0.14369E-02 ppm1      6.997 ppm2      3.841 CV     1
 ASSI {  316}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.700     0.910     0.910 peak   316 spectrum    1 weight  0.11000E+01 volume  0.29215E-02 ppm1      9.214 ppm2      3.841 CV     1
 ASSI {  318}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 29   and name HA  ))
      2.650     0.880     0.880 peak   318 spectrum    1 weight  0.11000E+01 volume  0.29269E-02 ppm1      1.793 ppm2      3.117 CV     1
 ASSI {  319}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
      2.720     0.920     0.920 peak   319 spectrum    1 weight  0.11000E+01 volume  0.34113E-02 ppm1      1.297 ppm2      3.117 CV     1
 ASSI {  321}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
      2.230     0.620     0.620 peak   321 spectrum    1 weight  0.11000E+01 volume  0.99462E-02 ppm1      0.500 ppm2      3.117 CV     1
 ASSI {  324}
   (( segid "    " and resid 33   and name HZ  ))
   (( segid "    " and resid 7    and name HA  ))
      3.150     1.240     1.240 peak   324 spectrum    1 weight  0.11000E+01 volume  0.17509E-02 ppm1      7.190 ppm2      5.231 CV     1
 ASSI {  325}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
      2.750     0.950     0.950 peak   325 spectrum    1 weight  0.11000E+01 volume  0.28457E-02 ppm1      1.207 ppm2      5.231 CV     1
 ASSI {  326}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      2.610     0.850     0.850 peak   326 spectrum    1 weight  0.11000E+01 volume  0.29317E-02 ppm1      1.906 ppm2      5.229 CV     1
 ASSI {  327}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      2.070     0.530     0.530 peak   327 spectrum    1 weight  0.11000E+01 volume  0.12597E-01 ppm1      8.157 ppm2      4.472 CV     1
 ASSI {  329}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      2.370     0.700     0.700 peak   329 spectrum    1 weight  0.11000E+01 volume  0.73832E-02 ppm1      1.458 ppm2      4.472 CV     1
 ASSI {  332}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HA  ))
      2.720     0.920     0.920 peak   332 spectrum    1 weight  0.11000E+01 volume  0.35174E-02 ppm1      1.874 ppm2      5.462 CV     1
 ASSI {  333}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 18   and name HA  ))
      2.550     0.810     0.810 peak   333 spectrum    1 weight  0.11000E+01 volume  0.35605E-02 ppm1      0.789 ppm2      5.614 CV     1
 ASSI {  334}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
      2.410     0.730     0.730 peak   334 spectrum    1 weight  0.11000E+01 volume  0.43438E-02 ppm1      4.336 ppm2      5.614 CV     1
 ASSI {  338}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 27   and name HA  ))
      3.090     1.190     1.190 peak   338 spectrum    1 weight  0.11000E+01 volume  0.26455E-02 ppm1      1.841 ppm2      3.982 CV     1
 ASSI {  340}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 26   and name HA  ))
      2.630     0.860     0.860 peak   340 spectrum    1 weight  0.11000E+01 volume  0.37322E-02 ppm1      0.484 ppm2      3.514 CV     1
 ASSI {  342}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 26   and name HA  ))
      2.850     1.010     1.010 peak   342 spectrum    1 weight  0.11000E+01 volume  0.24705E-02 ppm1      6.966 ppm2      3.514 CV     1
 ASSI {  343}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      2.910     1.060     1.060 peak   343 spectrum    1 weight  0.11000E+01 volume  0.21150E-02 ppm1      8.416 ppm2      3.514 CV     1
 ASSI {  346}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HA  ))
      2.600     0.850     0.850 peak   346 spectrum    1 weight  0.11000E+01 volume  0.35644E-02 ppm1      1.666 ppm2      4.081 CV     1
 OR {  346}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  349}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 81   and name HA  ))
      2.390     0.720     0.720 peak   349 spectrum    1 weight  0.11000E+01 volume  0.52002E-02 ppm1      1.753 ppm2      4.589 CV     1
 ASSI {  354}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HA  ))
      2.500     0.780     0.780 peak   354 spectrum    1 weight  0.11000E+01 volume  0.31893E-02 ppm1      0.783 ppm2      4.521 CV     1
 ASSI {  355}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HA  ))
      2.210     0.610     0.610 peak   355 spectrum    1 weight  0.11000E+01 volume  0.52217E-02 ppm1      1.360 ppm2      4.521 CV     1
 ASSI {  356}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
      2.290     0.650     0.650 peak   356 spectrum    1 weight  0.11000E+01 volume  0.71432E-02 ppm1      8.039 ppm2      4.655 CV     1
 ASSI {  357}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HA  ))
      3.050     1.160     1.160 peak   357 spectrum    1 weight  0.11000E+01 volume  0.24532E-02 ppm1      2.460 ppm2      4.654 CV     1
 ASSI {  358}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.250     0.630     0.630 peak   358 spectrum    1 weight  0.11000E+01 volume  0.82539E-02 ppm1      3.903 ppm2      4.610 CV     1
 ASSI {  359}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 72   and name HA  ))
      2.300     0.660     0.660 peak   359 spectrum    1 weight  0.11000E+01 volume  0.66187E-02 ppm1      3.543 ppm2      4.610 CV     1
 ASSI {  360}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      2.760     0.950     0.950 peak   360 spectrum    1 weight  0.11000E+01 volume  0.42768E-02 ppm1      2.706 ppm2      4.621 CV     1
 ASSI {  361}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.790     0.970     0.970 peak   361 spectrum    1 weight  0.11000E+01 volume  0.30085E-02 ppm1      2.326 ppm2      4.610 CV     1
 ASSI {  362}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.570     0.830     0.830 peak   362 spectrum    1 weight  0.11000E+01 volume  0.58019E-02 ppm1      1.985 ppm2      4.609 CV     1
 ASSI {  363}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HA  ))
      2.410     0.730     0.730 peak   363 spectrum    1 weight  0.11000E+01 volume  0.49691E-02 ppm1      1.982 ppm2      4.653 CV     1
 ASSI {  364}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
      2.430     0.740     0.740 peak   364 spectrum    1 weight  0.11000E+01 volume  0.46803E-02 ppm1      1.475 ppm2      5.157 CV     1
 ASSI {  365}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
      2.810     0.990     0.990 peak   365 spectrum    1 weight  0.11000E+01 volume  0.39801E-02 ppm1      1.750 ppm2      5.156 CV     1
 ASSI {  366}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HA  ))
      2.410     0.730     0.730 peak   366 spectrum    1 weight  0.11000E+01 volume  0.40474E-02 ppm1      1.913 ppm2      5.156 CV     1
 ASSI {  369}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HA  ))
      2.620     0.860     0.860 peak   369 spectrum    1 weight  0.11000E+01 volume  0.26325E-02 ppm1     -0.080 ppm2      4.315 CV     1
 ASSI {  370}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HA  ))
      2.820     0.990     0.990 peak   370 spectrum    1 weight  0.11000E+01 volume  0.32926E-02 ppm1      1.043 ppm2      4.317 CV     1
 ASSI {  371}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.780     0.960     0.960 peak   371 spectrum    1 weight  0.11000E+01 volume  0.47808E-02 ppm1      1.354 ppm2      4.316 CV     1
 ASSI {  373}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
      2.600     0.840     0.840 peak   373 spectrum    1 weight  0.11000E+01 volume  0.24938E-02 ppm1      1.398 ppm2      4.131 CV     1
 ASSI {  374}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      2.790     0.970     0.970 peak   374 spectrum    1 weight  0.11000E+01 volume  0.31736E-02 ppm1      1.767 ppm2      4.133 CV     1
 ASSI {  377}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 8    and name HA  ))
      2.960     1.100     1.100 peak   377 spectrum    1 weight  0.11000E+01 volume  0.24116E-02 ppm1     -1.108 ppm2      4.976 CV     1
 ASSI {  379}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
      2.590     0.840     0.840 peak   379 spectrum    1 weight  0.11000E+01 volume  0.24914E-02 ppm1      0.794 ppm2      4.974 CV     1
 ASSI {  380}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      2.540     0.810     0.810 peak   380 spectrum    1 weight  0.11000E+01 volume  0.44798E-02 ppm1      2.633 ppm2      4.910 CV     1
 ASSI {  382}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      2.190     0.600     0.600 peak   382 spectrum    1 weight  0.11000E+01 volume  0.71028E-02 ppm1      9.109 ppm2      4.975 CV     1
 ASSI {  383}
   (  segid "    " and resid 15   and name HD1%)
   (( segid "    " and resid 15   and name HG  ))
      2.600     0.850     0.850 peak   383 spectrum    1 weight  0.11000E+01 volume  0.36387E-02 ppm1      0.892 ppm2      1.214 CV     1
 ASSI {  384}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 25   and name HA  ))
      2.300     0.660     0.660 peak   384 spectrum    1 weight  0.11000E+01 volume  0.92762E-02 ppm1      3.026 ppm2      4.672 CV     1
 OR {  384}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  385}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
      2.740     0.940     0.940 peak   385 spectrum    1 weight  0.11000E+01 volume  0.28091E-02 ppm1      2.289 ppm2      4.634 CV     1
 ASSI {  386}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HA  ))
      3.020     1.140     1.140 peak   386 spectrum    1 weight  0.11000E+01 volume  0.22081E-02 ppm1      2.611 ppm2      4.632 CV     1
 ASSI {  388}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HA  ))
      3.810     1.820     1.820 peak   388 spectrum    1 weight  0.11000E+01 volume  0.20516E-02 ppm1      1.771 ppm2      4.247 CV     1
 ASSI {  389}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 64   and name HA  ))
      2.820     1.000     1.000 peak   389 spectrum    1 weight  0.11000E+01 volume  0.27087E-02 ppm1      1.431 ppm2      4.368 CV     1
 ASSI {  391}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.850     1.020     1.020 peak   391 spectrum    1 weight  0.11000E+01 volume  0.19568E-02 ppm1      7.980 ppm2      5.157 CV     1
 ASSI {  392}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.860     1.020     1.020 peak   392 spectrum    1 weight  0.11000E+01 volume  0.19580E-02 ppm1      8.151 ppm2      5.158 CV     1
 ASSI {  396}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 93   and name HA  ))
      2.730     0.930     0.930 peak   396 spectrum    1 weight  0.11000E+01 volume  0.27390E-02 ppm1      5.804 ppm2      3.663 CV     1
 ASSI {  398}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HA  ))
      2.820     0.990     0.990 peak   398 spectrum    1 weight  0.11000E+01 volume  0.19411E-02 ppm1      0.056 ppm2      3.663 CV     1
 ASSI {  399}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.070     0.530     0.530 peak   399 spectrum    1 weight  0.11000E+01 volume  0.12079E-01 ppm1      8.392 ppm2      4.247 CV     1
 ASSI {  400}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
      2.850     1.020     1.020 peak   400 spectrum    1 weight  0.11000E+01 volume  0.17887E-02 ppm1      3.204 ppm2      4.976 CV     1
 ASSI {  401}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      3.040     1.160     1.160 peak   401 spectrum    1 weight  0.11000E+01 volume  0.11634E-02 ppm1     10.313 ppm2      4.974 CV     1
 ASSI {  403}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 11   and name HA  ))
      2.890     1.040     1.040 peak   403 spectrum    1 weight  0.11000E+01 volume  0.26282E-02 ppm1      1.485 ppm2      5.270 CV     1
 ASSI {  404}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HA  ))
      2.520     0.790     0.790 peak   404 spectrum    1 weight  0.11000E+01 volume  0.39466E-02 ppm1      2.550 ppm2      5.270 CV     1
 ASSI {  405}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      2.760     0.950     0.950 peak   405 spectrum    1 weight  0.11000E+01 volume  0.34362E-02 ppm1      2.990 ppm2      5.270 CV     1
 ASSI {  407}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.890     1.040     1.040 peak   407 spectrum    1 weight  0.11000E+01 volume  0.19570E-02 ppm1      8.867 ppm2      5.271 CV     1
 ASSI {  408}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      3.110     1.210     1.210 peak   408 spectrum    1 weight  0.11000E+01 volume  0.11153E-02 ppm1      8.573 ppm2      4.976 CV     1
 ASSI {  409}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.780     0.970     0.970 peak   409 spectrum    1 weight  0.11000E+01 volume  0.25295E-02 ppm1      8.485 ppm2      4.911 CV     1
 ASSI {  410}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      2.540     0.810     0.810 peak   410 spectrum    1 weight  0.11000E+01 volume  0.36533E-02 ppm1      8.469 ppm2      4.885 CV     1
 ASSI {  413}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.250     1.320     1.320 peak   413 spectrum    1 weight  0.11000E+01 volume  0.10666E-02 ppm1      7.730 ppm2      4.633 CV     1
 ASSI {  414}
   (  segid "    " and resid 91   and name HE% )
   (( segid "    " and resid 103  and name HA  ))
      3.080     1.190     1.190 peak   414 spectrum    1 weight  0.11000E+01 volume  0.13395E-02 ppm1      7.135 ppm2      2.857 CV     1
 ASSI {  416}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      3.110     1.210     1.210 peak   416 spectrum    1 weight  0.11000E+01 volume  0.12720E-02 ppm1      8.204 ppm2      3.662 CV     1
 ASSI {  419}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HD2 ))
      1.750     0.380     0.450 peak   419 spectrum    1 weight  0.11000E+01 volume  0.16337E-01 ppm1      3.545 ppm2      3.906 CV     1
 ASSI {  420}
   (( segid "    " and resid 106  and name HD1 ))
   (( segid "    " and resid 106  and name HD2 ))
      1.740     0.380     0.460 peak   420 spectrum    1 weight  0.11000E+01 volume  0.17035E-01 ppm1      3.582 ppm2      3.818 CV     1
 ASSI {  421}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name HD2 ))
      2.370     0.700     0.700 peak   421 spectrum    1 weight  0.11000E+01 volume  0.57952E-02 ppm1      4.081 ppm2      3.818 CV     1
 ASSI {  423}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 77   and name HD2 ))
      1.850     0.430     0.430 peak   423 spectrum    1 weight  0.11000E+01 volume  0.12253E-01 ppm1      3.905 ppm2      3.650 CV     1
 ASSI {  425}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name HD1 ))
      2.360     0.700     0.700 peak   425 spectrum    1 weight  0.11000E+01 volume  0.54160E-02 ppm1      4.080 ppm2      3.578 CV     1
 ASSI {  426}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 103  and name HA  ))
      2.510     0.790     0.790 peak   426 spectrum    1 weight  0.11000E+01 volume  0.37731E-02 ppm1      2.319 ppm2      2.859 CV     1
 ASSI {  427}
   (( segid "    " and resid 104  and name HD1 ))
   (( segid "    " and resid 103  and name HA  ))
      2.450     0.750     0.750 peak   427 spectrum    1 weight  0.11000E+01 volume  0.49167E-02 ppm1      2.576 ppm2      2.860 CV     1
 ASSI {  428}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 77   and name HD2 ))
      2.800     0.980     0.980 peak   428 spectrum    1 weight  0.11000E+01 volume  0.35595E-02 ppm1      4.704 ppm2      3.651 CV     1
 ASSI {  429}
   (( segid "    " and resid 77   and name HG2 ))
   (( segid "    " and resid 77   and name HD1 ))
      2.550     0.810     0.810 peak   429 spectrum    1 weight  0.11000E+01 volume  0.74527E-02 ppm1      2.051 ppm2      3.907 CV     1
 ASSI {  430}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HA  ))
      3.060     1.170     1.170 peak   430 spectrum    1 weight  0.11000E+01 volume  0.19824E-02 ppm1      1.976 ppm2      3.663 CV     1
 ASSI {  431}
   (( segid "    " and resid 77   and name HG2 ))
   (( segid "    " and resid 77   and name HD2 ))
      2.430     0.740     0.740 peak   431 spectrum    1 weight  0.11000E+01 volume  0.38207E-02 ppm1      2.068 ppm2      3.650 CV     1
 ASSI {  432}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 106  and name HD1 ))
      2.220     0.610     0.610 peak   432 spectrum    1 weight  0.11000E+01 volume  0.62249E-02 ppm1      2.026 ppm2      3.572 CV     1
 ASSI {  433}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 77   and name HD2 ))
      3.080     1.180     1.180 peak   433 spectrum    1 weight  0.11000E+01 volume  0.15830E-02 ppm1      1.853 ppm2      3.647 CV     1
 ASSI {  434}
   (( segid "    " and resid 76   and name HD2 ))
   (( segid "    " and resid 76   and name HD1 ))
      1.830     0.420     0.420 peak   434 spectrum    1 weight  0.11000E+01 volume  0.85497E-02 ppm1      2.678 ppm2      3.236 CV     1
 ASSI {  435}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HD2 ))
      3.410     1.450     1.450 peak   435 spectrum    1 weight  0.11000E+01 volume  0.23296E-02 ppm1      2.412 ppm2      3.647 CV     1
 ASSI {  436}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HD1 ))
      3.190     1.270     1.270 peak   436 spectrum    1 weight  0.11000E+01 volume  0.24884E-02 ppm1      2.394 ppm2      3.909 CV     1
 ASSI {  438}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 106  and name HD2 ))
      3.950     1.950     1.950 peak   438 spectrum    1 weight  0.11000E+01 volume  0.11815E-02 ppm1      1.663 ppm2      3.819 CV     1
 ASSI {  439}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 106  and name HD1 ))
      3.760     1.760     1.760 peak   439 spectrum    1 weight  0.11000E+01 volume  0.13728E-02 ppm1      1.668 ppm2      3.577 CV     1
 ASSI {  441}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HD1 ))
      2.160     0.580     0.580 peak   441 spectrum    1 weight  0.11000E+01 volume  0.48886E-02 ppm1      4.132 ppm2      3.235 CV     1
 ASSI {  442}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      3.870     1.870     1.870 peak   442 spectrum    1 weight  0.11000E+01 volume  0.15275E-02 ppm1      1.738 ppm2      5.271 CV     1
 ASSI {  443}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HA  ))
      3.830     1.830     1.830 peak   443 spectrum    1 weight  0.11000E+01 volume  0.91722E-03 ppm1      4.527 ppm2      5.271 CV     1
 ASSI {  444}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 16   and name HA  ))
      3.920     1.920     1.920 peak   444 spectrum    1 weight  0.11000E+01 volume  0.97692E-03 ppm1      0.799 ppm2      5.157 CV     1
 ASSI {  445}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HD2 ))
      3.090     1.190     1.190 peak   445 spectrum    1 weight  0.11000E+01 volume  0.31376E-02 ppm1      4.134 ppm2      2.683 CV     1
 ASSI {  446}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HD1 ))
      2.990     1.120     1.120 peak   446 spectrum    1 weight  0.11000E+01 volume  0.19820E-02 ppm1      1.240 ppm2      3.236 CV     1
 ASSI {  447}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 76   and name HD1 ))
      3.240     1.310     1.310 peak   447 spectrum    1 weight  0.11000E+01 volume  0.15942E-02 ppm1      1.411 ppm2      3.235 CV     1
 ASSI {  448}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HD1 ))
      2.490     0.780     0.780 peak   448 spectrum    1 weight  0.11000E+01 volume  0.27489E-02 ppm1      1.649 ppm2      3.235 CV     1
 ASSI {  449}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HD1 ))
      3.940     1.940     1.940 peak   449 spectrum    1 weight  0.11000E+01 volume  0.16383E-02 ppm1      1.779 ppm2      3.236 CV     1
 ASSI {  450}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HD2 ))
      2.640     0.870     0.870 peak   450 spectrum    1 weight  0.11000E+01 volume  0.19249E-02 ppm1      1.243 ppm2      2.683 CV     1
 ASSI {  451}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 76   and name HD2 ))
      2.670     0.890     0.890 peak   451 spectrum    1 weight  0.11000E+01 volume  0.18662E-02 ppm1      1.407 ppm2      2.683 CV     1
 ASSI {  452}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HD2 ))
      3.240     1.310     1.310 peak   452 spectrum    1 weight  0.11000E+01 volume  0.20659E-02 ppm1      1.646 ppm2      2.683 CV     1
 ASSI {  453}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HD2 ))
      3.800     1.800     1.800 peak   453 spectrum    1 weight  0.11000E+01 volume  0.17780E-02 ppm1      1.788 ppm2      2.682 CV     1
 ASSI {  456}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HD2 ))
      3.820     1.830     1.830 peak   456 spectrum    1 weight  0.11000E+01 volume  0.13075E-02 ppm1      0.536 ppm2      2.358 CV     1
 ASSI {  457}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HD1 ))
      4.020     2.020     2.020 peak   457 spectrum    1 weight  0.11000E+01 volume  0.10546E-02 ppm1      0.764 ppm2      2.568 CV     1
 ASSI {  458}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HD2 ))
      4.330     2.350     2.170 peak   458 spectrum    1 weight  0.11000E+01 volume  0.71961E-03 ppm1      0.773 ppm2      2.357 CV     1
 ASSI {  460}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 104  and name HD1 ))
      2.100     0.550     0.550 peak   460 spectrum    1 weight  0.11000E+01 volume  0.50228E-02 ppm1      2.352 ppm2      2.567 CV     1
 ASSI {  467}
   (( segid "    " and resid 44   and name HA1 ))
   (( segid "    " and resid 44   and name HA2 ))
      1.690     0.360     0.510 peak   467 spectrum    1 weight  0.11000E+01 volume  0.23042E-01 ppm1      4.259 ppm2      3.807 CV     1
 ASSI {  468}
   (( segid "    " and resid 87   and name HA2 ))
   (( segid "    " and resid 87   and name HA1 ))
      1.890     0.450     0.450 peak   468 spectrum    1 weight  0.11000E+01 volume  0.13077E-01 ppm1      4.280 ppm2      3.729 CV     1
 ASSI {  472}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA1 ))
      2.450     0.750     0.750 peak   472 spectrum    1 weight  0.11000E+01 volume  0.47925E-02 ppm1      8.037 ppm2      4.251 CV     1
 ASSI {  475}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 44   and name HA1 ))
      3.190     1.270     1.270 peak   475 spectrum    1 weight  0.11000E+01 volume  0.96320E-03 ppm1     -0.338 ppm2      4.250 CV     1
 ASSI {  477}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA1 ))
      3.490     1.520     1.520 peak   477 spectrum    1 weight  0.11000E+01 volume  0.12609E-02 ppm1      8.998 ppm2      3.817 CV     1
 ASSI {  478}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA2 ))
      3.110     1.210     1.210 peak   478 spectrum    1 weight  0.11000E+01 volume  0.10296E-02 ppm1      8.998 ppm2      4.295 CV     1
 ASSI {  479}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HA1 ))
      3.200     1.280     1.280 peak   479 spectrum    1 weight  0.11000E+01 volume  0.11208E-02 ppm1      7.731 ppm2      3.825 CV     1
 ASSI {  482}
   (( segid "    " and resid 107  and name HA2 ))
   (( segid "    " and resid 107  and name HA1 ))
      1.830     0.420     0.420 peak   482 spectrum    1 weight  0.11000E+01 volume  0.16807E-01 ppm1      3.980 ppm2      3.715 CV     1
 ASSI {  483}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 17   and name HA2 ))
      1.740     0.380     0.460 peak   483 spectrum    1 weight  0.11000E+01 volume  0.20688E-01 ppm1      4.323 ppm2      4.156 CV     1
 ASSI {  484}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 12   and name HA2 ))
      1.810     0.410     0.410 peak   484 spectrum    1 weight  0.11000E+01 volume  0.13540E-01 ppm1      4.070 ppm2      4.493 CV     1
 ASSI {  491}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HE3 ))
      2.800     0.980     0.980 peak   491 spectrum    1 weight  0.11000E+01 volume  0.17022E-02 ppm1      3.037 ppm2      7.291 CV     1
 ASSI {  494}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 89   and name HD2 ))
      2.600     0.840     0.840 peak   494 spectrum    1 weight  0.11000E+01 volume  0.23169E-02 ppm1      0.953 ppm2      3.159 CV     1
 ASSI {  495}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HD1 ))
      2.550     0.810     0.810 peak   495 spectrum    1 weight  0.11000E+01 volume  0.27203E-02 ppm1      1.138 ppm2      3.220 CV     1
 ASSI {  496}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HD2 ))
      3.010     1.140     1.140 peak   496 spectrum    1 weight  0.11000E+01 volume  0.25933E-02 ppm1      1.136 ppm2      3.158 CV     1
 ASSI {  497}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HD1 ))
      2.270     0.640     0.640 peak   497 spectrum    1 weight  0.11000E+01 volume  0.73042E-02 ppm1      1.547 ppm2      3.201 CV     1
 ASSI {  498}
   (  segid "    " and resid 15   and name HD2%)
   (( segid "    " and resid 15   and name HB2 ))
      2.520     0.800     0.800 peak   498 spectrum    1 weight  0.11000E+01 volume  0.51633E-02 ppm1      0.839 ppm2      1.569 CV     1
 ASSI {  499}
   (  segid "    " and resid 15   and name HD2%)
   (( segid "    " and resid 15   and name HB1 ))
      2.770     0.960     0.960 peak   499 spectrum    1 weight  0.11000E+01 volume  0.50980E-02 ppm1      0.843 ppm2      1.456 CV     1
 ASSI {  500}
   (  segid "    " and resid 91   and name HE% )
   (( segid "    " and resid 89   and name HD2 ))
      3.540     1.560     1.560 peak   500 spectrum    1 weight  0.11000E+01 volume  0.13024E-02 ppm1      7.149 ppm2      3.161 CV     1
 ASSI {  505}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HD2 ))
      3.140     1.230     1.230 peak   505 spectrum    1 weight  0.11000E+01 volume  0.19191E-02 ppm1      2.080 ppm2      3.165 CV     1
 ASSI {  506}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HB1 ))
      1.830     0.420     0.420 peak   506 spectrum    1 weight  0.11000E+01 volume  0.94057E-02 ppm1      0.782 ppm2     -1.111 CV     1
 ASSI {  509}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HD1 ))
      3.120     1.220     1.220 peak   509 spectrum    1 weight  0.11000E+01 volume  0.17145E-02 ppm1      1.895 ppm2      3.201 CV     1
 ASSI {  510}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HD2 ))
      3.020     1.140     1.140 peak   510 spectrum    1 weight  0.11000E+01 volume  0.17747E-02 ppm1      1.895 ppm2      3.164 CV     1
 ASSI {  511}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HB2 ))
      1.940     0.470     0.470 peak   511 spectrum    1 weight  0.11000E+01 volume  0.81898E-02 ppm1      2.814 ppm2      3.323 CV     1
 ASSI {  513}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.930     1.070     1.070 peak   513 spectrum    1 weight  0.11000E+01 volume  0.25178E-02 ppm1      4.907 ppm2      2.741 CV     1
 ASSI {  516}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HD2 ))
      2.950     1.090     1.090 peak   516 spectrum    1 weight  0.11000E+01 volume  0.13015E-02 ppm1      4.135 ppm2      2.796 CV     1
 ASSI {  517}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB1 ))
      2.720     0.920     0.920 peak   517 spectrum    1 weight  0.11000E+01 volume  0.25383E-02 ppm1      5.423 ppm2      2.803 CV     1
 ASSI {  520}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HB2 ))
      1.850     0.430     0.430 peak   520 spectrum    1 weight  0.11000E+01 volume  0.14987E-01 ppm1      2.620 ppm2      2.288 CV     1
 ASSI {  522}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 105  and name HD2 ))
      1.950     0.470     0.470 peak   522 spectrum    1 weight  0.11000E+01 volume  0.71622E-02 ppm1      2.461 ppm2      2.794 CV     1
 ASSI {  523}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HD2 ))
      2.900     1.050     1.050 peak   523 spectrum    1 weight  0.11000E+01 volume  0.32999E-02 ppm1      1.702 ppm2      2.797 CV     1
 OR {  523}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  524}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HD1 ))
      3.210     1.290     1.290 peak   524 spectrum    1 weight  0.11000E+01 volume  0.26505E-02 ppm1      1.694 ppm2      2.473 CV     1
 ASSI {  525}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 6    and name HB1 ))
      3.120     1.220     1.220 peak   525 spectrum    1 weight  0.11000E+01 volume  0.26596E-02 ppm1      0.517 ppm2      2.811 CV     1
 ASSI {  526}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HD2 ))
      2.850     1.020     1.020 peak   526 spectrum    1 weight  0.11000E+01 volume  0.19853E-02 ppm1      1.138 ppm2      2.797 CV     1
 OR {  526}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  528}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HD2 ))
      2.870     1.030     1.030 peak   528 spectrum    1 weight  0.11000E+01 volume  0.16931E-02 ppm1      0.753 ppm2      2.796 CV     1
 ASSI {  529}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HD1 ))
      3.410     1.450     1.450 peak   529 spectrum    1 weight  0.11000E+01 volume  0.71432E-03 ppm1      0.761 ppm2      2.471 CV     1
 ASSI {  530}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 6    and name HB2 ))
      2.850     1.010     1.010 peak   530 spectrum    1 weight  0.11000E+01 volume  0.18095E-02 ppm1      0.507 ppm2      3.323 CV     1
 ASSI {  531}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HE1 ))
      2.460     0.760     0.760 peak   531 spectrum    1 weight  0.11000E+01 volume  0.66591E-02 ppm1      1.435 ppm2      3.021 CV     1
 ASSI {  532}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HE2 ))
      2.440     0.740     0.740 peak   532 spectrum    1 weight  0.11000E+01 volume  0.53561E-02 ppm1      1.393 ppm2      2.975 CV     1
 OR {  532}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HE2 ))
 ASSI {  535}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 79   and name HE3 ))
      3.360     1.410     1.410 peak   535 spectrum    1 weight  0.11000E+01 volume  0.41260E-03 ppm1      1.547 ppm2      7.292 CV     1
 ASSI {  536}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 12   and name HA2 ))
      3.350     1.400     1.400 peak   536 spectrum    1 weight  0.11000E+01 volume  0.98684E-03 ppm1      8.151 ppm2      4.491 CV     1
 ASSI {  537}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 12   and name HA1 ))
      4.380     2.400     2.120 peak   537 spectrum    1 weight  0.11000E+01 volume  0.50412E-03 ppm1      8.161 ppm2      4.077 CV     1
 ASSI {  538}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 12   and name HA2 ))
      4.770     2.850     1.730 peak   538 spectrum    1 weight  0.11000E+01 volume  0.32445E-03 ppm1      7.376 ppm2      4.489 CV     1
 ASSI {  540}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HD1 ))
      4.790     2.870     1.710 peak   540 spectrum    1 weight  0.11000E+01 volume  0.45334E-03 ppm1      8.746 ppm2      3.220 CV     1
 ASSI {  541}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HD2 ))
      4.740     2.800     1.760 peak   541 spectrum    1 weight  0.11000E+01 volume  0.50741E-03 ppm1      8.754 ppm2      3.158 CV     1
 ASSI {  542}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB2 ))
      4.630     2.680     1.870 peak   542 spectrum    1 weight  0.11000E+01 volume  0.48921E-03 ppm1      8.153 ppm2      1.568 CV     1
 ASSI {  543}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      4.120     2.120     2.120 peak   543 spectrum    1 weight  0.11000E+01 volume  0.56568E-03 ppm1      8.155 ppm2      1.449 CV     1
 ASSI {  544}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA2 ))
      3.260     1.330     1.330 peak   544 spectrum    1 weight  0.11000E+01 volume  0.12129E-02 ppm1      8.825 ppm2      4.119 CV     1
 ASSI {  545}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 87   and name HA1 ))
      4.250     2.260     2.250 peak   545 spectrum    1 weight  0.11000E+01 volume  0.57651E-03 ppm1      6.867 ppm2      3.721 CV     1
 ASSI {  546}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 87   and name HA2 ))
      3.730     1.730     1.730 peak   546 spectrum    1 weight  0.11000E+01 volume  0.46402E-03 ppm1      6.879 ppm2      4.289 CV     1
 ASSI {  548}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 12   and name HA1 ))
      3.640     1.660     1.660 peak   548 spectrum    1 weight  0.11000E+01 volume  0.11439E-02 ppm1      2.070 ppm2      4.060 CV     1
 ASSI {  550}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 12   and name HA1 ))
      3.190     1.270     1.270 peak   550 spectrum    1 weight  0.11000E+01 volume  0.99242E-03 ppm1      0.675 ppm2      4.061 CV     1
 ASSI {  551}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 12   and name HA2 ))
      4.170     2.170     2.170 peak   551 spectrum    1 weight  0.11000E+01 volume  0.73416E-03 ppm1      0.840 ppm2      4.492 CV     1
 ASSI {  552}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 12   and name HA1 ))
      3.100     1.200     1.200 peak   552 spectrum    1 weight  0.11000E+01 volume  0.10525E-02 ppm1      0.842 ppm2      4.061 CV     1
 ASSI {  553}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 17   and name HA2 ))
      3.820     1.820     1.820 peak   553 spectrum    1 weight  0.11000E+01 volume  0.10785E-02 ppm1      0.791 ppm2      4.152 CV     1
 ASSI {  554}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 17   and name HA2 ))
      4.060     2.060     2.060 peak   554 spectrum    1 weight  0.11000E+01 volume  0.71818E-03 ppm1      1.453 ppm2      4.151 CV     1
 ASSI {  555}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 44   and name HA1 ))
      3.880     1.880     1.880 peak   555 spectrum    1 weight  0.11000E+01 volume  0.54672E-03 ppm1      2.454 ppm2      4.237 CV     1
 OR {  555}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 44   and name HA1 ))
 ASSI {  556}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 12   and name HA2 ))
      3.120     1.220     1.220 peak   556 spectrum    1 weight  0.11000E+01 volume  0.20900E-02 ppm1      2.182 ppm2      4.487 CV     1
 ASSI {  557}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 12   and name HA2 ))
      3.280     1.350     1.350 peak   557 spectrum    1 weight  0.11000E+01 volume  0.89804E-03 ppm1      2.468 ppm2      4.490 CV     1
 ASSI {  558}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 17   and name HA1 ))
      3.210     1.290     1.290 peak   558 spectrum    1 weight  0.11000E+01 volume  0.54395E-03 ppm1      2.114 ppm2      4.327 CV     1
 ASSI {  559}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 17   and name HA1 ))
      3.600     1.620     1.620 peak   559 spectrum    1 weight  0.11000E+01 volume  0.61441E-03 ppm1      1.451 ppm2      4.327 CV     1
 ASSI {  560}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 17   and name HA1 ))
      3.360     1.410     1.410 peak   560 spectrum    1 weight  0.11000E+01 volume  0.70868E-03 ppm1      0.796 ppm2      4.323 CV     1
 ASSI {  561}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 44   and name HA2 ))
      4.550     2.590     1.950 peak   561 spectrum    1 weight  0.11000E+01 volume  0.58822E-03 ppm1      2.033 ppm2      3.804 CV     1
 ASSI {  562}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 44   and name HA2 ))
      4.210     2.210     2.210 peak   562 spectrum    1 weight  0.11000E+01 volume  0.61376E-03 ppm1      2.445 ppm2      3.810 CV     1
 OR {  562}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 44   and name HA2 ))
 ASSI {  563}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 6    and name HB2 ))
      2.460     0.760     0.760 peak   563 spectrum    1 weight  0.11000E+01 volume  0.43342E-02 ppm1      7.189 ppm2      3.323 CV     1
 ASSI {  564}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 6    and name HB1 ))
      2.550     0.810     0.810 peak   564 spectrum    1 weight  0.11000E+01 volume  0.38853E-02 ppm1      7.193 ppm2      2.812 CV     1
 ASSI {  565}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HB1 ))
      2.680     0.900     0.900 peak   565 spectrum    1 weight  0.11000E+01 volume  0.52918E-02 ppm1      0.785 ppm2      1.368 CV     1
 OR {  565}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 10   and name HB1 ))
 ASSI {  567}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 8    and name HB2 ))
      3.380     1.430     1.430 peak   567 spectrum    1 weight  0.11000E+01 volume  0.29256E-02 ppm1      0.383 ppm2      0.776 CV     1
 ASSI {  568}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 8    and name HB2 ))
      2.580     0.830     0.830 peak   568 spectrum    1 weight  0.11000E+01 volume  0.40907E-02 ppm1      0.589 ppm2      0.775 CV     1
 ASSI {  576}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      3.140     1.230     1.230 peak   576 spectrum    1 weight  0.11000E+01 volume  0.15652E-02 ppm1      8.490 ppm2      2.626 CV     1
 ASSI {  580}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      3.970     1.970     1.970 peak   580 spectrum    1 weight  0.11000E+01 volume  0.13902E-02 ppm1      8.455 ppm2      1.369 CV     1
 ASSI {  585}
   (( segid "    " and resid 79   and name HZ3 ))
   (( segid "    " and resid 91   and name HB2 ))
      3.010     1.130     1.130 peak   585 spectrum    1 weight  0.11000E+01 volume  0.20998E-02 ppm1      6.767 ppm2      3.212 CV     1
 ASSI {  586}
   (( segid "    " and resid 79   and name HZ3 ))
   (( segid "    " and resid 91   and name HB1 ))
      3.180     1.270     1.270 peak   586 spectrum    1 weight  0.11000E+01 volume  0.12876E-02 ppm1      6.774 ppm2      3.140 CV     1
 ASSI {  587}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 91   and name HB2 ))
      2.790     0.970     0.970 peak   587 spectrum    1 weight  0.11000E+01 volume  0.25998E-02 ppm1      6.985 ppm2      3.213 CV     1
 ASSI {  588}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 91   and name HB1 ))
      2.700     0.910     0.910 peak   588 spectrum    1 weight  0.11000E+01 volume  0.24955E-02 ppm1      6.984 ppm2      3.142 CV     1
 ASSI {  590}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 91   and name HB1 ))
      2.960     1.100     1.100 peak   590 spectrum    1 weight  0.11000E+01 volume  0.13014E-02 ppm1      7.289 ppm2      3.142 CV     1
 ASSI {  591}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HB1 ))
      2.430     0.740     0.740 peak   591 spectrum    1 weight  0.11000E+01 volume  0.45559E-02 ppm1      7.600 ppm2      3.207 CV     1
 OR {  591}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HB2 ))
 ASSI {  592}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      2.610     0.850     0.850 peak   592 spectrum    1 weight  0.11000E+01 volume  0.25571E-02 ppm1      9.118 ppm2      3.211 CV     1
 ASSI {  593}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      3.750     1.760     1.760 peak   593 spectrum    1 weight  0.11000E+01 volume  0.15335E-02 ppm1      9.114 ppm2      3.144 CV     1
 ASSI {  597}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HE2 ))
      2.190     0.600     0.600 peak   597 spectrum    1 weight  0.11000E+01 volume  0.11824E-01 ppm1      1.708 ppm2      3.026 CV     1
 ASSI {  598}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HE1 ))
      2.750     0.940     0.940 peak   598 spectrum    1 weight  0.11000E+01 volume  0.31388E-02 ppm1      1.740 ppm2      2.951 CV     1
 ASSI {  599}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HB2 ))
      1.850     0.430     0.430 peak   599 spectrum    1 weight  0.11000E+01 volume  0.11608E-01 ppm1      2.580 ppm2      2.942 CV     1
 ASSI {  601}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 13   and name HE2 ))
      2.800     0.980     0.980 peak   601 spectrum    1 weight  0.11000E+01 volume  0.34624E-02 ppm1      1.450 ppm2      2.989 CV     1
 ASSI {  602}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HB1 ))
      2.790     0.970     0.970 peak   602 spectrum    1 weight  0.11000E+01 volume  0.25517E-02 ppm1      6.865 ppm2      2.798 CV     1
 ASSI {  603}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HB2 ))
      2.790     0.980     0.980 peak   603 spectrum    1 weight  0.11000E+01 volume  0.24168E-02 ppm1      6.862 ppm2      2.660 CV     1
 ASSI {  608}
   (  segid "    " and resid 108  and name HD% )
   (( segid "    " and resid 103  and name HB2 ))
      3.160     1.250     1.250 peak   608 spectrum    1 weight  0.11000E+01 volume  0.13521E-02 ppm1      7.141 ppm2      2.253 CV     1
 ASSI {  609}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HB1 ))
      1.880     0.440     0.440 peak   609 spectrum    1 weight  0.11000E+01 volume  0.13077E-01 ppm1      2.260 ppm2      2.610 CV     1
 ASSI {  610}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HB2 ))
      1.860     0.430     0.430 peak   610 spectrum    1 weight  0.11000E+01 volume  0.15302E-01 ppm1      2.822 ppm2      2.547 CV     1
 ASSI {  614}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HB1 ))
      1.810     0.410     0.410 peak   614 spectrum    1 weight  0.11000E+01 volume  0.14532E-01 ppm1      2.604 ppm2      2.805 CV     1
 ASSI {  616}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HE1 ))
      2.570     0.830     0.830 peak   616 spectrum    1 weight  0.11000E+01 volume  0.37532E-02 ppm1      1.511 ppm2      2.834 CV     1
 OR {  616}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 82   and name HE1 ))
 ASSI {  617}
   (( segid "    " and resid 31   and name HD1 ))
   (( segid "    " and resid 31   and name HE1 ))
      2.310     0.670     0.670 peak   617 spectrum    1 weight  0.11000E+01 volume  0.77158E-02 ppm1      1.623 ppm2      2.901 CV     1
 OR {  617}
   (( segid "    " and resid 31   and name HD2 ))
   (( segid "    " and resid 31   and name HE1 ))
 ASSI {  618}
   (( segid "    " and resid 31   and name HG1 ))
   (( segid "    " and resid 31   and name HE1 ))
      2.750     0.940     0.940 peak   618 spectrum    1 weight  0.11000E+01 volume  0.28054E-02 ppm1      1.343 ppm2      2.902 CV     1
 ASSI {  621}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      2.960     1.090     1.090 peak   621 spectrum    1 weight  0.11000E+01 volume  0.21180E-02 ppm1      2.863 ppm2      2.250 CV     1
 ASSI {  622}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HE2 ))
      3.060     1.170     1.170 peak   622 spectrum    1 weight  0.11000E+01 volume  0.12611E-02 ppm1      1.043 ppm2      2.929 CV     1
 ASSI {  623}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HE1 ))
      3.270     1.340     1.340 peak   623 spectrum    1 weight  0.11000E+01 volume  0.12752E-02 ppm1      1.043 ppm2      2.835 CV     1
 ASSI {  624}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HE2 ))
      3.410     1.460     1.460 peak   624 spectrum    1 weight  0.11000E+01 volume  0.10358E-02 ppm1      0.875 ppm2      2.929 CV     1
 ASSI {  625}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HE1 ))
      3.520     1.550     1.550 peak   625 spectrum    1 weight  0.11000E+01 volume  0.10358E-02 ppm1      0.876 ppm2      2.835 CV     1
 ASSI {  626}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 82   and name HE2 ))
      3.470     1.510     1.510 peak   626 spectrum    1 weight  0.11000E+01 volume  0.10607E-02 ppm1      0.736 ppm2      2.929 CV     1
 ASSI {  627}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 82   and name HE1 ))
      3.560     1.590     1.590 peak   627 spectrum    1 weight  0.11000E+01 volume  0.10341E-02 ppm1      0.738 ppm2      2.834 CV     1
 ASSI {  629}
   (  segid "    " and resid 48   and name HE% )
   (( segid "    " and resid 50   and name HB1 ))
      3.210     1.290     1.290 peak   629 spectrum    1 weight  0.11000E+01 volume  0.15455E-02 ppm1      6.424 ppm2      2.822 CV     1
 ASSI {  631}
   (  segid "    " and resid 48   and name HD% )
   (( segid "    " and resid 48   and name HB2 ))
      3.190     1.270     1.270 peak   631 spectrum    1 weight  0.11000E+01 volume  0.11097E-02 ppm1      6.631 ppm2      2.943 CV     1
 ASSI {  633}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 48   and name HB2 ))
      3.100     1.200     1.200 peak   633 spectrum    1 weight  0.11000E+01 volume  0.10050E-02 ppm1      7.607 ppm2      2.944 CV     1
 ASSI {  639}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 75   and name HB2 ))
      3.910     1.910     1.910 peak   639 spectrum    1 weight  0.11000E+01 volume  0.13254E-02 ppm1      3.298 ppm2      1.764 CV     1
 ASSI {  640}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 75   and name HB1 ))
      2.700     0.910     0.910 peak   640 spectrum    1 weight  0.11000E+01 volume  0.17060E-02 ppm1      3.298 ppm2      1.404 CV     1
 ASSI {  643}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 75   and name HB1 ))
      2.810     0.990     0.990 peak   643 spectrum    1 weight  0.11000E+01 volume  0.17041E-02 ppm1      1.080 ppm2      1.402 CV     1
 ASSI {  644}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HE1 ))
      3.460     1.490     1.490 peak   644 spectrum    1 weight  0.11000E+01 volume  0.21576E-02 ppm1      0.532 ppm2      1.686 CV     1
 ASSI {  645}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HE2 ))
      4.110     2.110     2.110 peak   645 spectrum    1 weight  0.11000E+01 volume  0.88265E-03 ppm1      0.532 ppm2      1.947 CV     1
 ASSI {  646}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HE2 ))
      2.960     1.100     1.100 peak   646 spectrum    1 weight  0.11000E+01 volume  0.19736E-02 ppm1      0.864 ppm2      1.943 CV     1
 ASSI {  647}
   (( segid "    " and resid 34   and name HE1 ))
   (( segid "    " and resid 34   and name HE2 ))
      1.860     0.430     0.430 peak   647 spectrum    1 weight  0.11000E+01 volume  0.94532E-02 ppm1      1.691 ppm2      1.954 CV     1
 ASSI {  648}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HB2 ))
      1.910     0.460     0.460 peak   648 spectrum    1 weight  0.11000E+01 volume  0.79688E-02 ppm1      1.406 ppm2      1.763 CV     1
 ASSI {  650}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name HB2 ))
      3.960     1.960     1.960 peak   650 spectrum    1 weight  0.11000E+01 volume  0.10885E-02 ppm1      0.755 ppm2      1.762 CV     1
 ASSI {  652}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 40   and name HB1 ))
      2.860     1.030     1.030 peak   652 spectrum    1 weight  0.11000E+01 volume  0.21746E-02 ppm1      0.835 ppm2      2.133 CV     1
 ASSI {  654}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HB2 ))
      1.810     0.410     0.410 peak   654 spectrum    1 weight  0.11000E+01 volume  0.12816E-01 ppm1      2.133 ppm2      2.706 CV     1
 ASSI {  657}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB1 ))
      3.070     1.180     1.180 peak   657 spectrum    1 weight  0.11000E+01 volume  0.12740E-02 ppm1      4.616 ppm2      2.133 CV     1
 ASSI {  659}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HB1 ))
      3.020     1.140     1.140 peak   659 spectrum    1 weight  0.11000E+01 volume  0.24495E-02 ppm1      6.673 ppm2      2.135 CV     1
 ASSI {  664}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HB2 ))
      2.650     0.870     0.870 peak   664 spectrum    1 weight  0.11000E+01 volume  0.19231E-02 ppm1      6.676 ppm2      2.710 CV     1
 ASSI {  665}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.760     0.950     0.950 peak   665 spectrum    1 weight  0.11000E+01 volume  0.17983E-02 ppm1      7.426 ppm2      2.713 CV     1
 ASSI {  670}
   (  segid "    " and resid 108  and name HD% )
   (( segid "    " and resid 108  and name HB2 ))
      2.950     1.090     1.090 peak   670 spectrum    1 weight  0.11000E+01 volume  0.18849E-02 ppm1      7.156 ppm2      2.889 CV     1
 ASSI {  673}
   (  segid "    " and resid 108  and name HD% )
   (( segid "    " and resid 108  and name HB1 ))
      2.760     0.950     0.950 peak   673 spectrum    1 weight  0.11000E+01 volume  0.28253E-02 ppm1      7.160 ppm2      3.092 CV     1
 ASSI {  676}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 101  and name HB2 ))
      2.770     0.960     0.960 peak   676 spectrum    1 weight  0.11000E+01 volume  0.25229E-02 ppm1      7.585 ppm2      2.976 CV     1
 ASSI {  677}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      2.480     0.770     0.770 peak   677 spectrum    1 weight  0.11000E+01 volume  0.46336E-02 ppm1      8.284 ppm2      2.979 CV     1
 OR {  677}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  678}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.600     0.850     0.850 peak   678 spectrum    1 weight  0.11000E+01 volume  0.41829E-02 ppm1      4.466 ppm2      2.981 CV     1
 OR {  678}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  680}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      2.610     0.850     0.850 peak   680 spectrum    1 weight  0.11000E+01 volume  0.29833E-02 ppm1      8.953 ppm2      2.982 CV     1
 ASSI {  682}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 101  and name HB1 ))
      2.940     1.080     1.080 peak   682 spectrum    1 weight  0.11000E+01 volume  0.20210E-02 ppm1      7.581 ppm2      3.584 CV     1
 ASSI {  683}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      4.300     2.310     2.200 peak   683 spectrum    1 weight  0.11000E+01 volume  0.75501E-03 ppm1      8.914 ppm2      3.584 CV     1
 ASSI {  685}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.160     0.580     0.580 peak   685 spectrum    1 weight  0.11000E+01 volume  0.52594E-02 ppm1      8.299 ppm2      3.324 CV     1
 ASSI {  686}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 36   and name HB1 ))
      2.270     0.650     0.650 peak   686 spectrum    1 weight  0.11000E+01 volume  0.48348E-02 ppm1      6.998 ppm2      3.324 CV     1
 ASSI {  688}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
      1.910     0.460     0.460 peak   688 spectrum    1 weight  0.11000E+01 volume  0.11717E-01 ppm1      2.976 ppm2      3.584 CV     1
 ASSI {  689}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 90   and name HB2 ))
      2.730     0.930     0.930 peak   689 spectrum    1 weight  0.11000E+01 volume  0.20903E-02 ppm1      6.761 ppm2      2.570 CV     1
 ASSI {  690}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 90   and name HB1 ))
      2.870     1.030     1.030 peak   690 spectrum    1 weight  0.11000E+01 volume  0.22167E-02 ppm1      6.767 ppm2      2.300 CV     1
 ASSI {  693}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.700     0.910     0.910 peak   693 spectrum    1 weight  0.11000E+01 volume  0.25492E-02 ppm1      4.555 ppm2      2.570 CV     1
 ASSI {  694}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 90   and name HB2 ))
      3.660     1.680     1.680 peak   694 spectrum    1 weight  0.11000E+01 volume  0.65676E-03 ppm1      7.581 ppm2      2.571 CV     1
 ASSI {  695}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 90   and name HB2 ))
      3.680     1.700     1.700 peak   695 spectrum    1 weight  0.11000E+01 volume  0.87618E-03 ppm1      7.089 ppm2      2.575 CV     1
 ASSI {  696}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 90   and name HB1 ))
      3.570     1.600     1.600 peak   696 spectrum    1 weight  0.11000E+01 volume  0.50508E-03 ppm1      7.108 ppm2      2.302 CV     1
 ASSI {  697}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 90   and name HB1 ))
      4.010     2.010     2.010 peak   697 spectrum    1 weight  0.11000E+01 volume  0.43080E-03 ppm1      7.578 ppm2      2.305 CV     1
 ASSI {  698}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 108  and name HB2 ))
      1.780     0.390     0.420 peak   698 spectrum    1 weight  0.11000E+01 volume  0.18494E-01 ppm1      3.087 ppm2      2.890 CV     1
 ASSI {  701}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HB2 ))
      2.150     0.580     0.580 peak   701 spectrum    1 weight  0.11000E+01 volume  0.47537E-02 ppm1      0.055 ppm2      1.967 CV     1
 ASSI {  702}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HB2 ))
      2.060     0.530     0.530 peak   702 spectrum    1 weight  0.11000E+01 volume  0.57471E-02 ppm1      2.296 ppm2      2.571 CV     1
 ASSI {  703}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HB2 ))
      1.830     0.420     0.420 peak   703 spectrum    1 weight  0.11000E+01 volume  0.15751E-01 ppm1      2.576 ppm2      2.739 CV     1
 ASSI {  714}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 108  and name HB2 ))
      3.890     1.890     1.890 peak   714 spectrum    1 weight  0.11000E+01 volume  0.73725E-03 ppm1      1.675 ppm2      2.894 CV     1
 ASSI {  716}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 95   and name HB1 ))
      1.890     0.450     0.450 peak   716 spectrum    1 weight  0.11000E+01 volume  0.11728E-01 ppm1      3.277 ppm2      2.713 CV     1
 ASSI {  717}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB1 ))
      3.500     1.540     1.540 peak   717 spectrum    1 weight  0.11000E+01 volume  0.10989E-02 ppm1      6.628 ppm2      2.712 CV     1
 ASSI {  718}
   (( segid "    " and resid 95   and name HD22))
   (( segid "    " and resid 95   and name HB1 ))
      4.160     2.160     2.160 peak   718 spectrum    1 weight  0.11000E+01 volume  0.72994E-03 ppm1      7.702 ppm2      2.714 CV     1
 ASSI {  719}
   (( segid "    " and resid 95   and name HD21))
   (( segid "    " and resid 95   and name HB1 ))
      2.640     0.870     0.870 peak   719 spectrum    1 weight  0.11000E+01 volume  0.18504E-02 ppm1      8.054 ppm2      2.713 CV     1
 ASSI {  721}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HB1 ))
      1.810     0.410     0.410 peak   721 spectrum    1 weight  0.11000E+01 volume  0.13518E-01 ppm1      2.990 ppm2      2.543 CV     1
 ASSI {  733}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 11   and name HB2 ))
      3.010     1.130     1.130 peak   733 spectrum    1 weight  0.11000E+01 volume  0.19388E-02 ppm1      1.186 ppm2      2.996 CV     1
 ASSI {  734}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 11   and name HB1 ))
      3.170     1.260     1.260 peak   734 spectrum    1 weight  0.11000E+01 volume  0.15364E-02 ppm1      1.186 ppm2      2.548 CV     1
 ASSI {  737}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 36   and name HB1 ))
      4.170     2.180     2.180 peak   737 spectrum    1 weight  0.11000E+01 volume  0.10451E-02 ppm1      0.836 ppm2      3.324 CV     1
 ASSI {  738}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
      4.190     2.200     2.200 peak   738 spectrum    1 weight  0.11000E+01 volume  0.12112E-02 ppm1      0.603 ppm2      3.325 CV     1
 ASSI {  739}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 33   and name HB1 ))
      2.430     0.740     0.740 peak   739 spectrum    1 weight  0.11000E+01 volume  0.34201E-02 ppm1      0.588 ppm2      3.421 CV     1
 OR {  739}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 33   and name HB1 ))
 ASSI {  741}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB1 ))
      2.830     1.000     1.000 peak   741 spectrum    1 weight  0.11000E+01 volume  0.13470E-02 ppm1      4.818 ppm2      3.422 CV     1
 ASSI {  742}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 33   and name HB2 ))
      3.370     1.420     1.420 peak   742 spectrum    1 weight  0.11000E+01 volume  0.22474E-02 ppm1      0.585 ppm2      3.007 CV     1
 OR {  742}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 33   and name HB2 ))
 ASSI {  743}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 11   and name HB2 ))
      2.490     0.780     0.780 peak   743 spectrum    1 weight  0.11000E+01 volume  0.30949E-02 ppm1      4.732 ppm2      2.995 CV     1
 ASSI {  747}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.160     0.580     0.580 peak   747 spectrum    1 weight  0.11000E+01 volume  0.27712E-02 ppm1      4.819 ppm2      3.324 CV     1
 ASSI {  749}
   (( segid "    " and resid 95   and name HD21))
   (( segid "    " and resid 95   and name HB2 ))
      3.290     1.350     1.350 peak   749 spectrum    1 weight  0.11000E+01 volume  0.26250E-02 ppm1      8.056 ppm2      3.279 CV     1
 ASSI {  750}
   (( segid "    " and resid 95   and name HD22))
   (( segid "    " and resid 95   and name HB2 ))
      3.950     1.950     1.950 peak   750 spectrum    1 weight  0.11000E+01 volume  0.11779E-02 ppm1      7.709 ppm2      3.279 CV     1
 ASSI {  751}
   (( segid "    " and resid 11   and name HD21))
   (( segid "    " and resid 11   and name HB2 ))
      2.810     0.990     0.990 peak   751 spectrum    1 weight  0.11000E+01 volume  0.14656E-02 ppm1      7.156 ppm2      2.995 CV     1
 ASSI {  753}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 36   and name HB2 ))
      3.630     1.650     1.650 peak   753 spectrum    1 weight  0.11000E+01 volume  0.15946E-02 ppm1      6.760 ppm2      3.325 CV     1
 OR {  753}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 36   and name HB1 ))
 ASSI {  754}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.280     1.340     1.340 peak   754 spectrum    1 weight  0.11000E+01 volume  0.10741E-02 ppm1      4.827 ppm2      2.999 CV     1
 ASSI {  755}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HB2 ))
      1.890     0.450     0.450 peak   755 spectrum    1 weight  0.11000E+01 volume  0.83947E-02 ppm1      3.421 ppm2      3.008 CV     1
 ASSI {  756}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 33   and name HB1 ))
      2.580     0.830     0.830 peak   756 spectrum    1 weight  0.11000E+01 volume  0.30159E-02 ppm1      6.768 ppm2      3.424 CV     1
 ASSI {  757}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 33   and name HB2 ))
      2.630     0.870     0.870 peak   757 spectrum    1 weight  0.11000E+01 volume  0.33473E-02 ppm1      6.767 ppm2      3.008 CV     1
 ASSI {  761}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG2 ))
      2.840     1.010     1.010 peak   761 spectrum    1 weight  0.11000E+01 volume  0.26674E-02 ppm1      4.503 ppm2      2.365 CV     1
 ASSI {  762}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG1 ))
      2.960     1.090     1.090 peak   762 spectrum    1 weight  0.11000E+01 volume  0.27632E-02 ppm1      4.499 ppm2      2.291 CV     1
 ASSI {  765}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HB2 ))
      1.950     0.470     0.470 peak   765 spectrum    1 weight  0.11000E+01 volume  0.77752E-02 ppm1     -0.081 ppm2      1.354 CV     1
 ASSI {  770}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.240     0.630     0.630 peak   770 spectrum    1 weight  0.11000E+01 volume  0.85747E-02 ppm1      1.819 ppm2      1.567 CV     1
 OR {  770}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HG1 ))
 ASSI {  771}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 30   and name HG2 ))
      3.230     1.300     1.300 peak   771 spectrum    1 weight  0.11000E+01 volume  0.12393E-02 ppm1      0.855 ppm2      1.567 CV     1
 ASSI {  773}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HB2 ))
      3.380     1.430     1.430 peak   773 spectrum    1 weight  0.11000E+01 volume  0.13929E-02 ppm1      0.879 ppm2      1.356 CV     1
 ASSI {  774}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HB1 ))
      1.780     0.390     0.420 peak   774 spectrum    1 weight  0.11000E+01 volume  0.14217E-01 ppm1      2.041 ppm2      1.895 CV     1
 ASSI {  778}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HG1 ))
      2.830     1.000     1.000 peak   778 spectrum    1 weight  0.11000E+01 volume  0.27542E-02 ppm1      4.541 ppm2      2.466 CV     1
 OR {  778}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI {  779}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HG2 ))
      2.970     1.100     1.100 peak   779 spectrum    1 weight  0.11000E+01 volume  0.20093E-02 ppm1      4.741 ppm2      2.364 CV     1
 ASSI {  782}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
      3.570     1.590     1.590 peak   782 spectrum    1 weight  0.11000E+01 volume  0.10903E-02 ppm1      8.059 ppm2      2.268 CV     1
 ASSI {  783}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.850     1.010     1.010 peak   783 spectrum    1 weight  0.11000E+01 volume  0.10728E-02 ppm1      0.534 ppm2      1.567 CV     1
 ASSI {  784}
   (( segid "    " and resid 34   and name HD1 ))
   (( segid "    " and resid 30   and name HG2 ))
      3.650     1.670     1.670 peak   784 spectrum    1 weight  0.11000E+01 volume  0.12445E-02 ppm1      1.115 ppm2      1.567 CV     1
 ASSI {  785}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HB2 ))
      2.580     0.830     0.830 peak   785 spectrum    1 weight  0.11000E+01 volume  0.23888E-02 ppm1      1.361 ppm2      2.036 CV     1
 ASSI {  786}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HG1 ))
      3.420     1.470     1.470 peak   786 spectrum    1 weight  0.11000E+01 volume  0.12026E-02 ppm1      4.720 ppm2      2.272 CV     1
 ASSI {  787}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.030     1.140     1.140 peak   787 spectrum    1 weight  0.11000E+01 volume  0.14125E-02 ppm1      5.234 ppm2      2.035 CV     1
 ASSI {  789}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 7    and name HB1 ))
      3.640     1.650     1.650 peak   789 spectrum    1 weight  0.11000E+01 volume  0.71159E-03 ppm1      5.542 ppm2      1.893 CV     1
 ASSI {  791}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG2 ))
      3.480     1.510     1.510 peak   791 spectrum    1 weight  0.11000E+01 volume  0.12484E-02 ppm1      5.459 ppm2      2.116 CV     1
 ASSI {  792}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG1 ))
      3.600     1.620     1.620 peak   792 spectrum    1 weight  0.11000E+01 volume  0.98191E-03 ppm1      5.456 ppm2      2.287 CV     1
 ASSI {  793}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG1 ))
      3.780     1.780     1.780 peak   793 spectrum    1 weight  0.11000E+01 volume  0.82979E-03 ppm1      8.156 ppm2      2.468 CV     1
 OR {  793}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI {  799}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
      4.090     2.090     2.090 peak   799 spectrum    1 weight  0.11000E+01 volume  0.62362E-03 ppm1      9.359 ppm2      2.266 CV     1
 ASSI {  800}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG2 ))
      3.930     1.930     1.930 peak   800 spectrum    1 weight  0.11000E+01 volume  0.81643E-03 ppm1      9.363 ppm2      2.379 CV     1
 ASSI {  801}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 30   and name HG1 ))
      3.070     1.180     1.180 peak   801 spectrum    1 weight  0.11000E+01 volume  0.12642E-02 ppm1      6.629 ppm2      1.567 CV     1
 OR {  801}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 30   and name HG2 ))
 ASSI {  802}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HG2 ))
      4.210     2.220     2.220 peak   802 spectrum    1 weight  0.11000E+01 volume  0.80841E-03 ppm1      7.071 ppm2      1.566 CV     1
 OR {  802}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HG1 ))
 ASSI {  803}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 30   and name HG1 ))
      3.880     1.880     1.880 peak   803 spectrum    1 weight  0.11000E+01 volume  0.58019E-03 ppm1      7.589 ppm2      1.571 CV     1
 OR {  803}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 30   and name HG2 ))
 ASSI {  804}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG1 ))
      4.040     2.040     2.040 peak   804 spectrum    1 weight  0.11000E+01 volume  0.10834E-02 ppm1      7.971 ppm2      1.565 CV     1
 OR {  804}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG2 ))
 ASSI {  805}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.400     1.450     1.450 peak   805 spectrum    1 weight  0.11000E+01 volume  0.65290E-03 ppm1      8.324 ppm2      1.353 CV     1
 ASSI {  807}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 82   and name HB2 ))
      3.380     1.430     1.430 peak   807 spectrum    1 weight  0.11000E+01 volume  0.64370E-03 ppm1      6.274 ppm2      1.353 CV     1
 ASSI {  808}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 82   and name HB1 ))
      4.070     2.070     2.070 peak   808 spectrum    1 weight  0.11000E+01 volume  0.55939E-03 ppm1      6.271 ppm2     -0.078 CV     1
 ASSI {  809}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HG1 ))
      2.250     0.630     0.630 peak   809 spectrum    1 weight  0.11000E+01 volume  0.10833E-01 ppm1      1.959 ppm2      2.282 CV     1
 ASSI {  811}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HG2 ))
      1.980     0.490     0.490 peak   811 spectrum    1 weight  0.11000E+01 volume  0.21417E-01 ppm1      2.024 ppm2      2.212 CV     1
 OR {  811}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HG1 ))
 ASSI {  812}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HG1 ))
      1.740     0.380     0.460 peak   812 spectrum    1 weight  0.11000E+01 volume  0.21994E-01 ppm1      2.101 ppm2      2.286 CV     1
 ASSI {  813}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HG2 ))
      2.310     0.670     0.670 peak   813 spectrum    1 weight  0.11000E+01 volume  0.12436E-01 ppm1      2.002 ppm2      2.343 CV     1
 ASSI {  814}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
      2.450     0.750     0.750 peak   814 spectrum    1 weight  0.11000E+01 volume  0.64453E-02 ppm1      2.255 ppm2      2.466 CV     1
 OR {  814}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HG1 ))
 ASSI {  815}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.070     1.180     1.180 peak   815 spectrum    1 weight  0.11000E+01 volume  0.22704E-02 ppm1      4.587 ppm2      1.768 CV     1
 ASSI {  816}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HB2 ))
      1.780     0.400     0.420 peak   816 spectrum    1 weight  0.11000E+01 volume  0.13528E-01 ppm1      1.764 ppm2      1.989 CV     1
 ASSI {  819}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HB1 ))
      1.650     0.340     0.550 peak   819 spectrum    1 weight  0.11000E+01 volume  0.21651E-01 ppm1      1.749 ppm2      1.916 CV     1
 ASSI {  820}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.030     1.150     1.150 peak   820 spectrum    1 weight  0.11000E+01 volume  0.17513E-02 ppm1      1.084 ppm2      1.769 CV     1
 ASSI {  822}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 92   and name HB  ))
      2.460     0.760     0.760 peak   822 spectrum    1 weight  0.11000E+01 volume  0.49145E-02 ppm1      0.737 ppm2      1.620 CV     1
 ASSI {  823}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 92   and name HB  ))
      2.510     0.790     0.790 peak   823 spectrum    1 weight  0.11000E+01 volume  0.30027E-02 ppm1      2.038 ppm2      1.621 CV     1
 ASSI {  824}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HB1 ))
      2.420     0.730     0.730 peak   824 spectrum    1 weight  0.11000E+01 volume  0.51541E-02 ppm1      2.406 ppm2      2.027 CV     1
 ASSI {  825}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HB2 ))
      3.030     1.150     1.150 peak   825 spectrum    1 weight  0.11000E+01 volume  0.24227E-02 ppm1      2.406 ppm2      1.955 CV     1
 ASSI {  828}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      2.790     0.980     0.980 peak   828 spectrum    1 weight  0.11000E+01 volume  0.30778E-02 ppm1      4.763 ppm2      2.035 CV     1
 ASSI {  829}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HG2 ))
      3.650     1.670     1.670 peak   829 spectrum    1 weight  0.11000E+01 volume  0.93997E-03 ppm1      4.944 ppm2      2.174 CV     1
 ASSI {  830}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 18   and name HG1 ))
      3.380     1.430     1.430 peak   830 spectrum    1 weight  0.11000E+01 volume  0.14181E-02 ppm1      4.334 ppm2      2.172 CV     1
 ASSI {  838}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB  ))
      2.800     0.980     0.980 peak   838 spectrum    1 weight  0.11000E+01 volume  0.20536E-02 ppm1      9.162 ppm2      1.620 CV     1
 ASSI {  839}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 4    and name HB1 ))
      3.370     1.420     1.420 peak   839 spectrum    1 weight  0.11000E+01 volume  0.11321E-02 ppm1      6.959 ppm2      2.023 CV     1
 ASSI {  845}
   (  segid "    " and resid 91   and name HE% )
   (( segid "    " and resid 81   and name HB1 ))
      2.890     1.040     1.040 peak   845 spectrum    1 weight  0.11000E+01 volume  0.10182E-02 ppm1      7.125 ppm2      1.769 CV     1
 ASSI {  846}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 81   and name HB1 ))
      3.100     1.200     1.200 peak   846 spectrum    1 weight  0.11000E+01 volume  0.67339E-03 ppm1      6.995 ppm2      1.767 CV     1
 ASSI {  847}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.970     1.970     1.970 peak   847 spectrum    1 weight  0.11000E+01 volume  0.87766E-03 ppm1      8.327 ppm2      1.770 CV     1
 ASSI {  850}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HB2 ))
      2.640     0.870     0.870 peak   850 spectrum    1 weight  0.11000E+01 volume  0.47705E-02 ppm1      1.484 ppm2      1.751 CV     1
 ASSI {  851}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HG1 ))
      1.780     0.400     0.420 peak   851 spectrum    1 weight  0.11000E+01 volume  0.14392E-01 ppm1      2.175 ppm2      2.406 CV     1
 ASSI {  852}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 81   and name HB2 ))
      2.780     0.970     0.970 peak   852 spectrum    1 weight  0.11000E+01 volume  0.16184E-02 ppm1      1.071 ppm2      1.990 CV     1
 ASSI {  853}
   (  segid "    " and resid 54   and name HG2%)
   (( segid "    " and resid 7    and name HB1 ))
      3.460     1.500     1.500 peak   853 spectrum    1 weight  0.11000E+01 volume  0.12225E-02 ppm1      1.005 ppm2      1.893 CV     1
 ASSI {  856}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 42   and name HB  ))
      3.020     1.140     1.140 peak   856 spectrum    1 weight  0.11000E+01 volume  0.16241E-02 ppm1      3.840 ppm2      1.757 CV     1
 ASSI {  858}
   (( segid "    " and resid 35   and name HE21))
   (( segid "    " and resid 35   and name HG1 ))
      3.050     1.160     1.160 peak   858 spectrum    1 weight  0.11000E+01 volume  0.16396E-02 ppm1      7.971 ppm2      2.473 CV     1
 ASSI {  859}
   (( segid "    " and resid 35   and name HE21))
   (( segid "    " and resid 35   and name HG2 ))
      2.830     1.000     1.000 peak   859 spectrum    1 weight  0.11000E+01 volume  0.17113E-02 ppm1      7.974 ppm2      2.444 CV     1
 ASSI {  864}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 57   and name HB  ))
      2.440     0.740     0.740 peak   864 spectrum    1 weight  0.11000E+01 volume  0.44743E-02 ppm1      0.395 ppm2     -0.226 CV     1
 ASSI {  865}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB  ))
      2.580     0.830     0.830 peak   865 spectrum    1 weight  0.11000E+01 volume  0.32194E-02 ppm1      4.506 ppm2     -0.228 CV     1
 ASSI {  867}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB1 ))
      2.530     0.800     0.800 peak   867 spectrum    1 weight  0.11000E+01 volume  0.47289E-02 ppm1      4.077 ppm2      1.843 CV     1
 OR {  867}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  869}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.320     0.670     0.670 peak   869 spectrum    1 weight  0.11000E+01 volume  0.51821E-02 ppm1      7.075 ppm2      1.857 CV     1
 ASSI {  875}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.600     0.840     0.840 peak   875 spectrum    1 weight  0.11000E+01 volume  0.25788E-02 ppm1      7.441 ppm2      1.856 CV     1
 ASSI {  878}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.080     1.180     1.180 peak   878 spectrum    1 weight  0.11000E+01 volume  0.27328E-02 ppm1      8.152 ppm2      2.193 CV     1
 ASSI {  879}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.410     0.720     0.720 peak   879 spectrum    1 weight  0.11000E+01 volume  0.37492E-02 ppm1      8.128 ppm2      2.063 CV     1
 ASSI {  884}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
      3.630     1.650     1.650 peak   884 spectrum    1 weight  0.11000E+01 volume  0.21427E-02 ppm1      9.162 ppm2      1.587 CV     1
 ASSI {  885}
   (  segid "    " and resid 91   and name HE% )
   (( segid "    " and resid 81   and name HG2 ))
      3.600     1.620     1.620 peak   885 spectrum    1 weight  0.11000E+01 volume  0.10071E-02 ppm1      7.129 ppm2      1.764 CV     1
 ASSI {  891}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HB1 ))
      1.970     0.480     0.480 peak   891 spectrum    1 weight  0.11000E+01 volume  0.65765E-02 ppm1      3.316 ppm2      3.028 CV     1
 ASSI {  893}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 79   and name HB1 ))
      3.240     1.320     1.320 peak   893 spectrum    1 weight  0.11000E+01 volume  0.11974E-02 ppm1      1.403 ppm2      3.027 CV     1
 ASSI {  895}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 79   and name HB1 ))
      3.380     1.430     1.430 peak   895 spectrum    1 weight  0.11000E+01 volume  0.11943E-02 ppm1      1.079 ppm2      3.026 CV     1
 ASSI {  896}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 79   and name HB2 ))
      4.150     2.150     2.150 peak   896 spectrum    1 weight  0.11000E+01 volume  0.59588E-03 ppm1      1.079 ppm2      3.312 CV     1
 ASSI {  897}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 79   and name HB1 ))
      3.550     1.570     1.570 peak   897 spectrum    1 weight  0.11000E+01 volume  0.62742E-03 ppm1      0.751 ppm2      3.026 CV     1
 ASSI {  898}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 3    and name HB2 ))
      2.970     1.100     1.100 peak   898 spectrum    1 weight  0.11000E+01 volume  0.24752E-02 ppm1      1.862 ppm2      2.993 CV     1
 ASSI {  899}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HB2 ))
      1.900     0.450     0.450 peak   899 spectrum    1 weight  0.11000E+01 volume  0.11562E-01 ppm1      3.360 ppm2      3.192 CV     1
 ASSI {  903}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 32   and name HB  ))
      2.870     1.030     1.030 peak   903 spectrum    1 weight  0.11000E+01 volume  0.20289E-02 ppm1      0.534 ppm2      1.786 CV     1
 ASSI {  907}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 88   and name HB  ))
      2.400     0.720     0.720 peak   907 spectrum    1 weight  0.11000E+01 volume  0.50546E-02 ppm1      1.176 ppm2      2.301 CV     1
 ASSI {  913}
   (( segid "    " and resid 77   and name HG2 ))
   (( segid "    " and resid 77   and name HB1 ))
      2.150     0.580     0.580 peak   913 spectrum    1 weight  0.11000E+01 volume  0.19246E-01 ppm1      2.050 ppm2      2.411 CV     1
 ASSI {  914}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 106  and name HB2 ))
      1.770     0.390     0.430 peak   914 spectrum    1 weight  0.11000E+01 volume  0.17698E-01 ppm1      1.874 ppm2      2.241 CV     1
 ASSI {  915}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
      1.780     0.390     0.420 peak   915 spectrum    1 weight  0.11000E+01 volume  0.15566E-01 ppm1      2.346 ppm2      1.780 CV     1
 ASSI {  917}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HB1 ))
      2.800     0.980     0.980 peak   917 spectrum    1 weight  0.11000E+01 volume  0.61821E-02 ppm1      2.010 ppm2      1.785 CV     1
 ASSI {  919}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.990     1.110     1.110 peak   919 spectrum    1 weight  0.11000E+01 volume  0.21726E-02 ppm1      4.197 ppm2      1.694 CV     1
 ASSI {  922}
   (( segid "    " and resid 12   and name HA2 ))
   (( segid "    " and resid 59   and name HB2 ))
      2.230     0.620     0.620 peak   922 spectrum    1 weight  0.11000E+01 volume  0.48232E-02 ppm1      4.504 ppm2      2.057 CV     1
 ASSI {  927}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.820     0.990     0.990 peak   927 spectrum    1 weight  0.11000E+01 volume  0.39977E-02 ppm1      4.620 ppm2      2.992 CV     1
 ASSI {  928}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
      3.570     1.590     1.590 peak   928 spectrum    1 weight  0.11000E+01 volume  0.12054E-02 ppm1      8.448 ppm2      2.993 CV     1
 ASSI {  934}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.330     1.380     1.380 peak   934 spectrum    1 weight  0.11000E+01 volume  0.15679E-02 ppm1      9.325 ppm2      2.067 CV     1
 ASSI {  936}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HB2 ))
      2.370     0.700     0.700 peak   936 spectrum    1 weight  0.11000E+01 volume  0.71384E-02 ppm1      1.538 ppm2      1.858 CV     1
 OR {  936}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HB1 ))
 ASSI {  937}
   (( segid "    " and resid 31   and name HD1 ))
   (( segid "    " and resid 31   and name HB1 ))
      2.500     0.780     0.780 peak   937 spectrum    1 weight  0.11000E+01 volume  0.63675E-02 ppm1      1.643 ppm2      1.855 CV     1
 OR {  937}
   (( segid "    " and resid 31   and name HD2 ))
   (( segid "    " and resid 31   and name HB1 ))
 OR {  937}
   (( segid "    " and resid 31   and name HD1 ))
   (( segid "    " and resid 31   and name HB2 ))
 OR {  937}
   (( segid "    " and resid 31   and name HD2 ))
   (( segid "    " and resid 31   and name HB2 ))
 ASSI {  940}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.710     0.920     0.920 peak   940 spectrum    1 weight  0.11000E+01 volume  0.18340E-02 ppm1      3.752 ppm2      1.695 CV     1
 ASSI {  941}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HB1 ))
      3.800     1.800     1.800 peak   941 spectrum    1 weight  0.11000E+01 volume  0.12698E-02 ppm1      3.746 ppm2      1.591 CV     1
 ASSI {  943}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB1 ))
      2.850     1.020     1.020 peak   943 spectrum    1 weight  0.11000E+01 volume  0.17111E-02 ppm1      5.462 ppm2      1.969 CV     1
 ASSI {  947}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HB2 ))
      2.010     0.510     0.510 peak   947 spectrum    1 weight  0.11000E+01 volume  0.69513E-02 ppm1      0.568 ppm2      0.788 CV     1
 ASSI {  949}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HB2 ))
      3.160     1.250     1.250 peak   949 spectrum    1 weight  0.11000E+01 volume  0.16258E-02 ppm1      0.215 ppm2      0.792 CV     1
 ASSI {  952}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HG1 ))
      3.220     1.300     1.300 peak   952 spectrum    1 weight  0.11000E+01 volume  0.20391E-02 ppm1      4.586 ppm2      1.699 CV     1
 ASSI {  954}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
      2.460     0.760     0.760 peak   954 spectrum    1 weight  0.11000E+01 volume  0.50955E-02 ppm1      8.041 ppm2      2.040 CV     1
 OR {  954}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {  955}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HB1 ))
      3.380     1.430     1.430 peak   955 spectrum    1 weight  0.11000E+01 volume  0.27878E-02 ppm1      7.589 ppm2      3.356 CV     1
 ASSI {  956}
   (( segid "    " and resid 46   and name HE3 ))
   (( segid "    " and resid 46   and name HB2 ))
      3.780     1.780     1.780 peak   956 spectrum    1 weight  0.11000E+01 volume  0.23202E-02 ppm1      7.592 ppm2      3.193 CV     1
 ASSI {  960}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HB1 ))
      1.950     0.480     0.480 peak   960 spectrum    1 weight  0.11000E+01 volume  0.99646E-02 ppm1      3.302 ppm2      3.029 CV     1
 ASSI {  961}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
      3.530     1.560     1.560 peak   961 spectrum    1 weight  0.11000E+01 volume  0.23532E-02 ppm1      9.354 ppm2      3.356 CV     1
 ASSI {  964}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HG1 ))
      3.820     1.820     1.820 peak   964 spectrum    1 weight  0.11000E+01 volume  0.12582E-02 ppm1      8.319 ppm2      1.692 CV     1
 ASSI {  966}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HG1 ))
      2.300     0.660     0.660 peak   966 spectrum    1 weight  0.11000E+01 volume  0.48606E-02 ppm1      2.003 ppm2      1.702 CV     1
 ASSI {  967}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HG2 ))
      2.450     0.750     0.750 peak   967 spectrum    1 weight  0.11000E+01 volume  0.67862E-02 ppm1      1.994 ppm2      1.766 CV     1
 ASSI {  969}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 81   and name HG2 ))
      3.430     1.470     1.470 peak   969 spectrum    1 weight  0.11000E+01 volume  0.11037E-02 ppm1      1.118 ppm2      1.763 CV     1
 ASSI {  970}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG1 ))
      4.450     2.470     2.050 peak   970 spectrum    1 weight  0.11000E+01 volume  0.64886E-03 ppm1      8.939 ppm2      1.703 CV     1
 ASSI {  971}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG2 ))
      4.040     2.040     2.040 peak   971 spectrum    1 weight  0.11000E+01 volume  0.74176E-03 ppm1      8.944 ppm2      1.765 CV     1
 ASSI {  974}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      2.940     1.080     1.080 peak   974 spectrum    1 weight  0.11000E+01 volume  0.16061E-02 ppm1      8.490 ppm2      1.982 CV     1
 ASSI {  978}
   (( segid "    " and resid 94   and name HD2 ))
   (( segid "    " and resid 94   and name HB2 ))
      3.560     1.590     1.590 peak   978 spectrum    1 weight  0.11000E+01 volume  0.66276E-03 ppm1      6.907 ppm2      3.295 CV     1
 ASSI {  979}
   (( segid "    " and resid 94   and name HD2 ))
   (( segid "    " and resid 94   and name HB1 ))
      3.890     1.890     1.890 peak   979 spectrum    1 weight  0.11000E+01 volume  0.52963E-03 ppm1      6.898 ppm2      3.026 CV     1
 ASSI {  983}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB1 ))
      2.720     0.930     0.930 peak   983 spectrum    1 weight  0.11000E+01 volume  0.24015E-02 ppm1      4.592 ppm2      1.913 CV     1
 ASSI {  988}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 76   and name HB1 ))
      4.480     2.510     2.020 peak   988 spectrum    1 weight  0.11000E+01 volume  0.10702E-02 ppm1      7.053 ppm2      2.418 CV     1
 ASSI {  989}
   (( segid "    " and resid 77   and name HD2 ))
   (( segid "    " and resid 76   and name HB1 ))
      2.770     0.960     0.960 peak   989 spectrum    1 weight  0.11000E+01 volume  0.15752E-02 ppm1      3.656 ppm2      2.423 CV     1
 ASSI {  990}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 76   and name HB1 ))
      3.680     1.690     1.690 peak   990 spectrum    1 weight  0.11000E+01 volume  0.12798E-02 ppm1      3.914 ppm2      2.424 CV     1
 ASSI {  991}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      2.940     1.080     1.080 peak   991 spectrum    1 weight  0.11000E+01 volume  0.19572E-02 ppm1      4.403 ppm2      1.977 CV     1
 ASSI {  993}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HB1 ))
      1.820     0.410     0.410 peak   993 spectrum    1 weight  0.11000E+01 volume  0.10616E-01 ppm1      1.844 ppm2      2.420 CV     1
 ASSI {  995}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HB1 ))
      1.660     0.350     0.540 peak   995 spectrum    1 weight  0.11000E+01 volume  0.26642E-01 ppm1      2.011 ppm2      2.172 CV     1
 ASSI {  997}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      1.790     0.400     0.410 peak   997 spectrum    1 weight  0.11000E+01 volume  0.15148E-01 ppm1      2.318 ppm2      1.912 CV     1
 ASSI {  998}
   (( segid "    " and resid 7    and name HE1 ))
   (( segid "    " and resid 7    and name HD1 ))
      2.420     0.730     0.730 peak   998 spectrum    1 weight  0.11000E+01 volume  0.70404E-02 ppm1      2.879 ppm2      1.629 CV     1
 ASSI { 1001}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HB1 ))
      3.070     1.180     1.180 peak  1001 spectrum    1 weight  0.11000E+01 volume  0.19330E-02 ppm1      1.245 ppm2      2.420 CV     1
 ASSI { 1002}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HB1 ))
      2.540     0.800     0.800 peak  1002 spectrum    1 weight  0.11000E+01 volume  0.27001E-02 ppm1      1.640 ppm2      2.420 CV     1
 ASSI { 1003}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HD1 ))
      3.740     1.740     1.740 peak  1003 spectrum    1 weight  0.11000E+01 volume  0.18965E-02 ppm1      4.071 ppm2      1.709 CV     1
 OR { 1003}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HD2 ))
 ASSI { 1004}
   (( segid "    " and resid 54   and name HB  ))
   (( segid "    " and resid 7    and name HD1 ))
      3.660     1.680     1.680 peak  1004 spectrum    1 weight  0.11000E+01 volume  0.16104E-02 ppm1      3.721 ppm2      1.618 CV     1
 ASSI { 1006}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 16   and name HD2 ))
      2.750     0.940     0.940 peak  1006 spectrum    1 weight  0.11000E+01 volume  0.23323E-02 ppm1      2.981 ppm2      1.769 CV     1
 ASSI { 1012}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
      3.020     1.140     1.140 peak  1012 spectrum    1 weight  0.11000E+01 volume  0.18752E-02 ppm1      2.766 ppm2      1.832 CV     1
 ASSI { 1013}
   (( segid "    " and resid 82   and name HE1 ))
   (( segid "    " and resid 82   and name HD2 ))
      2.480     0.770     0.770 peak  1013 spectrum    1 weight  0.11000E+01 volume  0.48569E-02 ppm1      2.873 ppm2      1.505 CV     1
 OR { 1013}
   (( segid "    " and resid 82   and name HE2 ))
   (( segid "    " and resid 82   and name HD2 ))
 OR { 1013}
   (( segid "    " and resid 82   and name HE1 ))
   (( segid "    " and resid 82   and name HD1 ))
 OR { 1013}
   (( segid "    " and resid 82   and name HE2 ))
   (( segid "    " and resid 82   and name HD1 ))
 ASSI { 1014}
   (( segid "    " and resid 30   and name HG1 ))
   (( segid "    " and resid 30   and name HB2 ))
      2.360     0.700     0.700 peak  1014 spectrum    1 weight  0.11000E+01 volume  0.56822E-02 ppm1      1.574 ppm2      1.969 CV     1
 OR { 1014}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI { 1015}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HD2 ))
      2.980     1.110     1.110 peak  1015 spectrum    1 weight  0.11000E+01 volume  0.21437E-02 ppm1     -0.080 ppm2      1.506 CV     1
 OR { 1015}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HD1 ))
 ASSI { 1016}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HD2 ))
      2.540     0.810     0.810 peak  1016 spectrum    1 weight  0.11000E+01 volume  0.39620E-02 ppm1      0.880 ppm2      1.506 CV     1
 OR { 1016}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HD1 ))
 ASSI { 1018}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HD1 ))
      3.050     1.160     1.160 peak  1018 spectrum    1 weight  0.11000E+01 volume  0.23697E-02 ppm1      0.866 ppm2      1.132 CV     1
 ASSI { 1019}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HD2 ))
      2.400     0.720     0.720 peak  1019 spectrum    1 weight  0.11000E+01 volume  0.47198E-02 ppm1      0.871 ppm2      1.060 CV     1
 ASSI { 1020}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HD1 ))
      2.450     0.750     0.750 peak  1020 spectrum    1 weight  0.11000E+01 volume  0.30093E-02 ppm1      1.597 ppm2      1.142 CV     1
 ASSI { 1021}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HD1 ))
      3.170     1.260     1.260 peak  1021 spectrum    1 weight  0.11000E+01 volume  0.92887E-03 ppm1      0.537 ppm2      1.141 CV     1
 ASSI { 1022}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HD2 ))
      2.780     0.970     0.970 peak  1022 spectrum    1 weight  0.11000E+01 volume  0.14294E-02 ppm1      0.538 ppm2      1.062 CV     1
 ASSI { 1025}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HB2 ))
      2.540     0.810     0.810 peak  1025 spectrum    1 weight  0.11000E+01 volume  0.26036E-02 ppm1      1.250 ppm2      1.844 CV     1
 ASSI { 1026}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.920     1.070     1.070 peak  1026 spectrum    1 weight  0.11000E+01 volume  0.14380E-02 ppm1      3.983 ppm2      1.968 CV     1
 ASSI { 1027}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 72   and name HB1 ))
      4.200     2.210     2.210 peak  1027 spectrum    1 weight  0.11000E+01 volume  0.84018E-03 ppm1      3.558 ppm2      1.913 CV     1
 ASSI { 1028}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 72   and name HB2 ))
      4.250     2.250     2.250 peak  1028 spectrum    1 weight  0.11000E+01 volume  0.11983E-02 ppm1      3.534 ppm2      1.991 CV     1
 ASSI { 1029}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 82   and name HD2 ))
      3.360     1.410     1.410 peak  1029 spectrum    1 weight  0.11000E+01 volume  0.12557E-02 ppm1      6.276 ppm2      1.506 CV     1
 OR { 1029}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 82   and name HD1 ))
 ASSI { 1030}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HD1 ))
      3.670     1.680     1.680 peak  1030 spectrum    1 weight  0.11000E+01 volume  0.16892E-02 ppm1      4.318 ppm2      1.506 CV     1
 OR { 1030}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HD2 ))
 ASSI { 1031}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HD1 ))
      4.350     2.360     2.150 peak  1031 spectrum    1 weight  0.11000E+01 volume  0.71973E-03 ppm1      4.192 ppm2      1.139 CV     1
 ASSI { 1033}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HD1 ))
      3.370     1.420     1.420 peak  1033 spectrum    1 weight  0.11000E+01 volume  0.15349E-02 ppm1      4.139 ppm2      1.449 CV     1
 ASSI { 1034}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HD2 ))
      3.270     1.340     1.340 peak  1034 spectrum    1 weight  0.11000E+01 volume  0.98054E-03 ppm1      4.145 ppm2      1.352 CV     1
 ASSI { 1035}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HD1 ))
      3.640     1.660     1.660 peak  1035 spectrum    1 weight  0.11000E+01 volume  0.40080E-03 ppm1      3.744 ppm2      1.137 CV     1
 ASSI { 1036}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HD2 ))
      4.460     2.490     2.040 peak  1036 spectrum    1 weight  0.11000E+01 volume  0.30927E-03 ppm1      3.744 ppm2      1.062 CV     1
 ASSI { 1037}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 34   and name HD1 ))
      3.560     1.590     1.590 peak  1037 spectrum    1 weight  0.11000E+01 volume  0.29030E-03 ppm1      7.385 ppm2      1.137 CV     1
 ASSI { 1038}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 34   and name HD2 ))
      4.440     2.460     2.060 peak  1038 spectrum    1 weight  0.11000E+01 volume  0.50014E-03 ppm1      7.375 ppm2      1.064 CV     1
 ASSI { 1039}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HD1 ))
      5.250     3.450     1.250 peak  1039 spectrum    1 weight  0.11000E+01 volume  0.25756E-03 ppm1      9.172 ppm2      1.137 CV     1
 ASSI { 1040}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HD2 ))
      5.260     3.460     1.240 peak  1040 spectrum    1 weight  0.11000E+01 volume  0.34921E-03 ppm1      9.168 ppm2      1.064 CV     1
 ASSI { 1042}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 30   and name HB2 ))
      4.220     2.230     2.230 peak  1042 spectrum    1 weight  0.11000E+01 volume  0.63443E-03 ppm1      6.629 ppm2      1.967 CV     1
 ASSI { 1043}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 30   and name HB1 ))
      5.040     3.170     1.460 peak  1043 spectrum    1 weight  0.11000E+01 volume  0.31090E-03 ppm1      6.633 ppm2      1.827 CV     1
 ASSI { 1044}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
      3.380     1.430     1.430 peak  1044 spectrum    1 weight  0.11000E+01 volume  0.10156E-02 ppm1      0.916 ppm2      1.915 CV     1
 ASSI { 1045}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HD2 ))
      3.170     1.250     1.250 peak  1045 spectrum    1 weight  0.11000E+01 volume  0.18528E-02 ppm1      1.953 ppm2      1.354 CV     1
 ASSI { 1046}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HB1 ))
      2.270     0.640     0.640 peak  1046 spectrum    1 weight  0.11000E+01 volume  0.10056E-01 ppm1      2.455 ppm2      2.276 CV     1
 ASSI { 1047}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HB2 ))
      2.110     0.550     0.550 peak  1047 spectrum    1 weight  0.11000E+01 volume  0.11151E-01 ppm1      2.452 ppm2      2.228 CV     1
 ASSI { 1049}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.460     0.760     0.760 peak  1049 spectrum    1 weight  0.11000E+01 volume  0.39019E-02 ppm1      4.074 ppm2      2.230 CV     1
 ASSI { 1054}
   (( segid "    " and resid 77   and name HD2 ))
   (( segid "    " and resid 77   and name HG1 ))
      3.020     1.140     1.140 peak  1054 spectrum    1 weight  0.11000E+01 volume  0.30987E-02 ppm1      3.652 ppm2      2.206 CV     1
 ASSI { 1055}
   (( segid "    " and resid 77   and name HD1 ))
   (( segid "    " and resid 77   and name HG1 ))
      2.590     0.840     0.840 peak  1055 spectrum    1 weight  0.11000E+01 volume  0.25191E-02 ppm1      3.909 ppm2      2.205 CV     1
 ASSI { 1056}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HG1 ))
      2.300     0.660     0.660 peak  1056 spectrum    1 weight  0.11000E+01 volume  0.51894E-02 ppm1      3.570 ppm2      2.057 CV     1
 ASSI { 1057}
   (( segid "    " and resid 106  and name HD1 ))
   (( segid "    " and resid 106  and name HG2 ))
      3.220     1.300     1.300 peak  1057 spectrum    1 weight  0.11000E+01 volume  0.24448E-02 ppm1      3.575 ppm2      1.972 CV     1
 ASSI { 1059}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 73   and name HG1 ))
      2.680     0.900     0.900 peak  1059 spectrum    1 weight  0.11000E+01 volume  0.47783E-02 ppm1      3.879 ppm2      2.059 CV     1
 ASSI { 1060}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HG1 ))
      3.750     1.750     1.750 peak  1060 spectrum    1 weight  0.11000E+01 volume  0.17341E-02 ppm1      4.382 ppm2      2.058 CV     1
 ASSI { 1061}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HG2 ))
      2.400     0.720     0.720 peak  1061 spectrum    1 weight  0.11000E+01 volume  0.43073E-02 ppm1      2.244 ppm2      1.970 CV     1
 ASSI { 1063}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 9    and name HG12))
      2.840     1.010     1.010 peak  1063 spectrum    1 weight  0.11000E+01 volume  0.30817E-02 ppm1      1.996 ppm2      1.416 CV     1
 ASSI { 1064}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HG2 ))
      2.380     0.710     0.710 peak  1064 spectrum    1 weight  0.11000E+01 volume  0.45636E-02 ppm1      1.871 ppm2      1.512 CV     1
 ASSI { 1065}
   (( segid "    " and resid 97   and name HD2 ))
   (( segid "    " and resid 97   and name HG2 ))
      2.500     0.780     0.780 peak  1065 spectrum    1 weight  0.11000E+01 volume  0.39226E-02 ppm1      3.181 ppm2      1.523 CV     1
 ASSI { 1066}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG1 ))
      3.310     1.370     1.370 peak  1066 spectrum    1 weight  0.11000E+01 volume  0.15540E-02 ppm1      3.769 ppm2      1.561 CV     1
 ASSI { 1067}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG2 ))
      2.850     1.010     1.010 peak  1067 spectrum    1 weight  0.11000E+01 volume  0.14977E-02 ppm1      3.765 ppm2      1.513 CV     1
 ASSI { 1069}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HG1 ))
      1.870     0.440     0.440 peak  1069 spectrum    1 weight  0.11000E+01 volume  0.11263E-01 ppm1      1.243 ppm2      1.627 CV     1
 ASSI { 1071}
   (( segid "    " and resid 9    and name HG11))
   (( segid "    " and resid 9    and name HG12))
      1.790     0.400     0.410 peak  1071 spectrum    1 weight  0.11000E+01 volume  0.13667E-01 ppm1      1.099 ppm2      1.412 CV     1
 ASSI { 1072}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG  ))
      3.500     1.530     1.530 peak  1072 spectrum    1 weight  0.11000E+01 volume  0.14995E-02 ppm1      4.515 ppm2      1.303 CV     1
 ASSI { 1075}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HG1 ))
      1.850     0.430     0.430 peak  1075 spectrum    1 weight  0.11000E+01 volume  0.92352E-02 ppm1      1.136 ppm2      0.956 CV     1
 ASSI { 1081}
   (( segid "    " and resid 89   and name HD1 ))
   (( segid "    " and resid 89   and name HG1 ))
      2.950     1.090     1.090 peak  1081 spectrum    1 weight  0.11000E+01 volume  0.30253E-02 ppm1      3.189 ppm2      0.957 CV     1
 ASSI { 1082}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 75   and name HG  ))
      2.550     0.810     0.810 peak  1082 spectrum    1 weight  0.11000E+01 volume  0.37149E-02 ppm1      4.764 ppm2      1.077 CV     1
 ASSI { 1089}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 70   and name HG11))
      1.970     0.480     0.480 peak  1089 spectrum    1 weight  0.11000E+01 volume  0.80241E-02 ppm1      1.501 ppm2      1.202 CV     1
 ASSI { 1091}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HB2 ))
      1.890     0.440     0.440 peak  1091 spectrum    1 weight  0.11000E+01 volume  0.10666E-01 ppm1      1.894 ppm2      2.088 CV     1
 ASSI { 1092}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HB2 ))
      3.180     1.260     1.260 peak  1092 spectrum    1 weight  0.11000E+01 volume  0.24796E-02 ppm1      1.538 ppm2      2.086 CV     1
 ASSI { 1093}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HB1 ))
      2.760     0.950     0.950 peak  1093 spectrum    1 weight  0.11000E+01 volume  0.27968E-02 ppm1      1.551 ppm2      1.886 CV     1
 OR { 1093}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1099}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 8    and name HG  ))
      2.840     1.010     1.010 peak  1099 spectrum    1 weight  0.11000E+01 volume  0.13536E-02 ppm1     -1.111 ppm2      0.881 CV     1
 ASSI { 1100}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 10   and name HG  ))
      3.830     1.830     1.830 peak  1100 spectrum    1 weight  0.11000E+01 volume  0.14110E-02 ppm1      0.396 ppm2      1.306 CV     1
 ASSI { 1102}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 8    and name HG  ))
      3.620     1.640     1.640 peak  1102 spectrum    1 weight  0.11000E+01 volume  0.12084E-02 ppm1      0.383 ppm2      0.880 CV     1
 ASSI { 1104}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HG1 ))
      2.490     0.770     0.770 peak  1104 spectrum    1 weight  0.11000E+01 volume  0.29970E-02 ppm1      1.646 ppm2      0.956 CV     1
 ASSI { 1106}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HG2 ))
      2.350     0.690     0.690 peak  1106 spectrum    1 weight  0.11000E+01 volume  0.64952E-02 ppm1      1.674 ppm2      1.142 CV     1
 OR { 1106}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HG1 ))
 OR { 1106}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HG2 ))
 OR { 1106}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HG1 ))
 ASSI { 1108}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG1 ))
      3.080     1.190     1.190 peak  1108 spectrum    1 weight  0.11000E+01 volume  0.15662E-02 ppm1      4.094 ppm2      1.680 CV     1
 OR { 1108}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG2 ))
 ASSI { 1110}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HG2 ))
      2.830     1.000     1.000 peak  1110 spectrum    1 weight  0.11000E+01 volume  0.53827E-02 ppm1      0.537 ppm2      0.213 CV     1
 ASSI { 1111}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HG2 ))
      2.560     0.820     0.820 peak  1111 spectrum    1 weight  0.11000E+01 volume  0.25256E-02 ppm1      0.777 ppm2      0.214 CV     1
 ASSI { 1113}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HG2 ))
      1.800     0.410     0.410 peak  1113 spectrum    1 weight  0.11000E+01 volume  0.88699E-02 ppm1      0.535 ppm2      0.877 CV     1
 ASSI { 1114}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 8    and name HG  ))
      2.140     0.570     0.570 peak  1114 spectrum    1 weight  0.11000E+01 volume  0.73749E-02 ppm1      0.590 ppm2      0.880 CV     1
 ASSI { 1115}
   (  segid "    " and resid 37   and name HB% )
   (  segid "    " and resid 8    and name HD2%)
      2.910     1.060     1.060 peak  1115 spectrum    1 weight  0.11000E+01 volume  0.18795E-02 ppm1      1.875 ppm2      0.612 CV     1
 ASSI { 1116}
   (( segid "    " and resid 10   and name HB1 ))
   (  segid "    " and resid 10   and name HD1%)
      2.060     0.530     0.530 peak  1116 spectrum    1 weight  0.11000E+01 volume  0.14440E-01 ppm1      1.371 ppm2      0.777 CV     1
 ASSI { 1117}
   (( segid "    " and resid 10   and name HB2 ))
   (  segid "    " and resid 10   and name HD1%)
      2.660     0.880     0.880 peak  1117 spectrum    1 weight  0.11000E+01 volume  0.84001E-02 ppm1      1.475 ppm2      0.778 CV     1
 ASSI { 1118}
   (( segid "    " and resid 10   and name HG  ))
   (  segid "    " and resid 10   and name HD1%)
      2.310     0.670     0.670 peak  1118 spectrum    1 weight  0.11000E+01 volume  0.50099E-02 ppm1      1.264 ppm2      0.779 CV     1
 ASSI { 1119}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HG2 ))
      2.360     0.700     0.700 peak  1119 spectrum    1 weight  0.11000E+01 volume  0.51797E-02 ppm1      1.569 ppm2      0.866 CV     1
 ASSI { 1120}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 10   and name HD1%)
      2.550     0.820     0.820 peak  1120 spectrum    1 weight  0.11000E+01 volume  0.43640E-02 ppm1      1.799 ppm2      0.776 CV     1
 ASSI { 1122}
   (( segid "    " and resid 33   and name HB1 ))
   (  segid "    " and resid 8    and name HD2%)
      2.250     0.630     0.630 peak  1122 spectrum    1 weight  0.11000E+01 volume  0.48469E-02 ppm1      3.399 ppm2      0.612 CV     1
 ASSI { 1126}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 10   and name HD1%)
      3.340     1.400     1.400 peak  1126 spectrum    1 weight  0.11000E+01 volume  0.17789E-02 ppm1      5.608 ppm2      0.783 CV     1
 ASSI { 1127}
   (  segid "    " and resid 36   and name HD% )
   (  segid "    " and resid 10   and name HD1%)
      2.850     1.010     1.010 peak  1127 spectrum    1 weight  0.11000E+01 volume  0.34858E-02 ppm1      6.995 ppm2      0.775 CV     1
 ASSI { 1128}
   (  segid "    " and resid 36   and name HD% )
   (  segid "    " and resid 8    and name HD2%)
      2.550     0.810     0.810 peak  1128 spectrum    1 weight  0.11000E+01 volume  0.37909E-02 ppm1      6.999 ppm2      0.612 CV     1
 ASSI { 1129}
   (  segid "    " and resid 36   and name HE% )
   (  segid "    " and resid 10   and name HD1%)
      2.590     0.840     0.840 peak  1129 spectrum    1 weight  0.11000E+01 volume  0.46968E-02 ppm1      6.754 ppm2      0.778 CV     1
 ASSI { 1130}
   (  segid "    " and resid 36   and name HE% )
   (  segid "    " and resid 8    and name HD2%)
      2.320     0.670     0.670 peak  1130 spectrum    1 weight  0.11000E+01 volume  0.49293E-02 ppm1      6.765 ppm2      0.613 CV     1
 ASSI { 1131}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 10   and name HD1%)
      2.810     0.990     0.990 peak  1131 spectrum    1 weight  0.11000E+01 volume  0.28160E-02 ppm1      8.720 ppm2      0.782 CV     1
 ASSI { 1132}
   (( segid "    " and resid 16   and name HD1 ))
   (( segid "    " and resid 16   and name HG2 ))
      1.880     0.440     0.440 peak  1132 spectrum    1 weight  0.11000E+01 volume  0.26009E-01 ppm1      1.691 ppm2      1.482 CV     1
 ASSI { 1133}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HG1 ))
      2.180     0.590     0.590 peak  1133 spectrum    1 weight  0.11000E+01 volume  0.41386E-02 ppm1      1.147 ppm2      1.678 CV     1
 OR { 1133}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HG2 ))
 ASSI { 1134}
   (( segid "    " and resid 33   and name HB2 ))
   (  segid "    " and resid 8    and name HD2%)
      3.700     1.710     1.710 peak  1134 spectrum    1 weight  0.11000E+01 volume  0.18173E-02 ppm1      3.002 ppm2      0.612 CV     1
 ASSI { 1135}
   (( segid "    " and resid 8    and name HB1 ))
   (  segid "    " and resid 8    and name HD2%)
      1.870     0.440     0.440 peak  1135 spectrum    1 weight  0.11000E+01 volume  0.17116E-01 ppm1      0.802 ppm2      0.612 CV     1
 ASSI { 1136}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HG1 ))
      2.540     0.810     0.810 peak  1136 spectrum    1 weight  0.11000E+01 volume  0.32078E-02 ppm1      5.201 ppm2      1.485 CV     1
 ASSI { 1137}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 16   and name HG2 ))
      2.820     0.990     0.990 peak  1137 spectrum    1 weight  0.11000E+01 volume  0.33522E-02 ppm1      2.997 ppm2      1.485 CV     1
 OR { 1137}
   (( segid "    " and resid 16   and name HE2 ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 1139}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 15   and name HD2%)
      2.480     0.770     0.770 peak  1139 spectrum    1 weight  0.11000E+01 volume  0.25332E-02 ppm1      2.711 ppm2      0.818 CV     1
 ASSI { 1140}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HG1 ))
      2.950     1.090     1.090 peak  1140 spectrum    1 weight  0.11000E+01 volume  0.18855E-02 ppm1      4.082 ppm2      1.485 CV     1
 OR { 1140}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HG2 ))
 ASSI { 1141}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.680     0.900     0.900 peak  1141 spectrum    1 weight  0.11000E+01 volume  0.33164E-02 ppm1      1.502 ppm2      1.043 CV     1
 OR { 1141}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI { 1142}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.720     0.930     0.930 peak  1142 spectrum    1 weight  0.11000E+01 volume  0.22400E-02 ppm1      1.356 ppm2      1.043 CV     1
 ASSI { 1143}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG1 ))
      3.210     1.290     1.290 peak  1143 spectrum    1 weight  0.11000E+01 volume  0.18397E-02 ppm1     -0.081 ppm2      1.044 CV     1
 ASSI { 1144}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.620     0.860     0.860 peak  1144 spectrum    1 weight  0.11000E+01 volume  0.23089E-02 ppm1     -0.083 ppm2      0.876 CV     1
 ASSI { 1145}
   (( segid "    " and resid 8    and name HB1 ))
   (  segid "    " and resid 8    and name HD1%)
      3.070     1.180     1.180 peak  1145 spectrum    1 weight  0.11000E+01 volume  0.48632E-02 ppm1     -1.108 ppm2      0.560 CV     1
 ASSI { 1146}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 8    and name HD1%)
      2.610     0.850     0.850 peak  1146 spectrum    1 weight  0.11000E+01 volume  0.31947E-02 ppm1     -0.318 ppm2      0.560 CV     1
 ASSI { 1147}
   (( segid "    " and resid 8    and name HG  ))
   (  segid "    " and resid 8    and name HD1%)
      2.070     0.530     0.530 peak  1147 spectrum    1 weight  0.11000E+01 volume  0.10347E-01 ppm1      0.881 ppm2      0.561 CV     1
 ASSI { 1148}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 8    and name HD1%)
      2.910     1.060     1.060 peak  1148 spectrum    1 weight  0.11000E+01 volume  0.18617E-02 ppm1      5.210 ppm2      0.561 CV     1
 ASSI { 1149}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 8    and name HD1%)
      2.370     0.700     0.700 peak  1149 spectrum    1 weight  0.11000E+01 volume  0.61400E-02 ppm1      4.975 ppm2      0.560 CV     1
 ASSI { 1150}
   (( segid "    " and resid 33   and name HB1 ))
   (  segid "    " and resid 8    and name HD1%)
      2.580     0.830     0.830 peak  1150 spectrum    1 weight  0.11000E+01 volume  0.32276E-02 ppm1      3.419 ppm2      0.561 CV     1
 ASSI { 1151}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 8    and name HD1%)
      2.340     0.680     0.680 peak  1151 spectrum    1 weight  0.11000E+01 volume  0.63574E-02 ppm1      3.204 ppm2      0.560 CV     1
 ASSI { 1152}
   (( segid "    " and resid 33   and name HB2 ))
   (  segid "    " and resid 8    and name HD1%)
      3.300     1.360     1.360 peak  1152 spectrum    1 weight  0.11000E+01 volume  0.16265E-02 ppm1      3.016 ppm2      0.560 CV     1
 ASSI { 1153}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HG1 ))
      1.810     0.410     0.410 peak  1153 spectrum    1 weight  0.11000E+01 volume  0.12733E-01 ppm1      0.872 ppm2      1.047 CV     1
 ASSI { 1154}
   (( segid "    " and resid 104  and name HD1 ))
   (( segid "    " and resid 104  and name HG2 ))
      3.650     1.660     1.660 peak  1154 spectrum    1 weight  0.11000E+01 volume  0.11445E-02 ppm1      2.570 ppm2      0.212 CV     1
 ASSI { 1155}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 104  and name HG2 ))
      2.900     1.050     1.050 peak  1155 spectrum    1 weight  0.11000E+01 volume  0.10944E-02 ppm1      2.357 ppm2      0.211 CV     1
 ASSI { 1160}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HG2 ))
      2.890     1.040     1.040 peak  1160 spectrum    1 weight  0.11000E+01 volume  0.15980E-02 ppm1      8.742 ppm2      1.133 CV     1
 ASSI { 1161}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HG1 ))
      3.190     1.270     1.270 peak  1161 spectrum    1 weight  0.11000E+01 volume  0.12624E-02 ppm1      8.744 ppm2      0.955 CV     1
 ASSI { 1162}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 75   and name HG  ))
      2.770     0.960     0.960 peak  1162 spectrum    1 weight  0.11000E+01 volume  0.26111E-02 ppm1      8.944 ppm2      1.078 CV     1
 ASSI { 1164}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HG  ))
      3.730     1.740     1.740 peak  1164 spectrum    1 weight  0.11000E+01 volume  0.16823E-02 ppm1      8.390 ppm2      1.078 CV     1
 ASSI { 1167}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 16   and name HG1 ))
      3.210     1.290     1.290 peak  1167 spectrum    1 weight  0.11000E+01 volume  0.11628E-02 ppm1      9.308 ppm2      1.491 CV     1
 ASSI { 1168}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 8    and name HD1%)
      2.610     0.850     0.850 peak  1168 spectrum    1 weight  0.11000E+01 volume  0.44923E-02 ppm1      9.112 ppm2      0.560 CV     1
 ASSI { 1169}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 8    and name HD1%)
      3.170     1.260     1.260 peak  1169 spectrum    1 weight  0.11000E+01 volume  0.15868E-02 ppm1      8.261 ppm2      0.560 CV     1
 ASSI { 1170}
   (  segid "    " and resid 55   and name HD% )
   (  segid "    " and resid 8    and name HD1%)
      3.710     1.720     1.720 peak  1170 spectrum    1 weight  0.11000E+01 volume  0.14484E-02 ppm1      7.594 ppm2      0.560 CV     1
 ASSI { 1171}
   (( segid "    " and resid 46   and name HH2 ))
   (  segid "    " and resid 8    and name HD1%)
      2.610     0.850     0.850 peak  1171 spectrum    1 weight  0.11000E+01 volume  0.38123E-02 ppm1      6.759 ppm2      0.560 CV     1
 ASSI { 1172}
   (( segid "    " and resid 46   and name HZ3 ))
   (  segid "    " and resid 8    and name HD1%)
      2.590     0.840     0.840 peak  1172 spectrum    1 weight  0.11000E+01 volume  0.43059E-02 ppm1      6.637 ppm2      0.560 CV     1
 ASSI { 1174}
   (( segid "    " and resid 28   and name HB  ))
   (  segid "    " and resid 23   and name HB% )
      2.630     0.870     0.870 peak  1174 spectrum    1 weight  0.11000E+01 volume  0.33961E-02 ppm1      4.013 ppm2      1.308 CV     1
 ASSI { 1175}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      2.310     0.670     0.670 peak  1175 spectrum    1 weight  0.11000E+01 volume  0.78316E-02 ppm1      4.887 ppm2      1.308 CV     1
 ASSI { 1177}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      2.720     0.920     0.920 peak  1177 spectrum    1 weight  0.11000E+01 volume  0.40479E-02 ppm1      6.966 ppm2      1.308 CV     1
 ASSI { 1179}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      2.790     0.980     0.980 peak  1179 spectrum    1 weight  0.11000E+01 volume  0.29752E-02 ppm1      8.459 ppm2      1.308 CV     1
 ASSI { 1180}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 75   and name HD1%)
      3.640     1.650     1.650 peak  1180 spectrum    1 weight  0.11000E+01 volume  0.16772E-02 ppm1      8.406 ppm2      0.759 CV     1
 ASSI { 1181}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 75   and name HD1%)
      2.290     0.650     0.650 peak  1181 spectrum    1 weight  0.11000E+01 volume  0.56920E-02 ppm1      4.134 ppm2      0.759 CV     1
 ASSI { 1182}
   (( segid "    " and resid 75   and name HG  ))
   (  segid "    " and resid 75   and name HD1%)
      2.100     0.550     0.550 peak  1182 spectrum    1 weight  0.11000E+01 volume  0.10773E-01 ppm1      1.088 ppm2      0.759 CV     1
 ASSI { 1183}
   (( segid "    " and resid 81   and name HB1 ))
   (  segid "    " and resid 75   and name HD1%)
      2.640     0.870     0.870 peak  1183 spectrum    1 weight  0.11000E+01 volume  0.93825E-02 ppm1      1.771 ppm2      0.759 CV     1
 ASSI { 1184}
   (( segid "    " and resid 76   and name HD1 ))
   (  segid "    " and resid 75   and name HD1%)
      2.930     1.070     1.070 peak  1184 spectrum    1 weight  0.11000E+01 volume  0.30124E-02 ppm1      3.246 ppm2      0.759 CV     1
 ASSI { 1185}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 15   and name HD1%)
      3.070     1.180     1.180 peak  1185 spectrum    1 weight  0.11000E+01 volume  0.28318E-02 ppm1      8.153 ppm2      0.907 CV     1
 ASSI { 1186}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HG1 ))
      2.510     0.790     0.790 peak  1186 spectrum    1 weight  0.11000E+01 volume  0.76986E-02 ppm1      1.706 ppm2      1.388 CV     1
 ASSI { 1187}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 15   and name HD1%)
      2.580     0.830     0.830 peak  1187 spectrum    1 weight  0.11000E+01 volume  0.78055E-02 ppm1      1.488 ppm2      0.908 CV     1
 ASSI { 1188}
   (( segid "    " and resid 15   and name HB1 ))
   (  segid "    " and resid 15   and name HD1%)
      2.380     0.710     0.710 peak  1188 spectrum    1 weight  0.11000E+01 volume  0.71438E-02 ppm1      1.407 ppm2      0.909 CV     1
 ASSI { 1189}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 75   and name HD1%)
      2.570     0.830     0.830 peak  1189 spectrum    1 weight  0.11000E+01 volume  0.37264E-02 ppm1      1.408 ppm2      0.758 CV     1
 ASSI { 1190}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 84   and name HG2%)
      2.370     0.700     0.700 peak  1190 spectrum    1 weight  0.11000E+01 volume  0.50604E-02 ppm1      9.609 ppm2      1.476 CV     1
 ASSI { 1191}
   (  segid "    " and resid 90   and name HD% )
   (  segid "    " and resid 84   and name HG2%)
      2.550     0.810     0.810 peak  1191 spectrum    1 weight  0.11000E+01 volume  0.34588E-02 ppm1      6.768 ppm2      1.476 CV     1
 ASSI { 1192}
   (  segid "    " and resid 90   and name HE% )
   (  segid "    " and resid 84   and name HG2%)
      2.810     0.990     0.990 peak  1192 spectrum    1 weight  0.11000E+01 volume  0.28715E-02 ppm1      6.276 ppm2      1.476 CV     1
 ASSI { 1193}
   (( segid "    " and resid 84   and name HB  ))
   (  segid "    " and resid 84   and name HG2%)
      2.340     0.690     0.690 peak  1193 spectrum    1 weight  0.11000E+01 volume  0.50271E-02 ppm1      4.951 ppm2      1.476 CV     1
 ASSI { 1194}
   (( segid "    " and resid 88   and name HB  ))
   (  segid "    " and resid 84   and name HG2%)
      2.460     0.760     0.760 peak  1194 spectrum    1 weight  0.11000E+01 volume  0.41957E-02 ppm1      2.304 ppm2      1.476 CV     1
 ASSI { 1195}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      2.480     0.770     0.770 peak  1195 spectrum    1 weight  0.11000E+01 volume  0.52195E-02 ppm1      7.643 ppm2      0.920 CV     1
 ASSI { 1196}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 32   and name HG1%)
      2.890     1.050     1.050 peak  1196 spectrum    1 weight  0.11000E+01 volume  0.91360E-02 ppm1      7.443 ppm2      0.940 CV     1
 ASSI { 1197}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HG2%)
      2.520     0.790     0.790 peak  1197 spectrum    1 weight  0.11000E+01 volume  0.42026E-02 ppm1      8.148 ppm2      0.852 CV     1
 ASSI { 1198}
   (  segid "    " and resid 90   and name HD% )
   (  segid "    " and resid 99   and name HG2%)
      2.600     0.840     0.840 peak  1198 spectrum    1 weight  0.11000E+01 volume  0.44402E-02 ppm1      6.767 ppm2      1.062 CV     1
 ASSI { 1199}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HG1%)
      2.410     0.720     0.720 peak  1199 spectrum    1 weight  0.11000E+01 volume  0.59298E-02 ppm1      4.179 ppm2      0.673 CV     1
 ASSI { 1200}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 88   and name HG2%)
      2.320     0.670     0.670 peak  1200 spectrum    1 weight  0.11000E+01 volume  0.78667E-02 ppm1      4.175 ppm2      0.919 CV     1
 ASSI { 1201}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      2.290     0.660     0.660 peak  1201 spectrum    1 weight  0.11000E+01 volume  0.73725E-02 ppm1      4.179 ppm2      0.852 CV     1
 ASSI { 1202}
   (( segid "    " and resid 99   and name HB  ))
   (  segid "    " and resid 99   and name HG2%)
      2.410     0.730     0.730 peak  1202 spectrum    1 weight  0.11000E+01 volume  0.63354E-02 ppm1      3.935 ppm2      1.062 CV     1
 ASSI { 1203}
   (( segid "    " and resid 47   and name HB  ))
   (  segid "    " and resid 47   and name HG2%)
      2.120     0.560     0.560 peak  1203 spectrum    1 weight  0.11000E+01 volume  0.13840E-01 ppm1      4.281 ppm2      1.221 CV     1
 ASSI { 1204}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
      2.420     0.730     0.730 peak  1204 spectrum    1 weight  0.11000E+01 volume  0.68605E-02 ppm1      4.849 ppm2      1.223 CV     1
 ASSI { 1205}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HG2%)
      2.570     0.820     0.820 peak  1205 spectrum    1 weight  0.11000E+01 volume  0.43457E-02 ppm1      5.305 ppm2      1.062 CV     1
 ASSI { 1206}
   (  segid "    " and resid 90   and name HE% )
   (  segid "    " and resid 99   and name HG2%)
      2.790     0.970     0.970 peak  1206 spectrum    1 weight  0.11000E+01 volume  0.28928E-02 ppm1      6.275 ppm2      1.062 CV     1
 ASSI { 1207}
   (( segid "    " and resid 88   and name HB  ))
   (  segid "    " and resid 88   and name HG2%)
      2.080     0.540     0.540 peak  1207 spectrum    1 weight  0.11000E+01 volume  0.12903E-01 ppm1      2.305 ppm2      0.920 CV     1
 ASSI { 1208}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 32   and name HG1%)
      2.110     0.560     0.560 peak  1208 spectrum    1 weight  0.11000E+01 volume  0.11715E-01 ppm1      1.796 ppm2      0.939 CV     1
 ASSI { 1209}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG2%)
      2.080     0.540     0.540 peak  1209 spectrum    1 weight  0.11000E+01 volume  0.12067E-01 ppm1      1.759 ppm2      0.851 CV     1
 ASSI { 1210}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG1%)
      2.180     0.590     0.590 peak  1210 spectrum    1 weight  0.11000E+01 volume  0.92281E-02 ppm1      1.770 ppm2      0.673 CV     1
 ASSI { 1212}
   (  segid "    " and resid 92   and name HG1%)
   (  segid "    " and resid 99   and name HG2%)
      2.400     0.720     0.720 peak  1212 spectrum    1 weight  0.11000E+01 volume  0.80876E-02 ppm1      0.735 ppm2      1.063 CV     1
 ASSI { 1215}
   (  segid "    " and resid 42   and name HG2%)
   (  segid "    " and resid 42   and name HG1%)
      2.090     0.540     0.540 peak  1215 spectrum    1 weight  0.11000E+01 volume  0.15016E-01 ppm1      0.866 ppm2      0.673 CV     1
 ASSI { 1216}
   (  segid "    " and resid 57   and name HG1%)
   (  segid "    " and resid 42   and name HG1%)
      2.330     0.680     0.680 peak  1216 spectrum    1 weight  0.11000E+01 volume  0.66169E-02 ppm1      0.370 ppm2      0.674 CV     1
 ASSI { 1217}
   (( segid "    " and resid 28   and name HB  ))
   (  segid "    " and resid 28   and name HG2%)
      2.340     0.680     0.680 peak  1217 spectrum    1 weight  0.11000E+01 volume  0.71622E-02 ppm1      4.001 ppm2      1.226 CV     1
 ASSI { 1218}
   (( segid "    " and resid 98   and name HB  ))
   (  segid "    " and resid 98   and name HG2%)
      2.300     0.660     0.660 peak  1218 spectrum    1 weight  0.11000E+01 volume  0.88283E-02 ppm1      3.980 ppm2      1.146 CV     1
 ASSI { 1219}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 58   and name HG2%)
      2.190     0.600     0.600 peak  1219 spectrum    1 weight  0.11000E+01 volume  0.11107E-01 ppm1      3.886 ppm2      1.186 CV     1
 ASSI { 1221}
   (( segid "    " and resid 52   and name HB  ))
   (  segid "    " and resid 52   and name HG2%)
      2.070     0.540     0.540 peak  1221 spectrum    1 weight  0.11000E+01 volume  0.17001E-01 ppm1      4.418 ppm2      1.096 CV     1
 OR { 1221}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 52   and name HG2%)
 ASSI { 1222}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 20   and name HG2%)
      2.190     0.600     0.600 peak  1222 spectrum    1 weight  0.11000E+01 volume  0.10300E-01 ppm1      4.337 ppm2      1.208 CV     1
 ASSI { 1223}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HG2%)
      1.960     0.480     0.480 peak  1223 spectrum    1 weight  0.11000E+01 volume  0.23998E-01 ppm1      4.326 ppm2      1.155 CV     1
 OR { 1223}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI { 1224}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      2.280     0.650     0.650 peak  1224 spectrum    1 weight  0.11000E+01 volume  0.84636E-02 ppm1      4.739 ppm2      1.186 CV     1
 ASSI { 1225}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HG2%)
      2.550     0.810     0.810 peak  1225 spectrum    1 weight  0.11000E+01 volume  0.59671E-02 ppm1      4.633 ppm2      1.146 CV     1
 ASSI { 1227}
   (( segid "    " and resid 11   and name HD21))
   (  segid "    " and resid 58   and name HG2%)
      2.620     0.860     0.860 peak  1227 spectrum    1 weight  0.11000E+01 volume  0.39084E-02 ppm1      7.121 ppm2      1.182 CV     1
 ASSI { 1228}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      2.750     0.950     0.950 peak  1228 spectrum    1 weight  0.11000E+01 volume  0.32089E-02 ppm1      8.150 ppm2      1.186 CV     1
 ASSI { 1229}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 88   and name HG1%)
      2.570     0.820     0.820 peak  1229 spectrum    1 weight  0.11000E+01 volume  0.37566E-02 ppm1      8.760 ppm2      1.176 CV     1
 ASSI { 1230}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 42   and name HG1%)
      2.780     0.970     0.970 peak  1230 spectrum    1 weight  0.11000E+01 volume  0.31348E-02 ppm1      8.486 ppm2      0.673 CV     1
 ASSI { 1231}
   (  segid "    " and resid 51   and name HB% )
   (  segid "    " and resid 52   and name HG2%)
      2.600     0.850     0.850 peak  1231 spectrum    1 weight  0.11000E+01 volume  0.48329E-02 ppm1      1.545 ppm2      1.097 CV     1
 ASSI { 1232}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 56   and name HG2%)
      2.370     0.700     0.700 peak  1232 spectrum    1 weight  0.11000E+01 volume  0.67779E-02 ppm1      5.212 ppm2      0.971 CV     1
 ASSI { 1233}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HG2%)
      2.400     0.720     0.720 peak  1233 spectrum    1 weight  0.11000E+01 volume  0.60081E-02 ppm1      5.551 ppm2      0.998 CV     1
 ASSI { 1234}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
      2.400     0.720     0.720 peak  1234 spectrum    1 weight  0.11000E+01 volume  0.58134E-02 ppm1      4.507 ppm2     -0.340 CV     1
 ASSI { 1236}
   (( segid "    " and resid 56   and name HB  ))
   (  segid "    " and resid 56   and name HG2%)
      2.230     0.620     0.620 peak  1236 spectrum    1 weight  0.11000E+01 volume  0.92358E-02 ppm1      3.847 ppm2      0.971 CV     1
 ASSI { 1237}
   (( segid "    " and resid 54   and name HB  ))
   (  segid "    " and resid 54   and name HG2%)
      2.260     0.640     0.640 peak  1237 spectrum    1 weight  0.11000E+01 volume  0.85824E-02 ppm1      3.771 ppm2      0.997 CV     1
 ASSI { 1238}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG1%)
      2.290     0.650     0.650 peak  1238 spectrum    1 weight  0.11000E+01 volume  0.85183E-02 ppm1      2.091 ppm2      0.832 CV     1
 ASSI { 1240}
   (  segid "    " and resid 42   and name HG1%)
   (  segid "    " and resid 57   and name HG2%)
      2.500     0.780     0.780 peak  1240 spectrum    1 weight  0.11000E+01 volume  0.51763E-02 ppm1      0.658 ppm2     -0.340 CV     1
 ASSI { 1241}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 54   and name HG2%)
      2.740     0.940     0.940 peak  1241 spectrum    1 weight  0.11000E+01 volume  0.32555E-02 ppm1     10.313 ppm2      0.998 CV     1
 ASSI { 1242}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      2.620     0.860     0.860 peak  1242 spectrum    1 weight  0.11000E+01 volume  0.43179E-02 ppm1      8.260 ppm2      0.971 CV     1
 ASSI { 1243}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
      2.690     0.910     0.910 peak  1243 spectrum    1 weight  0.11000E+01 volume  0.34487E-02 ppm1      8.466 ppm2      0.833 CV     1
 ASSI { 1244}
   (( segid "    " and resid 46   and name HE1 ))
   (  segid "    " and resid 57   and name HG2%)
      2.980     1.110     1.110 peak  1244 spectrum    1 weight  0.11000E+01 volume  0.18697E-02 ppm1     10.558 ppm2     -0.341 CV     1
 ASSI { 1245}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
      2.960     1.090     1.090 peak  1245 spectrum    1 weight  0.11000E+01 volume  0.29208E-02 ppm1      8.389 ppm2     -0.341 CV     1
 ASSI { 1247}
   (( segid "    " and resid 44   and name HA2 ))
   (  segid "    " and resid 57   and name HG2%)
      3.500     1.530     1.530 peak  1247 spectrum    1 weight  0.11000E+01 volume  0.23866E-02 ppm1      3.805 ppm2     -0.340 CV     1
 ASSI { 1248}
   (( segid "    " and resid 9    and name HG12))
   (  segid "    " and resid 54   and name HG2%)
      2.940     1.080     1.080 peak  1248 spectrum    1 weight  0.11000E+01 volume  0.58343E-02 ppm1      1.434 ppm2      0.998 CV     1
 ASSI { 1249}
   (( segid "    " and resid 7    and name HG2 ))
   (  segid "    " and resid 54   and name HG2%)
      2.460     0.760     0.760 peak  1249 spectrum    1 weight  0.11000E+01 volume  0.58458E-02 ppm1      1.357 ppm2      0.999 CV     1
 OR { 1249}
   (( segid "    " and resid 7    and name HG1 ))
   (  segid "    " and resid 54   and name HG2%)
 ASSI { 1250}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 54   and name HG2%)
      2.440     0.750     0.750 peak  1250 spectrum    1 weight  0.11000E+01 volume  0.60633E-02 ppm1      2.005 ppm2      0.996 CV     1
 ASSI { 1251}
   (( segid "    " and resid 9    and name HB  ))
   (  segid "    " and resid 56   and name HG2%)
      2.330     0.680     0.680 peak  1251 spectrum    1 weight  0.11000E+01 volume  0.67060E-02 ppm1      1.991 ppm2      0.972 CV     1
 ASSI { 1252}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG2%)
      2.270     0.640     0.640 peak  1252 spectrum    1 weight  0.11000E+01 volume  0.86674E-02 ppm1      2.081 ppm2      0.921 CV     1
 ASSI { 1253}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 57   and name HG1%)
      2.250     0.630     0.630 peak  1253 spectrum    1 weight  0.11000E+01 volume  0.70101E-02 ppm1      4.515 ppm2      0.399 CV     1
 ASSI { 1254}
   (( segid "    " and resid 91   and name HB1 ))
   (  segid "    " and resid 100  and name HG2%)
      2.800     0.980     0.980 peak  1254 spectrum    1 weight  0.11000E+01 volume  0.61625E-02 ppm1      3.165 ppm2      1.541 CV     1
 ASSI { 1255}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 100  and name HG2%)
      2.270     0.640     0.640 peak  1255 spectrum    1 weight  0.11000E+01 volume  0.90321E-02 ppm1      4.388 ppm2      1.541 CV     1
 ASSI { 1256}
   (( segid "    " and resid 79   and name HZ3 ))
   (  segid "    " and resid 100  and name HG2%)
      2.450     0.750     0.750 peak  1256 spectrum    1 weight  0.11000E+01 volume  0.60538E-02 ppm1      6.772 ppm2      1.540 CV     1
 ASSI { 1257}
   (( segid "    " and resid 79   and name HH2 ))
   (  segid "    " and resid 100  and name HG2%)
      2.790     0.970     0.970 peak  1257 spectrum    1 weight  0.11000E+01 volume  0.38735E-02 ppm1      7.110 ppm2      1.540 CV     1
 ASSI { 1258}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      2.550     0.810     0.810 peak  1258 spectrum    1 weight  0.11000E+01 volume  0.46053E-02 ppm1      9.265 ppm2      1.540 CV     1
 ASSI { 1259}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HG1%)
      2.460     0.760     0.760 peak  1259 spectrum    1 weight  0.11000E+01 volume  0.43190E-02 ppm1      8.264 ppm2      0.399 CV     1
 ASSI { 1260}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 100  and name HG2%)
      2.910     1.060     1.060 peak  1260 spectrum    1 weight  0.11000E+01 volume  0.23545E-02 ppm1      8.655 ppm2      1.540 CV     1
 ASSI { 1261}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
      2.300     0.660     0.660 peak  1261 spectrum    1 weight  0.11000E+01 volume  0.11248E-01 ppm1      8.364 ppm2      1.394 CV     1
 ASSI { 1262}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 74   and name HB% )
      2.220     0.620     0.620 peak  1262 spectrum    1 weight  0.11000E+01 volume  0.10687E-01 ppm1      4.246 ppm2      1.394 CV     1
 ASSI { 1263}
   (  segid "    " and resid 57   and name HG2%)
   (  segid "    " and resid 57   and name HG1%)
      2.110     0.550     0.550 peak  1263 spectrum    1 weight  0.11000E+01 volume  0.13167E-01 ppm1     -0.327 ppm2      0.399 CV     1
 ASSI { 1264}
   (  segid "    " and resid 92   and name HG1%)
   (  segid "    " and resid 92   and name HG2%)
      2.230     0.620     0.620 peak  1264 spectrum    1 weight  0.11000E+01 volume  0.11202E-01 ppm1      0.732 ppm2      0.241 CV     1
 ASSI { 1265}
   (( segid "    " and resid 92   and name HB  ))
   (  segid "    " and resid 92   and name HG2%)
      2.230     0.620     0.620 peak  1265 spectrum    1 weight  0.11000E+01 volume  0.84042E-02 ppm1      1.623 ppm2      0.240 CV     1
 ASSI { 1266}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 92   and name HG2%)
      2.590     0.840     0.840 peak  1266 spectrum    1 weight  0.11000E+01 volume  0.36493E-02 ppm1      4.364 ppm2      0.241 CV     1
 ASSI { 1267}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 92   and name HG2%)
      3.400     1.450     1.450 peak  1267 spectrum    1 weight  0.11000E+01 volume  0.16649E-02 ppm1      2.033 ppm2      0.241 CV     1
 ASSI { 1268}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 21   and name HG2%)
      2.670     0.890     0.890 peak  1268 spectrum    1 weight  0.11000E+01 volume  0.35508E-02 ppm1      1.291 ppm2      0.546 CV     1
 ASSI { 1270}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 21   and name HG2%)
      2.690     0.900     0.900 peak  1270 spectrum    1 weight  0.11000E+01 volume  0.35249E-02 ppm1      3.118 ppm2      0.545 CV     1
 ASSI { 1271}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 24   and name HG2%)
      3.030     1.150     1.150 peak  1271 spectrum    1 weight  0.11000E+01 volume  0.32572E-02 ppm1      4.078 ppm2      0.921 CV     1
 ASSI { 1273}
   (( segid "    " and resid 21   and name HB  ))
   (  segid "    " and resid 21   and name HG2%)
      2.390     0.710     0.710 peak  1273 spectrum    1 weight  0.11000E+01 volume  0.61126E-02 ppm1      3.946 ppm2      0.546 CV     1
 ASSI { 1274}
   (( segid "    " and resid 19   and name HB  ))
   (  segid "    " and resid 19   and name HG2%)
      2.290     0.660     0.660 peak  1274 spectrum    1 weight  0.11000E+01 volume  0.71236E-02 ppm1      3.868 ppm2      0.382 CV     1
 ASSI { 1275}
   (( segid "    " and resid 33   and name HZ  ))
   (  segid "    " and resid 21   and name HG2%)
      2.520     0.800     0.800 peak  1275 spectrum    1 weight  0.11000E+01 volume  0.49373E-02 ppm1      7.181 ppm2      0.546 CV     1
 ASSI { 1276}
   (  segid "    " and resid 33   and name HD% )
   (  segid "    " and resid 19   and name HG2%)
      2.940     1.080     1.080 peak  1276 spectrum    1 weight  0.11000E+01 volume  0.29802E-02 ppm1      7.140 ppm2      0.382 CV     1
 ASSI { 1277}
   (  segid "    " and resid 36   and name HE% )
   (  segid "    " and resid 19   and name HG2%)
      2.650     0.880     0.880 peak  1277 spectrum    1 weight  0.11000E+01 volume  0.30918E-02 ppm1      6.755 ppm2      0.382 CV     1
 ASSI { 1278}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 57   and name HG1%)
      3.060     1.170     1.170 peak  1278 spectrum    1 weight  0.11000E+01 volume  0.20188E-02 ppm1      8.859 ppm2      0.400 CV     1
 ASSI { 1280}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 19   and name HG2%)
      2.710     0.920     0.920 peak  1280 spectrum    1 weight  0.11000E+01 volume  0.28515E-02 ppm1      8.760 ppm2      0.382 CV     1
 ASSI { 1283}
   (( segid "    " and resid 8    and name HB1 ))
   (  segid "    " and resid 19   and name HG2%)
      2.640     0.870     0.870 peak  1283 spectrum    1 weight  0.11000E+01 volume  0.21739E-02 ppm1     -1.122 ppm2      0.382 CV     1
 ASSI { 1284}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HG2%)
      3.720     1.730     1.730 peak  1284 spectrum    1 weight  0.11000E+01 volume  0.22703E-02 ppm1      8.203 ppm2      0.241 CV     1
 ASSI { 1287}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HB% )
      2.180     0.600     0.600 peak  1287 spectrum    1 weight  0.11000E+01 volume  0.12700E-01 ppm1      4.128 ppm2      1.522 CV     1
 ASSI { 1288}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
      2.860     1.020     1.020 peak  1288 spectrum    1 weight  0.11000E+01 volume  0.24745E-02 ppm1      7.006 ppm2      1.522 CV     1
 ASSI { 1290}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 37   and name HB% )
      2.630     0.860     0.860 peak  1290 spectrum    1 weight  0.11000E+01 volume  0.44755E-02 ppm1      8.286 ppm2      1.871 CV     1
 ASSI { 1291}
   (( segid "    " and resid 46   and name HZ2 ))
   (  segid "    " and resid 37   and name HB% )
      2.380     0.710     0.710 peak  1291 spectrum    1 weight  0.11000E+01 volume  0.66781E-02 ppm1      7.373 ppm2      1.870 CV     1
 ASSI { 1292}
   (  segid "    " and resid 36   and name HE% )
   (  segid "    " and resid 37   and name HB% )
      3.070     1.180     1.180 peak  1292 spectrum    1 weight  0.11000E+01 volume  0.33007E-02 ppm1      6.778 ppm2      1.870 CV     1
 ASSI { 1293}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 37   and name HB% )
      2.570     0.830     0.830 peak  1293 spectrum    1 weight  0.11000E+01 volume  0.38546E-02 ppm1      4.196 ppm2      1.871 CV     1
 ASSI { 1295}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 26   and name HB% )
      2.270     0.640     0.640 peak  1295 spectrum    1 weight  0.11000E+01 volume  0.89875E-02 ppm1      3.520 ppm2      1.337 CV     1
 ASSI { 1296}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 27   and name HB% )
      2.190     0.600     0.600 peak  1296 spectrum    1 weight  0.11000E+01 volume  0.12108E-01 ppm1      3.984 ppm2      1.315 CV     1
 ASSI { 1297}
   (  segid "    " and resid 6    and name HE% )
   (  segid "    " and resid 26   and name HB% )
      2.920     1.070     1.070 peak  1297 spectrum    1 weight  0.11000E+01 volume  0.28989E-02 ppm1      6.969 ppm2      1.336 CV     1
 ASSI { 1299}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 26   and name HB% )
      2.290     0.660     0.660 peak  1299 spectrum    1 weight  0.11000E+01 volume  0.84197E-02 ppm1      8.417 ppm2      1.335 CV     1
 ASSI { 1300}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 70   and name HG2%)
      2.840     1.000     1.000 peak  1300 spectrum    1 weight  0.11000E+01 volume  0.27249E-02 ppm1      4.189 ppm2      0.918 CV     1
 ASSI { 1301}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 70   and name HG2%)
      2.460     0.750     0.750 peak  1301 spectrum    1 weight  0.11000E+01 volume  0.55606E-02 ppm1      1.896 ppm2      0.918 CV     1
 ASSI { 1302}
   (  segid "    " and resid 57   and name HG1%)
   (  segid "    " and resid 37   and name HB% )
      2.690     0.900     0.900 peak  1302 spectrum    1 weight  0.11000E+01 volume  0.33036E-02 ppm1      0.394 ppm2      1.870 CV     1
 ASSI { 1303}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 37   and name HB% )
      2.520     0.790     0.790 peak  1303 spectrum    1 weight  0.11000E+01 volume  0.44511E-02 ppm1      0.776 ppm2      1.872 CV     1
 ASSI { 1304}
   (  segid "    " and resid 57   and name HG2%)
   (  segid "    " and resid 37   and name HB% )
      3.130     1.230     1.230 peak  1304 spectrum    1 weight  0.11000E+01 volume  0.15364E-02 ppm1     -0.336 ppm2      1.872 CV     1
 ASSI { 1307}
   (( segid "    " and resid 6    and name HB2 ))
   (  segid "    " and resid 29   and name HB% )
      3.050     1.160     1.160 peak  1307 spectrum    1 weight  0.11000E+01 volume  0.17430E-02 ppm1      3.324 ppm2      0.484 CV     1
 ASSI { 1309}
   (( segid "    " and resid 6    and name HB1 ))
   (  segid "    " and resid 29   and name HB% )
      2.750     0.950     0.950 peak  1309 spectrum    1 weight  0.11000E+01 volume  0.27567E-02 ppm1      2.811 ppm2      0.484 CV     1
 ASSI { 1310}
   (  segid "    " and resid 6    and name HD% )
   (  segid "    " and resid 29   and name HB% )
      2.660     0.890     0.890 peak  1310 spectrum    1 weight  0.11000E+01 volume  0.38403E-02 ppm1      7.190 ppm2      0.483 CV     1
 ASSI { 1311}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      2.320     0.680     0.680 peak  1311 spectrum    1 weight  0.11000E+01 volume  0.73380E-02 ppm1      6.967 ppm2      0.483 CV     1
 ASSI { 1312}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      2.750     0.950     0.950 peak  1312 spectrum    1 weight  0.11000E+01 volume  0.28767E-02 ppm1      7.969 ppm2      0.483 CV     1
 ASSI { 1313}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      2.740     0.940     0.940 peak  1313 spectrum    1 weight  0.11000E+01 volume  0.32491E-02 ppm1      8.717 ppm2      0.810 CV     1
 ASSI { 1315}
   (( segid "    " and resid 9    and name HB  ))
   (  segid "    " and resid 9    and name HG2%)
      2.130     0.570     0.570 peak  1315 spectrum    1 weight  0.11000E+01 volume  0.11109E-01 ppm1      1.988 ppm2      0.810 CV     1
 ASSI { 1316}
   (( segid "    " and resid 9    and name HG12))
   (  segid "    " and resid 9    and name HG2%)
      2.380     0.710     0.710 peak  1316 spectrum    1 weight  0.11000E+01 volume  0.53768E-02 ppm1      1.407 ppm2      0.809 CV     1
 ASSI { 1317}
   (( segid "    " and resid 9    and name HG11))
   (  segid "    " and resid 9    and name HG2%)
      2.910     1.060     1.060 peak  1317 spectrum    1 weight  0.11000E+01 volume  0.64922E-02 ppm1      1.132 ppm2      0.810 CV     1
 ASSI { 1318}
   (( segid "    " and resid 9    and name HB  ))
   (  segid "    " and resid 9    and name HD1%)
      2.500     0.780     0.780 peak  1318 spectrum    1 weight  0.11000E+01 volume  0.50203E-02 ppm1      1.997 ppm2      0.779 CV     1
 ASSI { 1319}
   (( segid "    " and resid 9    and name HG12))
   (  segid "    " and resid 9    and name HD1%)
      2.290     0.660     0.660 peak  1319 spectrum    1 weight  0.11000E+01 volume  0.75679E-02 ppm1      1.399 ppm2      0.779 CV     1
 ASSI { 1320}
   (( segid "    " and resid 9    and name HG11))
   (  segid "    " and resid 9    and name HD1%)
      2.250     0.630     0.630 peak  1320 spectrum    1 weight  0.11000E+01 volume  0.88366E-02 ppm1      1.095 ppm2      0.780 CV     1
 ASSI { 1321}
   (  segid "    " and resid 54   and name HG2%)
   (  segid "    " and resid 9    and name HD1%)
      2.230     0.620     0.620 peak  1321 spectrum    1 weight  0.11000E+01 volume  0.97995E-02 ppm1      0.991 ppm2      0.779 CV     1
 ASSI { 1322}
   (( segid "    " and resid 70   and name HG12))
   (  segid "    " and resid 70   and name HD1%)
      2.570     0.820     0.820 peak  1322 spectrum    1 weight  0.11000E+01 volume  0.42754E-02 ppm1      1.485 ppm2      0.873 CV     1
 ASSI { 1323}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HA1 ))
      3.140     1.230     1.230 peak  1323 spectrum    1 weight  0.11000E+01 volume  0.61905E-03 ppm1      0.850 ppm2      3.948 CV     1
 OR { 1323}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HA2 ))
 ASSI { 1324}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
      4.720     2.780     1.780 peak  1324 spectrum    1 weight  0.11000E+01 volume  0.66235E-03 ppm1      7.413 ppm2      3.954 CV     1
 OR { 1324}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
 ASSI { 1326}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HD1 ))
      2.990     1.110     1.110 peak  1326 spectrum    1 weight  0.11000E+01 volume  0.15559E-02 ppm1      0.537 ppm2      2.568 CV     1
 ASSI { 1327}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      3.670     1.690     1.690 peak  1327 spectrum    1 weight  0.11000E+01 volume  0.76249E-03 ppm1      9.418 ppm2      3.660 CV     1
 ASSI { 1328}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 43   and name HA  ))
      3.590     1.610     1.610 peak  1328 spectrum    1 weight  0.11000E+01 volume  0.98826E-03 ppm1     -0.336 ppm2      4.907 CV     1
 ASSI { 1329}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 8    and name HA  ))
      4.100     2.100     2.100 peak  1329 spectrum    1 weight  0.11000E+01 volume  0.69068E-03 ppm1      1.999 ppm2      4.968 CV     1
 ASSI { 1330}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.250     1.320     1.320 peak  1330 spectrum    1 weight  0.11000E+01 volume  0.11618E-02 ppm1      7.441 ppm2      3.118 CV     1
 ASSI { 1331}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.680     1.690     1.690 peak  1331 spectrum    1 weight  0.11000E+01 volume  0.59992E-03 ppm1      7.960 ppm2      3.116 CV     1
 ASSI { 1332}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.770     1.770     1.770 peak  1332 spectrum    1 weight  0.11000E+01 volume  0.54438E-03 ppm1      8.468 ppm2      3.117 CV     1
 ASSI { 1334}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
      3.830     1.830     1.830 peak  1334 spectrum    1 weight  0.11000E+01 volume  0.91176E-03 ppm1      1.442 ppm2      5.614 CV     1
 ASSI { 1335}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 18   and name HA  ))
      3.460     1.500     1.500 peak  1335 spectrum    1 weight  0.11000E+01 volume  0.84209E-03 ppm1      0.384 ppm2      5.614 CV     1
 ASSI { 1336}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 6    and name HA  ))
      3.120     1.210     1.210 peak  1336 spectrum    1 weight  0.11000E+01 volume  0.14313E-02 ppm1      7.202 ppm2      5.393 CV     1
 ASSI { 1337}
   (  segid "    " and resid 48   and name HD% )
   (( segid "    " and resid 48   and name HB1 ))
      3.630     1.650     1.650 peak  1337 spectrum    1 weight  0.11000E+01 volume  0.51175E-03 ppm1      6.627 ppm2      2.588 CV     1
 ASSI { 1338}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 79   and name HB2 ))
      4.690     2.750     1.810 peak  1338 spectrum    1 weight  0.11000E+01 volume  0.61994E-03 ppm1      7.289 ppm2      3.319 CV     1
 ASSI { 1339}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HB2 ))
      3.410     1.460     1.460 peak  1339 spectrum    1 weight  0.11000E+01 volume  0.50781E-03 ppm1      7.055 ppm2      3.318 CV     1
 ASSI { 1340}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HB1 ))
      4.350     2.360     2.150 peak  1340 spectrum    1 weight  0.11000E+01 volume  0.52235E-03 ppm1      7.052 ppm2      3.025 CV     1
 ASSI { 1344}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
      4.240     2.250     2.250 peak  1344 spectrum    1 weight  0.11000E+01 volume  0.63366E-03 ppm1      9.400 ppm2      3.318 CV     1
 ASSI { 1346}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.270     2.280     2.230 peak  1346 spectrum    1 weight  0.11000E+01 volume  0.70119E-03 ppm1      9.610 ppm2      2.661 CV     1
 ASSI { 1347}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 55   and name HB1 ))
      2.970     1.100     1.100 peak  1347 spectrum    1 weight  0.11000E+01 volume  0.17761E-02 ppm1      6.653 ppm2      3.207 CV     1
 OR { 1347}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI { 1348}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 33   and name HB1 ))
      3.620     1.640     1.640 peak  1348 spectrum    1 weight  0.11000E+01 volume  0.11191E-02 ppm1      6.639 ppm2      3.414 CV     1
 ASSI { 1349}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 33   and name HB2 ))
      3.360     1.410     1.410 peak  1349 spectrum    1 weight  0.11000E+01 volume  0.91247E-03 ppm1      6.641 ppm2      3.024 CV     1
 ASSI { 1350}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 48   and name HB1 ))
      4.560     2.600     1.940 peak  1350 spectrum    1 weight  0.11000E+01 volume  0.48564E-03 ppm1      7.625 ppm2      2.580 CV     1
 ASSI { 1351}
   (( segid "    " and resid 3    and name HD2 ))
   (( segid "    " and resid 3    and name HB2 ))
      3.650     1.660     1.660 peak  1351 spectrum    1 weight  0.11000E+01 volume  0.68890E-03 ppm1      6.849 ppm2      2.991 CV     1
 ASSI { 1356}
   (  segid "    " and resid 48   and name HE% )
   (( segid "    " and resid 50   and name HB2 ))
      3.590     1.620     1.620 peak  1356 spectrum    1 weight  0.11000E+01 volume  0.78203E-03 ppm1      6.422 ppm2      2.550 CV     1
 ASSI { 1357}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 34   and name HE1 ))
      3.740     1.740     1.740 peak  1357 spectrum    1 weight  0.11000E+01 volume  0.56471E-03 ppm1      7.587 ppm2      1.684 CV     1
 ASSI { 1358}
   (( segid "    " and resid 33   and name HZ  ))
   (( segid "    " and resid 20   and name HB  ))
      4.630     2.670     1.870 peak  1358 spectrum    1 weight  0.11000E+01 volume  0.45766E-03 ppm1      7.189 ppm2      4.333 CV     1
 ASSI { 1360}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 20   and name HB  ))
      5.050     3.190     1.450 peak  1360 spectrum    1 weight  0.11000E+01 volume  0.27419E-03 ppm1      0.547 ppm2      4.340 CV     1
 ASSI { 1361}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 98   and name HB  ))
      3.930     1.930     1.930 peak  1361 spectrum    1 weight  0.11000E+01 volume  0.69680E-03 ppm1      0.056 ppm2      3.975 CV     1
 ASSI { 1363}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB  ))
      4.410     2.440     2.090 peak  1363 spectrum    1 weight  0.11000E+01 volume  0.39334E-03 ppm1     10.320 ppm2      3.759 CV     1
 ASSI { 1364}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 99   and name HB  ))
      4.290     2.300     2.210 peak  1364 spectrum    1 weight  0.11000E+01 volume  0.36216E-03 ppm1      6.271 ppm2      3.925 CV     1
 ASSI { 1365}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 84   and name HB  ))
      4.190     2.190     2.190 peak  1365 spectrum    1 weight  0.11000E+01 volume  0.44215E-03 ppm1      2.314 ppm2      4.963 CV     1
 ASSI { 1366}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 84   and name HB  ))
      4.290     2.300     2.210 peak  1366 spectrum    1 weight  0.11000E+01 volume  0.49917E-03 ppm1      6.296 ppm2      4.965 CV     1
 ASSI { 1367}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 84   and name HB  ))
      4.360     2.380     2.140 peak  1367 spectrum    1 weight  0.11000E+01 volume  0.47283E-03 ppm1      7.748 ppm2      4.964 CV     1
 ASSI { 1368}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB  ))
      4.290     2.300     2.210 peak  1368 spectrum    1 weight  0.11000E+01 volume  0.37872E-03 ppm1      9.608 ppm2      4.963 CV     1
 ASSI { 1369}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      4.480     2.510     2.020 peak  1369 spectrum    1 weight  0.11000E+01 volume  0.21055E-03 ppm1      7.426 ppm2      4.318 CV     1
 ASSI { 1370}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 99   and name HB  ))
      4.580     2.620     1.920 peak  1370 spectrum    1 weight  0.11000E+01 volume  0.42551E-03 ppm1      0.732 ppm2      3.931 CV     1
 ASSI { 1371}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 54   and name HB  ))
      4.800     2.880     1.700 peak  1371 spectrum    1 weight  0.11000E+01 volume  0.25617E-03 ppm1      7.849 ppm2      3.762 CV     1
 ASSI { 1372}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 54   and name HB  ))
      4.150     2.150     2.150 peak  1372 spectrum    1 weight  0.11000E+01 volume  0.31009E-03 ppm1      7.736 ppm2      3.766 CV     1
 ASSI { 1374}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 47   and name HB  ))
      4.490     2.520     2.010 peak  1374 spectrum    1 weight  0.11000E+01 volume  0.22437E-03 ppm1      9.112 ppm2      4.266 CV     1
 ASSI { 1377}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB  ))
      3.830     1.840     1.840 peak  1377 spectrum    1 weight  0.11000E+01 volume  0.73879E-03 ppm1      8.259 ppm2      3.844 CV     1
 ASSI { 1378}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB  ))
      4.680     2.740     1.820 peak  1378 spectrum    1 weight  0.11000E+01 volume  0.36600E-03 ppm1      8.908 ppm2      4.394 CV     1
 ASSI { 1379}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      4.620     2.670     1.880 peak  1379 spectrum    1 weight  0.11000E+01 volume  0.22664E-03 ppm1      7.853 ppm2      4.428 CV     1
 ASSI { 1380}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 28   and name HA  ))
      4.980     3.100     1.520 peak  1380 spectrum    1 weight  0.11000E+01 volume  0.24181E-03 ppm1      0.500 ppm2      3.701 CV     1
 ASSI { 1381}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      4.500     2.530     2.000 peak  1381 spectrum    1 weight  0.11000E+01 volume  0.17639E-03 ppm1      7.957 ppm2      3.704 CV     1
 ASSI { 1382}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      4.190     2.190     2.190 peak  1382 spectrum    1 weight  0.11000E+01 volume  0.29795E-03 ppm1      7.440 ppm2      3.704 CV     1
 ASSI { 1383}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      4.180     2.180     2.180 peak  1383 spectrum    1 weight  0.11000E+01 volume  0.25059E-03 ppm1      9.161 ppm2      3.660 CV     1
 ASSI { 1385}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 36   and name HA  ))
      3.340     1.390     1.390 peak  1385 spectrum    1 weight  0.11000E+01 volume  0.97775E-03 ppm1      6.678 ppm2      4.283 CV     1
 ASSI { 1386}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      4.860     2.950     1.640 peak  1386 spectrum    1 weight  0.11000E+01 volume  0.51541E-03 ppm1      3.205 ppm2      5.546 CV     1
 OR { 1386}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 1387}
   (( segid "    " and resid 40   and name HD22))
   (( segid "    " and resid 36   and name HA  ))
      3.970     1.970     1.970 peak  1387 spectrum    1 weight  0.11000E+01 volume  0.39952E-03 ppm1      6.278 ppm2      4.280 CV     1
 ASSI { 1389}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB1 ))
      2.500     0.780     0.780 peak  1389 spectrum    1 weight  0.11000E+01 volume  0.65017E-02 ppm1      4.499 ppm2      3.870 CV     1
 ASSI { 1393}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 55   and name HA  ))
      4.390     2.410     2.110 peak  1393 spectrum    1 weight  0.11000E+01 volume  0.45435E-03 ppm1      0.562 ppm2      5.646 CV     1
 ASSI { 1394}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      4.830     2.920     1.670 peak  1394 spectrum    1 weight  0.11000E+01 volume  0.67607E-03 ppm1      6.627 ppm2      3.763 CV     1
 ASSI { 1395}
   (( segid "    " and resid 97   and name HD2 ))
   (( segid "    " and resid 97   and name HA  ))
      4.360     2.370     2.140 peak  1395 spectrum    1 weight  0.11000E+01 volume  0.66235E-03 ppm1      3.176 ppm2      3.761 CV     1
 ASSI { 1397}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HA  ))
      2.230     0.620     0.620 peak  1397 spectrum    1 weight  0.11000E+01 volume  0.10151E-01 ppm1      3.900 ppm2      4.512 CV     1
 ASSI { 1398}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 100  and name HA  ))
      2.500     0.780     0.780 peak  1398 spectrum    1 weight  0.11000E+01 volume  0.45978E-02 ppm1      4.388 ppm2      4.902 CV     1
 ASSI { 1399}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 91   and name HA  ))
      2.470     0.760     0.760 peak  1399 spectrum    1 weight  0.11000E+01 volume  0.44534E-02 ppm1      4.585 ppm2      5.320 CV     1
 ASSI { 1400}
   (( segid "    " and resid 70   and name HG11))
   (( segid "    " and resid 70   and name HA  ))
      3.330     1.380     1.380 peak  1400 spectrum    1 weight  0.11000E+01 volume  0.12463E-02 ppm1      1.203 ppm2      4.177 CV     1
 ASSI { 1401}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      5.120     3.270     1.380 peak  1401 spectrum    1 weight  0.11000E+01 volume  0.32843E-03 ppm1      2.594 ppm2      5.650 CV     1
 ASSI { 1402}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      3.970     1.970     1.970 peak  1402 spectrum    1 weight  0.11000E+01 volume  0.60313E-03 ppm1      1.223 ppm2      5.402 CV     1
 ASSI { 1405}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      4.560     2.600     1.940 peak  1405 spectrum    1 weight  0.11000E+01 volume  0.68242E-03 ppm1      6.994 ppm2      4.165 CV     1
 ASSI { 1406}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 53   and name HA  ))
      3.880     1.880     1.880 peak  1406 spectrum    1 weight  0.11000E+01 volume  0.51520E-03 ppm1      7.211 ppm2      4.158 CV     1
 ASSI { 1408}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.460     1.500     1.500 peak  1408 spectrum    1 weight  0.11000E+01 volume  0.93706E-03 ppm1      8.970 ppm2      4.465 CV     1
 ASSI { 1411}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.190     1.270     1.270 peak  1411 spectrum    1 weight  0.11000E+01 volume  0.10658E-02 ppm1      7.865 ppm2      4.086 CV     1
 ASSI { 1413}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.300     1.360     1.360 peak  1413 spectrum    1 weight  0.11000E+01 volume  0.10548E-02 ppm1      8.285 ppm2      3.842 CV     1
 ASSI { 1414}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.450     1.490     1.490 peak  1414 spectrum    1 weight  0.11000E+01 volume  0.85860E-03 ppm1      8.153 ppm2      3.839 CV     1
 ASSI { 1415}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 37   and name HA  ))
      3.620     1.640     1.640 peak  1415 spectrum    1 weight  0.11000E+01 volume  0.73131E-03 ppm1      6.724 ppm2      3.841 CV     1
 ASSI { 1416}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 90   and name HA  ))
      3.710     1.720     1.720 peak  1416 spectrum    1 weight  0.11000E+01 volume  0.13946E-02 ppm1      6.765 ppm2      4.557 CV     1
 ASSI { 1417}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 90   and name HA  ))
      3.340     1.400     1.400 peak  1417 spectrum    1 weight  0.11000E+01 volume  0.11273E-02 ppm1      7.115 ppm2      4.557 CV     1
 ASSI { 1418}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 90   and name HA  ))
      3.030     1.150     1.150 peak  1418 spectrum    1 weight  0.11000E+01 volume  0.16504E-02 ppm1      6.987 ppm2      4.557 CV     1
 ASSI { 1419}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 89   and name HA  ))
      3.080     1.190     1.190 peak  1419 spectrum    1 weight  0.11000E+01 volume  0.17069E-02 ppm1      6.783 ppm2      4.291 CV     1
 ASSI { 1420}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 90   and name HA  ))
      3.330     1.390     1.390 peak  1420 spectrum    1 weight  0.11000E+01 volume  0.95910E-03 ppm1      7.579 ppm2      4.555 CV     1
 ASSI { 1421}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.310     1.370     1.370 peak  1421 spectrum    1 weight  0.11000E+01 volume  0.92578E-03 ppm1      7.759 ppm2      4.505 CV     1
 ASSI { 1422}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 79   and name HA  ))
      3.910     1.910     1.910 peak  1422 spectrum    1 weight  0.11000E+01 volume  0.47214E-03 ppm1      7.299 ppm2      5.800 CV     1
 ASSI { 1423}
   (  segid "    " and resid 48   and name HE% )
   (( segid "    " and resid 50   and name HA  ))
      3.130     1.230     1.230 peak  1423 spectrum    1 weight  0.11000E+01 volume  0.14893E-02 ppm1      6.428 ppm2      4.087 CV     1
 ASSI { 1424}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.480     1.520     1.520 peak  1424 spectrum    1 weight  0.11000E+01 volume  0.75893E-03 ppm1      6.632 ppm2      4.455 CV     1
 ASSI { 1425}
   (( segid "    " and resid 95   and name HD22))
   (( segid "    " and resid 95   and name HA  ))
      4.980     3.100     1.520 peak  1425 spectrum    1 weight  0.11000E+01 volume  0.54476E-03 ppm1      7.722 ppm2      4.457 CV     1
 ASSI { 1426}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.410     1.450     1.450 peak  1426 spectrum    1 weight  0.11000E+01 volume  0.12137E-02 ppm1      8.051 ppm2      4.453 CV     1
 ASSI { 1427}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.400     0.720     0.720 peak  1427 spectrum    1 weight  0.11000E+01 volume  0.64049E-02 ppm1      8.236 ppm2      4.500 CV     1
 ASSI { 1428}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 22   and name HA  ))
      3.700     1.710     1.710 peak  1428 spectrum    1 weight  0.11000E+01 volume  0.65516E-03 ppm1      7.208 ppm2      5.460 CV     1
 ASSI { 1429}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      3.120     1.220     1.220 peak  1429 spectrum    1 weight  0.11000E+01 volume  0.12207E-02 ppm1      8.091 ppm2      5.462 CV     1
 ASSI { 1433}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      3.140     1.230     1.230 peak  1433 spectrum    1 weight  0.11000E+01 volume  0.20362E-02 ppm1      2.669 ppm2      5.443 CV     1
 ASSI { 1435}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HA  ))
      2.460     0.760     0.760 peak  1435 spectrum    1 weight  0.11000E+01 volume  0.52107E-02 ppm1      1.723 ppm2      4.370 CV     1
 ASSI { 1436}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HA  ))
      2.470     0.770     0.770 peak  1436 spectrum    1 weight  0.11000E+01 volume  0.52411E-02 ppm1      2.294 ppm2      4.556 CV     1
 ASSI { 1437}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      2.580     0.830     0.830 peak  1437 spectrum    1 weight  0.11000E+01 volume  0.45591E-02 ppm1      2.053 ppm2      4.401 CV     1
 ASSI { 1438}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HA  ))
      3.040     1.150     1.150 peak  1438 spectrum    1 weight  0.11000E+01 volume  0.24749E-02 ppm1      2.348 ppm2      4.402 CV     1
 OR { 1438}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI { 1439}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 67   and name HA  ))
      2.880     1.040     1.040 peak  1439 spectrum    1 weight  0.11000E+01 volume  0.25017E-02 ppm1      2.179 ppm2      4.356 CV     1
 ASSI { 1440}
   (( segid "    " and resid 102  and name HG1 ))
   (( segid "    " and resid 102  and name HA  ))
      2.880     1.040     1.040 peak  1440 spectrum    1 weight  0.11000E+01 volume  0.24106E-02 ppm1      1.358 ppm2      4.369 CV     1
 ASSI { 1441}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.560     1.580     1.580 peak  1441 spectrum    1 weight  0.11000E+01 volume  0.78845E-03 ppm1      9.611 ppm2      4.290 CV     1
 ASSI { 1443}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      3.900     1.900     1.900 peak  1443 spectrum    1 weight  0.11000E+01 volume  0.12797E-02 ppm1      2.134 ppm2      3.841 CV     1
 ASSI { 1444}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.050     1.050 peak  1444 spectrum    1 weight  0.11000E+01 volume  0.14361E-02 ppm1      0.961 ppm2      4.293 CV     1
 ASSI { 1445}
   (  segid "    " and resid 24   and name HG1%)
   (( segid "    " and resid 3    and name HA  ))
      3.420     1.460     1.460 peak  1445 spectrum    1 weight  0.11000E+01 volume  0.80419E-03 ppm1      0.849 ppm2      4.617 CV     1
 ASSI { 1447}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 22   and name HA  ))
      3.620     1.640     1.640 peak  1447 spectrum    1 weight  0.11000E+01 volume  0.58717E-03 ppm1      0.539 ppm2      5.462 CV     1
 ASSI { 1448}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      4.180     2.180     2.180 peak  1448 spectrum    1 weight  0.11000E+01 volume  0.54742E-03 ppm1      1.294 ppm2      5.463 CV     1
 ASSI { 1449}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 7    and name HA  ))
      3.790     1.800     1.800 peak  1449 spectrum    1 weight  0.11000E+01 volume  0.62588E-03 ppm1      0.783 ppm2      5.229 CV     1
 ASSI { 1450}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HA  ))
      2.990     1.120     1.120 peak  1450 spectrum    1 weight  0.11000E+01 volume  0.18008E-02 ppm1      1.484 ppm2      5.232 CV     1
 ASSI { 1451}
   (  segid "    " and resid 26   and name HB% )
   (( segid "    " and resid 25   and name HA  ))
      3.930     1.930     1.930 peak  1451 spectrum    1 weight  0.11000E+01 volume  0.13980E-02 ppm1      1.336 ppm2      4.672 CV     1
 ASSI { 1452}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 11   and name HA  ))
      3.400     1.450     1.450 peak  1452 spectrum    1 weight  0.11000E+01 volume  0.82539E-03 ppm1      0.805 ppm2      5.270 CV     1
 ASSI { 1454}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HD1 ))
      4.720     2.790     1.780 peak  1454 spectrum    1 weight  0.11000E+01 volume  0.40631E-03 ppm1      8.409 ppm2      3.235 CV     1
 ASSI { 1455}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 76   and name HD1 ))
      3.630     1.650     1.650 peak  1455 spectrum    1 weight  0.11000E+01 volume  0.25919E-03 ppm1      7.037 ppm2      3.238 CV     1
 ASSI { 1456}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HD2 ))
      5.250     3.450     1.250 peak  1456 spectrum    1 weight  0.11000E+01 volume  0.26817E-03 ppm1      8.408 ppm2      2.683 CV     1
 ASSI { 1457}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 44   and name HA1 ))
      4.460     2.480     2.040 peak  1457 spectrum    1 weight  0.11000E+01 volume  0.30536E-03 ppm1      0.408 ppm2      4.250 CV     1
 ASSI { 1458}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 44   and name HA2 ))
      4.570     2.610     1.930 peak  1458 spectrum    1 weight  0.11000E+01 volume  0.60289E-03 ppm1      0.389 ppm2      3.806 CV     1
 ASSI { 1459}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 12   and name HA2 ))
      3.790     1.800     1.800 peak  1459 spectrum    1 weight  0.11000E+01 volume  0.58452E-03 ppm1      1.469 ppm2      4.474 CV     1
 ASSI { 1460}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 12   and name HA2 ))
      4.550     2.590     1.950 peak  1460 spectrum    1 weight  0.11000E+01 volume  0.49338E-03 ppm1      1.845 ppm2      4.473 CV     1
 ASSI { 1461}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 17   and name HA2 ))
      4.300     2.310     2.200 peak  1461 spectrum    1 weight  0.11000E+01 volume  0.37794E-03 ppm1      2.128 ppm2      4.160 CV     1
 ASSI { 1462}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 12   and name HA1 ))
      3.610     1.630     1.630 peak  1462 spectrum    1 weight  0.11000E+01 volume  0.58518E-03 ppm1      1.472 ppm2      4.056 CV     1
 ASSI { 1463}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HA1 ))
      4.890     2.990     1.610 peak  1463 spectrum    1 weight  0.11000E+01 volume  0.25199E-03 ppm1      5.160 ppm2      4.308 CV     1
 ASSI { 1464}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HA2 ))
      4.580     2.620     1.920 peak  1464 spectrum    1 weight  0.11000E+01 volume  0.44205E-03 ppm1      5.153 ppm2      4.152 CV     1
 ASSI { 1465}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 17   and name HA1 ))
      4.510     2.540     1.990 peak  1465 spectrum    1 weight  0.11000E+01 volume  0.26282E-03 ppm1      5.603 ppm2      4.329 CV     1
 ASSI { 1466}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 17   and name HA2 ))
      4.450     2.480     2.050 peak  1466 spectrum    1 weight  0.11000E+01 volume  0.33478E-03 ppm1      5.611 ppm2      4.155 CV     1
 ASSI { 1467}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 78   and name HA2 ))
      3.880     1.880     1.880 peak  1467 spectrum    1 weight  0.11000E+01 volume  0.48412E-03 ppm1      3.293 ppm2      4.298 CV     1
 ASSI { 1468}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 12   and name HA2 ))
      4.480     2.510     2.020 peak  1468 spectrum    1 weight  0.11000E+01 volume  0.33843E-03 ppm1      8.853 ppm2      4.484 CV     1
 ASSI { 1470}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 79   and name HE3 ))
      5.050     3.190     1.450 peak  1470 spectrum    1 weight  0.11000E+01 volume  0.24878E-03 ppm1      5.331 ppm2      7.289 CV     1
 ASSI { 1473}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 44   and name HA2 ))
      4.540     2.570     1.960 peak  1473 spectrum    1 weight  0.11000E+01 volume  0.50413E-03 ppm1      8.386 ppm2      3.815 CV     1
 ASSI { 1474}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 87   and name HA1 ))
      3.650     1.670     1.670 peak  1474 spectrum    1 weight  0.11000E+01 volume  0.24933E-03 ppm1      0.926 ppm2      3.724 CV     1
 ASSI { 1475}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 87   and name HA1 ))
      4.350     2.370     2.150 peak  1475 spectrum    1 weight  0.11000E+01 volume  0.76653E-03 ppm1      2.798 ppm2      3.725 CV     1
 ASSI { 1479}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
      3.890     1.890     1.890 peak  1479 spectrum    1 weight  0.11000E+01 volume  0.14139E-02 ppm1      9.156 ppm2      3.324 CV     1
 ASSI { 1482}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      3.250     1.320     1.320 peak  1482 spectrum    1 weight  0.11000E+01 volume  0.12017E-02 ppm1      7.732 ppm2      2.285 CV     1
 ASSI { 1483}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 8    and name HB1 ))
      4.010     2.010     2.010 peak  1483 spectrum    1 weight  0.11000E+01 volume  0.50067E-03 ppm1      6.767 ppm2     -1.108 CV     1
 ASSI { 1484}
   (  segid "    " and resid 33   and name HD% )
   (( segid "    " and resid 8    and name HB1 ))
      4.100     2.100     2.100 peak  1484 spectrum    1 weight  0.11000E+01 volume  0.51784E-03 ppm1      7.167 ppm2     -1.114 CV     1
 ASSI { 1485}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HB1 ))
      4.340     2.350     2.160 peak  1485 spectrum    1 weight  0.11000E+01 volume  0.40932E-03 ppm1      9.113 ppm2     -1.114 CV     1
 ASSI { 1487}
   (  segid "    " and resid 33   and name HD% )
   (( segid "    " and resid 8    and name HB2 ))
      3.580     1.600     1.600 peak  1487 spectrum    1 weight  0.11000E+01 volume  0.39562E-03 ppm1      7.171 ppm2      0.773 CV     1
 ASSI { 1488}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 8    and name HB2 ))
      3.540     1.560     1.560 peak  1488 spectrum    1 weight  0.11000E+01 volume  0.30436E-03 ppm1      6.762 ppm2      0.777 CV     1
 ASSI { 1489}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      4.220     2.220     2.220 peak  1489 spectrum    1 weight  0.11000E+01 volume  0.44198E-03 ppm1      7.401 ppm2      2.285 CV     1
 ASSI { 1490}
   (( segid "    " and resid 54   and name HB  ))
   (( segid "    " and resid 49   and name HB2 ))
      3.790     1.800     1.800 peak  1490 spectrum    1 weight  0.11000E+01 volume  0.55939E-03 ppm1      3.766 ppm2      2.287 CV     1
 ASSI { 1492}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 8    and name HB1 ))
      4.810     2.890     1.690 peak  1492 spectrum    1 weight  0.11000E+01 volume  0.38232E-03 ppm1      3.195 ppm2     -1.107 CV     1
 ASSI { 1493}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 8    and name HB1 ))
      4.540     2.580     1.960 peak  1493 spectrum    1 weight  0.11000E+01 volume  0.33794E-03 ppm1      3.412 ppm2     -1.113 CV     1
 ASSI { 1494}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 34   and name HE1 ))
      3.670     1.680     1.680 peak  1494 spectrum    1 weight  0.11000E+01 volume  0.42827E-03 ppm1     10.557 ppm2      1.685 CV     1
 ASSI { 1496}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 10   and name HB1 ))
      4.000     2.000     2.000 peak  1496 spectrum    1 weight  0.11000E+01 volume  0.55561E-03 ppm1      5.162 ppm2      1.370 CV     1
 ASSI { 1499}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 75   and name HB2 ))
      4.680     2.740     1.820 peak  1499 spectrum    1 weight  0.11000E+01 volume  0.64482E-03 ppm1      3.036 ppm2      1.762 CV     1
 ASSI { 1506}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 93   and name HB1 ))
      3.490     1.520     1.520 peak  1506 spectrum    1 weight  0.11000E+01 volume  0.32838E-03 ppm1      1.147 ppm2      0.062 CV     1
 ASSI { 1507}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 93   and name HB1 ))
      5.900     4.350     0.600 peak  1507 spectrum    1 weight  0.11000E+01 volume  0.23138E-03 ppm1      4.360 ppm2      0.063 CV     1
 ASSI { 1510}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      3.440     1.480     1.480 peak  1510 spectrum    1 weight  0.11000E+01 volume  0.58159E-03 ppm1      3.844 ppm2      2.705 CV     1
 ASSI { 1511}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 90   and name HB2 ))
      4.810     2.890     1.690 peak  1511 spectrum    1 weight  0.11000E+01 volume  0.36812E-03 ppm1      6.280 ppm2      2.569 CV     1
 ASSI { 1512}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 90   and name HB1 ))
      5.170     3.340     1.330 peak  1512 spectrum    1 weight  0.11000E+01 volume  0.22105E-03 ppm1      6.274 ppm2      2.307 CV     1
 ASSI { 1513}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HB1 ))
      4.940     3.050     1.560 peak  1513 spectrum    1 weight  0.11000E+01 volume  0.32233E-03 ppm1      7.111 ppm2      3.585 CV     1
 ASSI { 1514}
   (  segid "    " and resid 37   and name HB% )
   (( segid "    " and resid 36   and name HB2 ))
      3.060     1.170     1.170 peak  1514 spectrum    1 weight  0.11000E+01 volume  0.71990E-03 ppm1      1.866 ppm2      3.325 CV     1
 ASSI { 1516}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.780     1.780     1.780 peak  1516 spectrum    1 weight  0.11000E+01 volume  0.58982E-03 ppm1      9.164 ppm2      3.426 CV     1
 ASSI { 1517}
   (( segid "    " and resid 5    and name HE21))
   (( segid "    " and resid 5    and name HG2 ))
      3.640     1.650     1.650 peak  1517 spectrum    1 weight  0.11000E+01 volume  0.41650E-03 ppm1      7.797 ppm2      2.178 CV     1
 ASSI { 1518}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HG2 ))
      4.590     2.630     1.910 peak  1518 spectrum    1 weight  0.11000E+01 volume  0.49543E-03 ppm1      8.046 ppm2      2.178 CV     1
 ASSI { 1519}
   (( segid "    " and resid 82   and name HE1 ))
   (( segid "    " and resid 82   and name HB2 ))
      3.930     1.930     1.930 peak  1519 spectrum    1 weight  0.11000E+01 volume  0.74051E-03 ppm1      2.872 ppm2      1.353 CV     1
 OR { 1519}
   (( segid "    " and resid 82   and name HE2 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 1525}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 5    and name HG2 ))
      3.330     1.380     1.380 peak  1525 spectrum    1 weight  0.11000E+01 volume  0.12535E-02 ppm1      1.198 ppm2      2.176 CV     1
 ASSI { 1526}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 80   and name HB2 ))
      3.730     1.740     1.740 peak  1526 spectrum    1 weight  0.11000E+01 volume  0.10582E-02 ppm1      0.745 ppm2      2.029 CV     1
 ASSI { 1527}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 57   and name HB  ))
      4.090     2.090     2.090 peak  1527 spectrum    1 weight  0.11000E+01 volume  0.86626E-03 ppm1      0.766 ppm2     -0.225 CV     1
 ASSI { 1529}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 57   and name HB  ))
      4.140     2.140     2.140 peak  1529 spectrum    1 weight  0.11000E+01 volume  0.29406E-03 ppm1      5.402 ppm2     -0.228 CV     1
 ASSI { 1530}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 57   and name HB  ))
      4.390     2.410     2.110 peak  1530 spectrum    1 weight  0.11000E+01 volume  0.30271E-03 ppm1      7.584 ppm2     -0.229 CV     1
 ASSI { 1531}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 57   and name HB  ))
      4.140     2.140     2.140 peak  1531 spectrum    1 weight  0.11000E+01 volume  0.22970E-03 ppm1      7.366 ppm2     -0.229 CV     1
 ASSI { 1532}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 57   and name HB  ))
      4.270     2.280     2.230 peak  1532 spectrum    1 weight  0.11000E+01 volume  0.23087E-03 ppm1      6.765 ppm2     -0.233 CV     1
 ASSI { 1533}
   (( segid "    " and resid 46   and name HZ3 ))
   (( segid "    " and resid 57   and name HB  ))
      4.270     2.280     2.230 peak  1533 spectrum    1 weight  0.11000E+01 volume  0.22580E-03 ppm1      6.636 ppm2     -0.233 CV     1
 ASSI { 1534}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 59   and name HB1 ))
      3.990     1.990     1.990 peak  1534 spectrum    1 weight  0.11000E+01 volume  0.14459E-02 ppm1      4.071 ppm2      2.199 CV     1
 ASSI { 1535}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 106  and name HB2 ))
      3.860     1.870     1.870 peak  1535 spectrum    1 weight  0.11000E+01 volume  0.11082E-02 ppm1      3.812 ppm2      2.240 CV     1
 ASSI { 1536}
   (( segid "    " and resid 106  and name HD1 ))
   (( segid "    " and resid 106  and name HB2 ))
      4.060     2.060     2.060 peak  1536 spectrum    1 weight  0.11000E+01 volume  0.97597E-03 ppm1      3.583 ppm2      2.241 CV     1
 ASSI { 1540}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HB2 ))
      4.270     2.280     2.230 peak  1540 spectrum    1 weight  0.11000E+01 volume  0.74081E-03 ppm1      3.562 ppm2      2.343 CV     1
 ASSI { 1541}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG2 ))
      3.190     1.270     1.270 peak  1541 spectrum    1 weight  0.11000E+01 volume  0.12990E-02 ppm1      4.646 ppm2      2.387 CV     1
 ASSI { 1543}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 45   and name HB1 ))
      3.680     1.700     1.700 peak  1543 spectrum    1 weight  0.11000E+01 volume  0.93457E-03 ppm1      3.880 ppm2      1.984 CV     1
 ASSI { 1546}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      4.360     2.380     2.140 peak  1546 spectrum    1 weight  0.11000E+01 volume  0.45871E-03 ppm1      8.992 ppm2      2.414 CV     1
 ASSI { 1548}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 53   and name HB2 ))
      4.130     2.130     2.130 peak  1548 spectrum    1 weight  0.11000E+01 volume  0.85200E-03 ppm1      7.205 ppm2      1.983 CV     1
 ASSI { 1549}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 53   and name HB1 ))
      3.070     1.180     1.180 peak  1549 spectrum    1 weight  0.11000E+01 volume  0.91930E-03 ppm1      7.202 ppm2      1.913 CV     1
 ASSI { 1550}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.530     1.560     1.560 peak  1550 spectrum    1 weight  0.11000E+01 volume  0.74651E-03 ppm1      8.493 ppm2      2.074 CV     1
 ASSI { 1553}
   (( segid "    " and resid 79   and name HE1 ))
   (( segid "    " and resid 76   and name HB1 ))
      4.660     2.710     1.840 peak  1553 spectrum    1 weight  0.11000E+01 volume  0.48399E-03 ppm1     10.326 ppm2      2.421 CV     1
 ASSI { 1554}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 53   and name HD1 ))
      4.650     2.700     1.850 peak  1554 spectrum    1 weight  0.11000E+01 volume  0.36642E-03 ppm1      6.972 ppm2      1.442 CV     1
 ASSI { 1555}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 53   and name HD2 ))
      4.240     2.250     2.250 peak  1555 spectrum    1 weight  0.11000E+01 volume  0.47535E-03 ppm1      6.973 ppm2      1.355 CV     1
 ASSI { 1556}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD1 ))
      3.870     1.870     1.870 peak  1556 spectrum    1 weight  0.11000E+01 volume  0.42604E-03 ppm1      7.860 ppm2      1.444 CV     1
 ASSI { 1557}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD2 ))
      3.680     1.690     1.690 peak  1557 spectrum    1 weight  0.11000E+01 volume  0.29531E-03 ppm1      7.857 ppm2      1.348 CV     1
 ASSI { 1558}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 34   and name HD2 ))
      4.650     2.700     1.850 peak  1558 spectrum    1 weight  0.11000E+01 volume  0.18795E-03 ppm1     10.569 ppm2      1.067 CV     1
 ASSI { 1561}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HG11))
      3.200     1.280     1.280 peak  1561 spectrum    1 weight  0.11000E+01 volume  0.77859E-03 ppm1      9.111 ppm2      1.101 CV     1
 ASSI { 1563}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HG2 ))
      3.270     1.340     1.340 peak  1563 spectrum    1 weight  0.11000E+01 volume  0.97846E-03 ppm1      4.364 ppm2      1.297 CV     1
 ASSI { 1568}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 8    and name HD1%)
      4.240     2.250     2.250 peak  1568 spectrum    1 weight  0.11000E+01 volume  0.50305E-03 ppm1     10.300 ppm2      0.560 CV     1
 ASSI { 1570}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HG1 ))
      3.740     1.750     1.750 peak  1570 spectrum    1 weight  0.11000E+01 volume  0.73362E-03 ppm1      8.586 ppm2      1.358 CV     1
 ASSI { 1575}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HG2%)
      3.580     1.600     1.600 peak  1575 spectrum    1 weight  0.11000E+01 volume  0.20182E-02 ppm1      9.261 ppm2      1.062 CV     1
 ASSI { 1576}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HG2%)
      3.330     1.390     1.390 peak  1576 spectrum    1 weight  0.11000E+01 volume  0.12490E-02 ppm1      8.307 ppm2      1.062 CV     1
 ASSI { 1577}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 32   and name HG1%)
      3.250     1.320     1.320 peak  1577 spectrum    1 weight  0.11000E+01 volume  0.27183E-02 ppm1      3.119 ppm2      0.940 CV     1
 ASSI { 1578}
   (  segid "    " and resid 92   and name HG2%)
   (  segid "    " and resid 99   and name HG2%)
      2.860     1.020     1.020 peak  1578 spectrum    1 weight  0.11000E+01 volume  0.24221E-02 ppm1      0.228 ppm2      1.062 CV     1
 ASSI { 1579}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 84   and name HG2%)
      3.630     1.650     1.650 peak  1579 spectrum    1 weight  0.11000E+01 volume  0.11254E-02 ppm1      7.632 ppm2      1.477 CV     1
 ASSI { 1580}
   (  segid "    " and resid 101  and name HE% )
   (  segid "    " and resid 84   and name HG2%)
      3.350     1.400     1.400 peak  1580 spectrum    1 weight  0.11000E+01 volume  0.12140E-02 ppm1      7.104 ppm2      1.475 CV     1
 ASSI { 1581}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 84   and name HG2%)
      4.070     2.070     2.070 peak  1581 spectrum    1 weight  0.11000E+01 volume  0.85836E-03 ppm1      6.963 ppm2      1.475 CV     1
 ASSI { 1583}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      3.920     1.920     1.920 peak  1583 spectrum    1 weight  0.11000E+01 volume  0.14344E-02 ppm1      8.749 ppm2      0.920 CV     1
 ASSI { 1584}
   (( segid "    " and resid 59   and name HG1 ))
   (  segid "    " and resid 42   and name HG1%)
      2.860     1.030     1.030 peak  1584 spectrum    1 weight  0.11000E+01 volume  0.32474E-02 ppm1      2.471 ppm2      0.672 CV     1
 ASSI { 1586}
   (( segid "    " and resid 46   and name HZ2 ))
   (  segid "    " and resid 57   and name HG2%)
      3.190     1.270     1.270 peak  1586 spectrum    1 weight  0.11000E+01 volume  0.15518E-02 ppm1      7.372 ppm2     -0.340 CV     1
 ASSI { 1587}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      2.890     1.050     1.050 peak  1587 spectrum    1 weight  0.11000E+01 volume  0.21898E-02 ppm1      6.627 ppm2      1.155 CV     1
 ASSI { 1588}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      2.800     0.980     0.980 peak  1588 spectrum    1 weight  0.11000E+01 volume  0.28663E-02 ppm1      7.011 ppm2      1.097 CV     1
 ASSI { 1589}
   (( segid "    " and resid 11   and name HD21))
   (  segid "    " and resid 56   and name HG2%)
      3.130     1.220     1.220 peak  1589 spectrum    1 weight  0.11000E+01 volume  0.17271E-02 ppm1      7.150 ppm2      0.971 CV     1
 ASSI { 1591}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 32   and name HG2%)
      3.050     1.160     1.160 peak  1591 spectrum    1 weight  0.11000E+01 volume  0.15156E-02 ppm1      7.443 ppm2      0.856 CV     1
 ASSI { 1592}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 54   and name HG2%)
      2.970     1.100     1.100 peak  1592 spectrum    1 weight  0.11000E+01 volume  0.23558E-02 ppm1      9.114 ppm2      0.996 CV     1
 ASSI { 1593}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      3.350     1.400     1.400 peak  1593 spectrum    1 weight  0.11000E+01 volume  0.21760E-02 ppm1      9.117 ppm2      0.972 CV     1
 ASSI { 1594}
   (( segid "    " and resid 12   and name HA2 ))
   (  segid "    " and resid 42   and name HG1%)
      3.110     1.210     1.210 peak  1594 spectrum    1 weight  0.11000E+01 volume  0.28178E-02 ppm1      4.503 ppm2      0.672 CV     1
 ASSI { 1595}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      3.780     1.790     1.790 peak  1595 spectrum    1 weight  0.11000E+01 volume  0.10630E-02 ppm1      9.111 ppm2      0.811 CV     1
 ASSI { 1596}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 9    and name HG2%)
      3.640     1.660     1.660 peak  1596 spectrum    1 weight  0.11000E+01 volume  0.12623E-02 ppm1      5.217 ppm2      0.809 CV     1
 ASSI { 1597}
   (( segid "    " and resid 11   and name HD22))
   (  segid "    " and resid 9    and name HG2%)
      3.460     1.500     1.500 peak  1597 spectrum    1 weight  0.11000E+01 volume  0.74206E-03 ppm1      6.821 ppm2      0.809 CV     1
 ASSI { 1598}
   (( segid "    " and resid 11   and name HB1 ))
   (  segid "    " and resid 9    and name HG2%)
      3.110     1.210     1.210 peak  1598 spectrum    1 weight  0.11000E+01 volume  0.21108E-02 ppm1      2.547 ppm2      0.810 CV     1
 ASSI { 1599}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 21   and name HG2%)
      3.350     1.400     1.400 peak  1599 spectrum    1 weight  0.11000E+01 volume  0.11657E-02 ppm1      9.213 ppm2      0.545 CV     1
 ASSI { 1600}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 92   and name HG2%)
      3.310     1.370     1.370 peak  1600 spectrum    1 weight  0.11000E+01 volume  0.99337E-03 ppm1      9.156 ppm2      0.244 CV     1
 ASSI { 1601}
   (( segid "    " and resid 25   and name HB1 ))
   (  segid "    " and resid 26   and name HB% )
      3.720     1.730     1.730 peak  1601 spectrum    1 weight  0.11000E+01 volume  0.16870E-02 ppm1      3.017 ppm2      1.337 CV     1
 OR { 1601}
   (( segid "    " and resid 25   and name HB2 ))
   (  segid "    " and resid 26   and name HB% )
 ASSI { 1602}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HD1 ))
      4.080     2.080     2.080 peak  1602 spectrum    1 weight  0.11000E+01 volume  0.85592E-03 ppm1      2.448 ppm2      3.236 CV     1
 ASSI { 1603}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HD2 ))
      3.920     1.920     1.920 peak  1603 spectrum    1 weight  0.11000E+01 volume  0.95607E-03 ppm1      2.458 ppm2      2.684 CV     1
 ASSI { 1604}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 83   and name HA  ))
      3.170     1.250     1.250 peak  1604 spectrum    1 weight  0.11000E+01 volume  0.11652E-02 ppm1      6.746 ppm2      5.445 CV     1
 ASSI { 1605}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HA  ))
      3.130     1.220     1.220 peak  1605 spectrum    1 weight  0.11000E+01 volume  0.14191E-02 ppm1      6.858 ppm2      5.446 CV     1
 ASSI { 1606}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HG1 ))
      3.400     1.450     1.450 peak  1606 spectrum    1 weight  0.11000E+01 volume  0.98422E-03 ppm1      4.455 ppm2      2.206 CV     1
 ASSI { 1607}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 77   and name HG1 ))
      4.800     2.880     1.700 peak  1607 spectrum    1 weight  0.11000E+01 volume  0.54027E-03 ppm1      4.710 ppm2      2.204 CV     1
 ASSI { 1612}
   (  segid "    " and resid 91   and name HE% )
   (( segid "    " and resid 89   and name HD1 ))
      3.100     1.200     1.200 peak  1612 spectrum    1 weight  0.11000E+01 volume  0.12759E-02 ppm1      7.152 ppm2      3.217 CV     1
 ASSI { 1613}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HD1 ))
      3.060     1.170     1.170 peak  1613 spectrum    1 weight  0.11000E+01 volume  0.18251E-02 ppm1      2.084 ppm2      3.202 CV     1
 ASSI { 1614}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HD2 ))
      2.340     0.680     0.680 peak  1614 spectrum    1 weight  0.11000E+01 volume  0.74337E-02 ppm1      1.546 ppm2      3.164 CV     1
 ASSI { 1615}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HD1 ))
      2.840     1.010     1.010 peak  1615 spectrum    1 weight  0.11000E+01 volume  0.37728E-02 ppm1      1.653 ppm2      3.219 CV     1
 ASSI { 1616}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HD2 ))
      2.360     0.700     0.700 peak  1616 spectrum    1 weight  0.11000E+01 volume  0.46513E-02 ppm1      1.653 ppm2      3.158 CV     1
 ASSI { 1617}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HD2 ))
      2.590     0.840     0.840 peak  1617 spectrum    1 weight  0.11000E+01 volume  0.62902E-02 ppm1      1.610 ppm2      3.158 CV     1
 ASSI { 1618}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HD1 ))
      2.310     0.660     0.660 peak  1618 spectrum    1 weight  0.11000E+01 volume  0.52610E-02 ppm1      1.606 ppm2      3.217 CV     1
 ASSI { 1619}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 32   and name HG1%)
      3.460     1.500     1.500 peak  1619 spectrum    1 weight  0.11000E+01 volume  0.12459E-02 ppm1      8.470 ppm2      0.939 CV     1
 ASSI { 1620}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB  ))
      2.510     0.790     0.790 peak  1620 spectrum    1 weight  0.11000E+01 volume  0.52504E-02 ppm1      4.760 ppm2      3.883 CV     1
 ASSI { 1621}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HG2 ))
      3.910     1.910     1.910 peak  1621 spectrum    1 weight  0.11000E+01 volume  0.79385E-03 ppm1      8.057 ppm2      2.219 CV     1
 OR { 1621}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HG1 ))
 ASSI { 1622}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HB1 ))
      2.930     1.070     1.070 peak  1622 spectrum    1 weight  0.11000E+01 volume  0.37937E-02 ppm1      2.463 ppm2      2.197 CV     1
 ASSI { 1623}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.600     0.850     0.850 peak  1623 spectrum    1 weight  0.11000E+01 volume  0.36893E-02 ppm1      4.541 ppm2      2.191 CV     1
 ASSI { 1624}
   (( segid "    " and resid 34   and name HD2 ))
   (( segid "    " and resid 34   and name HE2 ))
      3.110     1.210     1.210 peak  1624 spectrum    1 weight  0.11000E+01 volume  0.19761E-02 ppm1      1.069 ppm2      1.943 CV     1
 ASSI { 1625}
   (( segid "    " and resid 34   and name HD1 ))
   (( segid "    " and resid 34   and name HE2 ))
      2.710     0.920     0.920 peak  1625 spectrum    1 weight  0.11000E+01 volume  0.19020E-02 ppm1      1.135 ppm2      1.946 CV     1
 ASSI { 1626}
   (( segid "    " and resid 11   and name HD21))
   (( segid "    " and resid 11   and name HB1 ))
      3.200     1.280     1.280 peak  1626 spectrum    1 weight  0.11000E+01 volume  0.12378E-02 ppm1      7.154 ppm2      2.552 CV     1
 ASSI { 1627}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      2.690     0.900     0.900 peak  1627 spectrum    1 weight  0.11000E+01 volume  0.22066E-02 ppm1      8.869 ppm2      2.997 CV     1
 ASSI { 1628}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HB1 ))
      2.600     0.840     0.840 peak  1628 spectrum    1 weight  0.11000E+01 volume  0.28664E-02 ppm1      1.304 ppm2      1.701 CV     1
 ASSI { 1630}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HB2 ))
      2.880     1.030     1.030 peak  1630 spectrum    1 weight  0.11000E+01 volume  0.34410E-02 ppm1      1.306 ppm2      1.801 CV     1
 ASSI { 1631}
   (( segid "    " and resid 102  and name HG1 ))
   (( segid "    " and resid 102  and name HB2 ))
      2.470     0.760     0.760 peak  1631 spectrum    1 weight  0.11000E+01 volume  0.38018E-02 ppm1      1.385 ppm2      1.798 CV     1
 ASSI { 1632}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB2 ))
      2.710     0.920     0.920 peak  1632 spectrum    1 weight  0.11000E+01 volume  0.28932E-02 ppm1      4.373 ppm2      1.802 CV     1
 ASSI { 1633}
   (  segid "    " and resid 56   and name HG2%)
   (  segid "    " and resid 9    and name HG2%)
      2.640     0.870     0.870 peak  1633 spectrum    1 weight  0.11000E+01 volume  0.63716E-02 ppm1      1.002 ppm2      0.809 CV     1
 ASSI { 1635}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HD1 ))
      3.780     1.790     1.790 peak  1635 spectrum    1 weight  0.11000E+01 volume  0.64477E-03 ppm1      4.123 ppm2      2.477 CV     1
 ASSI { 1636}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HG2 ))
      2.660     0.880     0.880 peak  1636 spectrum    1 weight  0.11000E+01 volume  0.44649E-02 ppm1      1.895 ppm2      2.215 CV     1
 OR { 1636}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HG1 ))
 ASSI { 1637}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HD2%)
      3.110     1.210     1.210 peak  1637 spectrum    1 weight  0.11000E+01 volume  0.14124E-02 ppm1      4.486 ppm2      0.818 CV     1
 ASSI { 1638}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HA  ))
      2.730     0.930     0.930 peak  1638 spectrum    1 weight  0.11000E+01 volume  0.27676E-02 ppm1      1.976 ppm2      4.714 CV     1
 ASSI { 1639}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
      2.870     1.030     1.030 peak  1639 spectrum    1 weight  0.11000E+01 volume  0.28700E-02 ppm1      2.085 ppm2      4.716 CV     1
 ASSI { 1640}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 105  and name HG2 ))
      3.140     1.240     1.240 peak  1640 spectrum    1 weight  0.11000E+01 volume  0.96534E-03 ppm1      2.470 ppm2      1.138 CV     1
 ASSI { 1641}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 105  and name HG1 ))
      3.030     1.150     1.150 peak  1641 spectrum    1 weight  0.11000E+01 volume  0.14068E-02 ppm1      2.466 ppm2      1.675 CV     1
 OR { 1641}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 105  and name HG2 ))
 ASSI { 1642}
   (( segid "    " and resid 21   and name HB  ))
   (  segid "    " and resid 32   and name HG2%)
      3.270     1.340     1.340 peak  1642 spectrum    1 weight  0.11000E+01 volume  0.22643E-02 ppm1      3.949 ppm2      0.854 CV     1
 ASSI { 1643}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HB2 ))
      2.240     0.630     0.630 peak  1643 spectrum    1 weight  0.11000E+01 volume  0.80324E-02 ppm1      2.447 ppm2      2.057 CV     1
 ASSI { 1644}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
      2.930     1.070     1.070 peak  1644 spectrum    1 weight  0.11000E+01 volume  0.11928E-02 ppm1      9.228 ppm2      3.330 CV     1
 ASSI { 1645}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.490     0.770     0.770 peak  1645 spectrum    1 weight  0.11000E+01 volume  0.93350E-02 ppm1      1.948 ppm2      1.567 CV     1
 ASSI { 1646}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.760     0.950     0.950 peak  1646 spectrum    1 weight  0.11000E+01 volume  0.38694E-02 ppm1      1.969 ppm2      4.161 CV     1
 ASSI { 1647}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
      2.450     0.750     0.750 peak  1647 spectrum    1 weight  0.11000E+01 volume  0.34897E-02 ppm1      1.908 ppm2      4.162 CV     1
 ASSI { 1648}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
      2.620     0.860     0.860 peak  1648 spectrum    1 weight  0.11000E+01 volume  0.29348E-02 ppm1      3.147 ppm2      5.320 CV     1
 ASSI { 1649}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      2.970     1.100     1.100 peak  1649 spectrum    1 weight  0.11000E+01 volume  0.27302E-02 ppm1      3.218 ppm2      5.322 CV     1
 ASSI { 1650}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HE1 ))
      2.260     0.640     0.640 peak  1650 spectrum    1 weight  0.11000E+01 volume  0.67025E-02 ppm1      1.347 ppm2      3.024 CV     1
 ASSI { 1651}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HA  ))
      2.770     0.960     0.960 peak  1651 spectrum    1 weight  0.11000E+01 volume  0.32668E-02 ppm1      2.002 ppm2      4.498 CV     1
 ASSI { 1652}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
      2.660     0.880     0.880 peak  1652 spectrum    1 weight  0.11000E+01 volume  0.32852E-02 ppm1      2.076 ppm2      4.495 CV     1
 ASSI { 1653}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
      2.700     0.910     0.910 peak  1653 spectrum    1 weight  0.11000E+01 volume  0.46009E-02 ppm1      1.930 ppm2      5.613 CV     1
 ASSI { 1654}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HA  ))
      2.390     0.720     0.720 peak  1654 spectrum    1 weight  0.11000E+01 volume  0.44913E-02 ppm1      2.038 ppm2      5.613 CV     1
 ASSI { 1655}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HD2 ))
      3.290     1.350     1.350 peak  1655 spectrum    1 weight  0.11000E+01 volume  0.31135E-02 ppm1      1.589 ppm2      1.061 CV     1
 ASSI { 1656}
   (( segid "    " and resid 34   and name HE1 ))
   (( segid "    " and resid 34   and name HD2 ))
      2.640     0.870     0.870 peak  1656 spectrum    1 weight  0.11000E+01 volume  0.25294E-02 ppm1      1.678 ppm2      1.059 CV     1
 ASSI { 1657}
   (( segid "    " and resid 34   and name HE1 ))
   (( segid "    " and resid 34   and name HD1 ))
      2.910     1.060     1.060 peak  1657 spectrum    1 weight  0.11000E+01 volume  0.29420E-02 ppm1      1.672 ppm2      1.141 CV     1
 ASSI { 1658}
   (  segid "    " and resid 33   and name HE% )
   (  segid "    " and resid 19   and name HG2%)
      2.750     0.940     0.940 peak  1658 spectrum    1 weight  0.11000E+01 volume  0.23371E-02 ppm1      7.020 ppm2      0.382 CV     1
 ASSI { 1659}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HG2 ))
      2.010     0.510     0.510 peak  1659 spectrum    1 weight  0.11000E+01 volume  0.98565E-02 ppm1      1.884 ppm2      1.484 CV     1
 ASSI { 1660}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 6    and name HA  ))
      2.630     0.860     0.860 peak  1660 spectrum    1 weight  0.11000E+01 volume  0.29325E-02 ppm1      1.907 ppm2      5.395 CV     1
 ASSI { 1661}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      2.730     0.930     0.930 peak  1661 spectrum    1 weight  0.11000E+01 volume  0.33854E-02 ppm1      1.969 ppm2      5.394 CV     1
 ASSI { 1662}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HE2 ))
      3.460     1.500     1.500 peak  1662 spectrum    1 weight  0.11000E+01 volume  0.15500E-02 ppm1      1.847 ppm2      2.988 CV     1
 ASSI { 1663}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HG2 ))
      4.280     2.290     2.220 peak  1663 spectrum    1 weight  0.11000E+01 volume  0.35103E-03 ppm1      7.767 ppm2      2.358 CV     1
 ASSI { 1665}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 106  and name HD2 ))
      2.380     0.710     0.710 peak  1665 spectrum    1 weight  0.11000E+01 volume  0.40860E-02 ppm1      1.973 ppm2      3.817 CV     1
 ASSI { 1666}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 106  and name HD2 ))
      2.860     1.020     1.020 peak  1666 spectrum    1 weight  0.11000E+01 volume  0.37514E-02 ppm1      2.042 ppm2      3.817 CV     1
 ASSI { 1667}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 79   and name HB2 ))
      4.220     2.220     2.220 peak  1667 spectrum    1 weight  0.11000E+01 volume  0.47180E-03 ppm1      0.756 ppm2      3.314 CV     1
 ASSI { 1668}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HD1%)
      2.490     0.780     0.780 peak  1668 spectrum    1 weight  0.11000E+01 volume  0.58002E-02 ppm1      4.475 ppm2      0.907 CV     1
 ASSI { 1669}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HA  ))
      2.370     0.700     0.700 peak  1669 spectrum    1 weight  0.11000E+01 volume  0.76487E-02 ppm1      0.849 ppm2      3.657 CV     1
 ASSI { 1670}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 32   and name HA  ))
      2.710     0.920     0.920 peak  1670 spectrum    1 weight  0.11000E+01 volume  0.26842E-02 ppm1      2.263 ppm2      3.657 CV     1
 ASSI { 1671}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
      3.040     1.150     1.150 peak  1671 spectrum    1 weight  0.11000E+01 volume  0.21926E-02 ppm1      2.218 ppm2      3.657 CV     1
 ASSI { 1672}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HG2 ))
      4.340     2.350     2.160 peak  1672 spectrum    1 weight  0.11000E+01 volume  0.51279E-03 ppm1      8.752 ppm2      2.150 CV     1
 ASSI { 1674}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG1 ))
      3.540     1.560     1.560 peak  1674 spectrum    1 weight  0.11000E+01 volume  0.78518E-03 ppm1      5.613 ppm2      2.173 CV     1
 ASSI { 1675}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG2 ))
      3.520     1.550     1.550 peak  1675 spectrum    1 weight  0.11000E+01 volume  0.79445E-03 ppm1      5.609 ppm2      2.147 CV     1
 ASSI { 1676}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HG1 ))
      4.650     2.700     1.850 peak  1676 spectrum    1 weight  0.11000E+01 volume  0.46055E-03 ppm1      8.747 ppm2      2.172 CV     1
 ASSI { 1677}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HG1 ))
      3.690     1.700     1.700 peak  1677 spectrum    1 weight  0.11000E+01 volume  0.47381E-03 ppm1      8.430 ppm2      2.174 CV     1
 ASSI { 1678}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 18   and name HB2 ))
      4.030     2.030     2.030 peak  1678 spectrum    1 weight  0.11000E+01 volume  0.10557E-02 ppm1      0.784 ppm2      1.934 CV     1
 ASSI { 1679}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 18   and name HG1 ))
      3.250     1.320     1.320 peak  1679 spectrum    1 weight  0.11000E+01 volume  0.16053E-02 ppm1      0.789 ppm2      2.168 CV     1
 ASSI { 1680}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 11   and name HA  ))
      3.690     1.710     1.710 peak  1680 spectrum    1 weight  0.11000E+01 volume  0.52756E-03 ppm1      1.919 ppm2      5.268 CV     1
 ASSI { 1681}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 13   and name HA  ))
      2.240     0.630     0.630 peak  1681 spectrum    1 weight  0.11000E+01 volume  0.76095E-02 ppm1      1.807 ppm2      4.077 CV     1
 ASSI { 1682}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HA  ))
      2.530     0.800     0.800 peak  1682 spectrum    1 weight  0.11000E+01 volume  0.82997E-02 ppm1      2.985 ppm2      4.465 CV     1
 ASSI { 1683}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HA  ))
      2.320     0.680     0.680 peak  1683 spectrum    1 weight  0.11000E+01 volume  0.65552E-02 ppm1      2.934 ppm2      4.465 CV     1
 ASSI { 1684}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      2.430     0.740     0.740 peak  1684 spectrum    1 weight  0.11000E+01 volume  0.51011E-02 ppm1      1.564 ppm2      4.474 CV     1
 ASSI { 1685}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HD1 ))
      2.630     0.860     0.860 peak  1685 spectrum    1 weight  0.11000E+01 volume  0.23880E-02 ppm1      1.943 ppm2      1.442 CV     1
 ASSI { 1686}
   (( segid "    " and resid 53   and name HE2 ))
   (( segid "    " and resid 53   and name HD2 ))
      2.950     1.090     1.090 peak  1686 spectrum    1 weight  0.11000E+01 volume  0.22062E-02 ppm1      2.963 ppm2      1.354 CV     1
 ASSI { 1688}
   (( segid "    " and resid 53   and name HE2 ))
   (( segid "    " and resid 53   and name HD1 ))
      2.720     0.920     0.920 peak  1688 spectrum    1 weight  0.11000E+01 volume  0.23057E-02 ppm1      2.963 ppm2      1.448 CV     1
 ASSI { 1690}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      4.340     2.350     2.160 peak  1690 spectrum    1 weight  0.11000E+01 volume  0.79760E-03 ppm1      4.374 ppm2      2.251 CV     1
 ASSI { 1691}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HG1 ))
      2.950     1.090     1.090 peak  1691 spectrum    1 weight  0.11000E+01 volume  0.29521E-02 ppm1      1.593 ppm2      0.526 CV     1
 ASSI { 1692}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HG1 ))
      2.360     0.700     0.700 peak  1692 spectrum    1 weight  0.11000E+01 volume  0.29757E-02 ppm1      1.706 ppm2      0.526 CV     1
 ASSI { 1693}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HG2 ))
      2.840     1.010     1.010 peak  1693 spectrum    1 weight  0.11000E+01 volume  0.34974E-02 ppm1      1.708 ppm2      0.869 CV     1
 ASSI { 1694}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 35   and name HA  ))
      2.680     0.900     0.900 peak  1694 spectrum    1 weight  0.11000E+01 volume  0.47047E-02 ppm1      2.933 ppm2      4.073 CV     1
 ASSI { 1695}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.280     0.650     0.650 peak  1695 spectrum    1 weight  0.11000E+01 volume  0.59849E-02 ppm1      2.984 ppm2      4.072 CV     1
 ASSI { 1696}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 77   and name HD1 ))
      3.780     1.780     1.780 peak  1696 spectrum    1 weight  0.11000E+01 volume  0.16685E-02 ppm1      1.847 ppm2      3.908 CV     1
 ASSI { 1697}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HG2 ))
      2.450     0.750     0.750 peak  1697 spectrum    1 weight  0.11000E+01 volume  0.44712E-02 ppm1      1.854 ppm2      1.538 CV     1
 ASSI { 1698}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HG1 ))
      2.290     0.650     0.650 peak  1698 spectrum    1 weight  0.11000E+01 volume  0.58575E-02 ppm1      1.853 ppm2      1.347 CV     1
 ASSI { 1700}
   (( segid "    " and resid 31   and name HG1 ))
   (( segid "    " and resid 31   and name HG2 ))
      1.760     0.390     0.440 peak  1700 spectrum    1 weight  0.11000E+01 volume  0.12301E-01 ppm1      1.344 ppm2      1.539 CV     1
 ASSI { 1702}
   (  segid "    " and resid 55   and name HE% )
   (  segid "    " and resid 29   and name HB% )
      3.250     1.320     1.320 peak  1702 spectrum    1 weight  0.11000E+01 volume  0.97460E-03 ppm1      6.752 ppm2      0.482 CV     1
 ASSI { 1704}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 32   and name HA  ))
      2.210     0.610     0.610 peak  1704 spectrum    1 weight  0.11000E+01 volume  0.11829E-01 ppm1      0.934 ppm2      3.657 CV     1
 ASSI { 1705}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 53   and name HG2 ))
      3.180     1.270     1.270 peak  1705 spectrum    1 weight  0.11000E+01 volume  0.14166E-02 ppm1      3.005 ppm2      1.223 CV     1
 ASSI { 1706}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 53   and name HG1 ))
      3.010     1.130     1.130 peak  1706 spectrum    1 weight  0.11000E+01 volume  0.17629E-02 ppm1      3.000 ppm2      1.358 CV     1
 ASSI { 1707}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HG2 ))
      2.740     0.940     0.940 peak  1707 spectrum    1 weight  0.11000E+01 volume  0.22583E-02 ppm1      1.969 ppm2      1.225 CV     1
 ASSI { 1708}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HG2 ))
      2.810     0.980     0.980 peak  1708 spectrum    1 weight  0.11000E+01 volume  0.19488E-02 ppm1      1.908 ppm2      1.226 CV     1
 ASSI { 1709}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HG1 ))
      2.660     0.880     0.880 peak  1709 spectrum    1 weight  0.11000E+01 volume  0.58452E-02 ppm1      1.970 ppm2      1.349 CV     1
 ASSI { 1710}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HG1 ))
      2.270     0.650     0.650 peak  1710 spectrum    1 weight  0.11000E+01 volume  0.64892E-02 ppm1      1.908 ppm2      1.350 CV     1
 ASSI { 1711}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
      2.210     0.610     0.610 peak  1711 spectrum    1 weight  0.11000E+01 volume  0.11501E-01 ppm1      4.016 ppm2      4.297 CV     1
 ASSI { 1712}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      3.710     1.720     1.720 peak  1712 spectrum    1 weight  0.11000E+01 volume  0.12915E-02 ppm1      1.651 ppm2      4.166 CV     1
 ASSI { 1715}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
      3.500     1.530     1.530 peak  1715 spectrum    1 weight  0.11000E+01 volume  0.14612E-02 ppm1      5.306 ppm2      1.541 CV     1
 ASSI { 1716}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.970     1.100     1.100 peak  1716 spectrum    1 weight  0.11000E+01 volume  0.16459E-02 ppm1      8.658 ppm2      4.369 CV     1
 ASSI { 1717}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      4.030     2.030     2.030 peak  1717 spectrum    1 weight  0.11000E+01 volume  0.89441E-03 ppm1      8.238 ppm2      1.799 CV     1
 ASSI { 1719}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 103  and name HA  ))
      4.640     2.700     1.860 peak  1719 spectrum    1 weight  0.11000E+01 volume  0.45770E-03 ppm1      0.540 ppm2      2.860 CV     1
 ASSI { 1720}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 103  and name HA  ))
      5.400     3.640     1.100 peak  1720 spectrum    1 weight  0.11000E+01 volume  0.33124E-03 ppm1      0.216 ppm2      2.857 CV     1
 ASSI { 1721}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 103  and name HA  ))
      3.750     1.750     1.750 peak  1721 spectrum    1 weight  0.11000E+01 volume  0.62338E-03 ppm1      6.991 ppm2      2.865 CV     1
 ASSI { 1723}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 87   and name HA2 ))
      3.400     1.440     1.440 peak  1723 spectrum    1 weight  0.11000E+01 volume  0.46380E-03 ppm1      2.794 ppm2      4.278 CV     1
 ASSI { 1724}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 89   and name HB2 ))
      3.030     1.150     1.150 peak  1724 spectrum    1 weight  0.11000E+01 volume  0.11814E-02 ppm1      6.751 ppm2      1.654 CV     1
 ASSI { 1725}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 89   and name HB1 ))
      4.330     2.340     2.170 peak  1725 spectrum    1 weight  0.11000E+01 volume  0.76926E-03 ppm1      6.748 ppm2      1.613 CV     1
 ASSI { 1726}
   (( segid "    " and resid 92   and name HB  ))
   (( segid "    " and resid 92   and name HA  ))
      3.100     1.200     1.200 peak  1726 spectrum    1 weight  0.11000E+01 volume  0.13850E-02 ppm1      1.614 ppm2      4.363 CV     1
 ASSI { 1727}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.880     1.030     1.030 peak  1727 spectrum    1 weight  0.11000E+01 volume  0.17525E-02 ppm1      9.151 ppm2      4.358 CV     1
 ASSI { 1729}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 79   and name HE3 ))
      3.460     1.500     1.500 peak  1729 spectrum    1 weight  0.11000E+01 volume  0.23746E-02 ppm1      3.200 ppm2      7.291 CV     1
 ASSI { 1730}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 79   and name HE3 ))
      4.260     2.260     2.240 peak  1730 spectrum    1 weight  0.11000E+01 volume  0.33225E-03 ppm1      0.765 ppm2      7.290 CV     1
 ASSI { 1731}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 79   and name HE3 ))
      4.540     2.570     1.960 peak  1731 spectrum    1 weight  0.11000E+01 volume  0.35452E-03 ppm1      0.213 ppm2      7.291 CV     1
 ASSI { 1733}
   (  segid "    " and resid 10   and name HD2%)
   (  segid "    " and resid 36   and name HE% )
      2.490     0.770     0.770 peak  1733 spectrum    1 weight  0.11000E+01 volume  0.36050E-02 ppm1      0.785 ppm2      6.750 CV     1
 ASSI { 1734}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 36   and name HE% )
      4.140     2.140     2.140 peak  1734 spectrum    1 weight  0.11000E+01 volume  0.11110E-02 ppm1      4.795 ppm2      6.747 CV     1
 ASSI { 1736}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA2 ))
      2.970     1.110     1.110 peak  1736 spectrum    1 weight  0.11000E+01 volume  0.21813E-02 ppm1      7.696 ppm2      4.283 CV     1
 ASSI { 1739}
   (( segid "    " and resid 14   and name HB  ))
   (  segid "    " and resid 14   and name HG2%)
      2.100     0.550     0.550 peak  1739 spectrum    1 weight  0.11000E+01 volume  0.15266E-01 ppm1      4.252 ppm2      1.169 CV     1
 ASSI { 1740}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HG1%)
      3.890     1.890     1.890 peak  1740 spectrum    1 weight  0.11000E+01 volume  0.13749E-02 ppm1      8.146 ppm2      0.670 CV     1
 ASSI { 1742}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 76   and name HD2 ))
      3.200     1.280     1.280 peak  1742 spectrum    1 weight  0.11000E+01 volume  0.16924E-02 ppm1      0.762 ppm2      2.683 CV     1
 ASSI { 1743}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HG  ))
      1.990     0.500     0.500 peak  1743 spectrum    1 weight  0.11000E+01 volume  0.15120E-01 ppm1      1.764 ppm2      1.079 CV     1
 ASSI { 1744}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HA  ))
      3.880     1.890     1.890 peak  1744 spectrum    1 weight  0.11000E+01 volume  0.72620E-03 ppm1      7.107 ppm2      4.934 CV     1
 ASSI { 1745}
   (( segid "    " and resid 102  and name HE2 ))
   (( segid "    " and resid 102  and name HG2 ))
      3.390     1.430     1.430 peak  1745 spectrum    1 weight  0.11000E+01 volume  0.14382E-02 ppm1      3.017 ppm2      1.296 CV     1
 ASSI { 1746}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HG2 ))
      4.310     2.320     2.190 peak  1746 spectrum    1 weight  0.11000E+01 volume  0.40244E-03 ppm1      8.249 ppm2      1.294 CV     1
 ASSI { 1747}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HG1 ))
      4.270     2.280     2.230 peak  1747 spectrum    1 weight  0.11000E+01 volume  0.54878E-03 ppm1      8.244 ppm2      1.393 CV     1
 ASSI { 1749}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HG2 ))
      4.200     2.210     2.210 peak  1749 spectrum    1 weight  0.11000E+01 volume  0.36618E-03 ppm1      8.652 ppm2      1.298 CV     1
 ASSI { 1750}
   (( segid "    " and resid 10   and name HG  ))
   (  segid "    " and resid 8    and name HD2%)
      3.340     1.390     1.390 peak  1750 spectrum    1 weight  0.11000E+01 volume  0.26472E-02 ppm1      1.302 ppm2      0.612 CV     1
 ASSI { 1752}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 9    and name HD1%)
      5.260     3.460     1.240 peak  1752 spectrum    1 weight  0.11000E+01 volume  0.35212E-03 ppm1      8.710 ppm2      0.778 CV     1
 ASSI { 1753}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 9    and name HD1%)
      3.710     1.720     1.720 peak  1753 spectrum    1 weight  0.11000E+01 volume  0.16612E-02 ppm1      4.338 ppm2      0.782 CV     1
 ASSI { 1754}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 11   and name HA  ))
      4.450     2.470     2.050 peak  1754 spectrum    1 weight  0.11000E+01 volume  0.61257E-03 ppm1      4.060 ppm2      5.272 CV     1
 ASSI { 1756}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      2.760     0.950     0.950 peak  1756 spectrum    1 weight  0.11000E+01 volume  0.36117E-02 ppm1      3.326 ppm2      5.395 CV     1
 ASSI {    1}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 21   and name HN  ))
      2.920     1.060     1.060 peak     1 spectrum    1 weight  0.11000E+01 volume  0.19689E-02 ppm1      0.545 ppm2      8.993 CV     1
 ASSI {    2}
   (( segid "    " and resid 33   and name HZ  ))
   (( segid "    " and resid 21   and name HN  ))
      2.920     1.070     1.070 peak     2 spectrum    1 weight  0.11000E+01 volume  0.20751E-02 ppm1      7.193 ppm2      8.997 CV     1
 ASSI {    3}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      2.710     0.920     0.920 peak     3 spectrum    1 weight  0.11000E+01 volume  0.25333E-02 ppm1      8.449 ppm2      7.293 CV     1
 ASSI {    5}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      2.560     0.820     0.820 peak     5 spectrum    1 weight  0.11000E+01 volume  0.23737E-02 ppm1      3.217 ppm2     10.309 CV     1
 ASSI {    7}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HE1 ))
      2.410     0.730     0.730 peak     7 spectrum    1 weight  0.11000E+01 volume  0.68830E-02 ppm1      7.581 ppm2     10.550 CV     1
 ASSI {    8}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 46   and name HE1 ))
      2.640     0.870     0.870 peak     8 spectrum    1 weight  0.11000E+01 volume  0.34801E-02 ppm1      7.390 ppm2     10.550 CV     1
 ASSI {   11}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HE1 ))
      2.430     0.740     0.740 peak    11 spectrum    1 weight  0.11000E+01 volume  0.60746E-02 ppm1      7.054 ppm2     10.332 CV     1
 ASSI {   12}
   (( segid "    " and resid 79   and name HZ2 ))
   (( segid "    " and resid 79   and name HE1 ))
      2.790     0.980     0.980 peak    12 spectrum    1 weight  0.11000E+01 volume  0.31688E-02 ppm1      7.382 ppm2     10.334 CV     1
 ASSI {   13}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 79   and name HE1 ))
      3.580     1.600     1.600 peak    13 spectrum    1 weight  0.11000E+01 volume  0.10530E-02 ppm1      1.841 ppm2     10.332 CV     1
 ASSI {   18}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 103  and name HN  ))
      2.830     1.000     1.000 peak    18 spectrum    1 weight  0.11000E+01 volume  0.36392E-02 ppm1      2.590 ppm2      8.247 CV     1
 ASSI {   19}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HN  ))
      2.570     0.820     0.820 peak    19 spectrum    1 weight  0.11000E+01 volume  0.39562E-02 ppm1      2.263 ppm2      8.249 CV     1
 ASSI {   20}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      2.080     0.540     0.540 peak    20 spectrum    1 weight  0.11000E+01 volume  0.10414E-01 ppm1      4.728 ppm2      8.150 CV     1
 ASSI {   21}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HN  ))
      3.020     1.140     1.140 peak    21 spectrum    1 weight  0.11000E+01 volume  0.15416E-02 ppm1      2.838 ppm2      8.248 CV     1
 ASSI {   22}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 103  and name HN  ))
      3.780     1.790     1.790 peak    22 spectrum    1 weight  0.11000E+01 volume  0.98048E-03 ppm1      1.727 ppm2      8.247 CV     1
 ASSI {   29}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      2.310     0.670     0.670 peak    29 spectrum    1 weight  0.11000E+01 volume  0.68456E-02 ppm1      5.016 ppm2      7.732 CV     1
 ASSI {   30}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
      2.940     1.080     1.080 peak    30 spectrum    1 weight  0.11000E+01 volume  0.21349E-02 ppm1      2.631 ppm2      7.724 CV     1
 ASSI {   31}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.100     0.550     0.550 peak    31 spectrum    1 weight  0.11000E+01 volume  0.11229E-01 ppm1      4.173 ppm2      8.496 CV     1
 ASSI {   33}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
      3.070     1.180     1.180 peak    33 spectrum    1 weight  0.11000E+01 volume  0.16642E-02 ppm1      2.714 ppm2      8.489 CV     1
 ASSI {   35}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      2.340     0.680     0.680 peak    35 spectrum    1 weight  0.11000E+01 volume  0.58555E-02 ppm1      4.580 ppm2      8.317 CV     1
 ASSI {   36}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      3.030     1.150     1.150 peak    36 spectrum    1 weight  0.11000E+01 volume  0.14556E-02 ppm1      4.318 ppm2      8.313 CV     1
 ASSI {   37}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 82   and name HN  ))
      2.760     0.950     0.950 peak    37 spectrum    1 weight  0.11000E+01 volume  0.26657E-02 ppm1      1.738 ppm2      8.314 CV     1
 ASSI {   38}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HN  ))
      3.510     1.540     1.540 peak    38 spectrum    1 weight  0.11000E+01 volume  0.15825E-02 ppm1     -0.092 ppm2      8.315 CV     1
 ASSI {   40}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 82   and name HN  ))
      4.420     2.440     2.080 peak    40 spectrum    1 weight  0.11000E+01 volume  0.68195E-03 ppm1      1.995 ppm2      8.311 CV     1
 ASSI {   41}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 43   and name HN  ))
      3.770     1.780     1.780 peak    41 spectrum    1 weight  0.11000E+01 volume  0.71812E-03 ppm1      2.525 ppm2      8.487 CV     1
 ASSI {   43}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      2.210     0.610     0.610 peak    43 spectrum    1 weight  0.11000E+01 volume  0.80092E-02 ppm1      5.223 ppm2      8.578 CV     1
 ASSI {   45}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
      2.610     0.850     0.850 peak    45 spectrum    1 weight  0.11000E+01 volume  0.42902E-02 ppm1      4.532 ppm2      8.054 CV     1
 ASSI {   47}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 109  and name HN  ))
      3.800     1.800     1.800 peak    47 spectrum    1 weight  0.11000E+01 volume  0.79391E-03 ppm1      3.099 ppm2      8.051 CV     1
 ASSI {   48}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HN  ))
      3.200     1.280     1.280 peak    48 spectrum    1 weight  0.11000E+01 volume  0.18413E-02 ppm1      1.896 ppm2      8.054 CV     1
 ASSI {   50}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HN  ))
      3.380     1.430     1.430 peak    50 spectrum    1 weight  0.11000E+01 volume  0.97989E-03 ppm1      2.021 ppm2      8.052 CV     1
 ASSI {   51}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
      2.950     1.090     1.090 peak    51 spectrum    1 weight  0.11000E+01 volume  0.23041E-02 ppm1      0.771 ppm2      8.582 CV     1
 ASSI {   52}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 8    and name HN  ))
      2.960     1.100     1.100 peak    52 spectrum    1 weight  0.11000E+01 volume  0.12673E-02 ppm1     -1.128 ppm2      8.580 CV     1
 ASSI {   54}
   (( segid "    " and resid 9    and name HG12))
   (( segid "    " and resid 9    and name HN  ))
      3.810     1.810     1.810 peak    54 spectrum    1 weight  0.11000E+01 volume  0.10426E-02 ppm1      1.402 ppm2      9.115 CV     1
 ASSI {   55}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 9    and name HN  ))
      2.510     0.790     0.790 peak    55 spectrum    1 weight  0.11000E+01 volume  0.33708E-02 ppm1      1.988 ppm2      9.114 CV     1
 ASSI {   60}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 8    and name HN  ))
      3.610     1.620     1.620 peak    60 spectrum    1 weight  0.11000E+01 volume  0.10527E-02 ppm1      1.470 ppm2      8.582 CV     1
 ASSI {   61}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 8    and name HN  ))
      4.190     2.200     2.200 peak    61 spectrum    1 weight  0.11000E+01 volume  0.75150E-03 ppm1      0.592 ppm2      8.584 CV     1
 ASSI {   62}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      3.100     1.200     1.200 peak    62 spectrum    1 weight  0.11000E+01 volume  0.16424E-02 ppm1      5.607 ppm2      8.709 CV     1
 ASSI {   64}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.030     0.520     0.520 peak    64 spectrum    1 weight  0.11000E+01 volume  0.10809E-01 ppm1      4.322 ppm2      8.709 CV     1
 ASSI {   65}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      2.000     0.500     0.500 peak    65 spectrum    1 weight  0.11000E+01 volume  0.12234E-01 ppm1      4.517 ppm2      8.869 CV     1
 ASSI {   66}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      2.990     1.120     1.120 peak    66 spectrum    1 weight  0.11000E+01 volume  0.16298E-02 ppm1      4.722 ppm2      8.872 CV     1
 ASSI {   67}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      2.290     0.650     0.650 peak    67 spectrum    1 weight  0.11000E+01 volume  0.76410E-02 ppm1      4.759 ppm2      8.952 CV     1
 ASSI {   68}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      2.970     1.100     1.100 peak    68 spectrum    1 weight  0.11000E+01 volume  0.16198E-02 ppm1      4.618 ppm2      8.951 CV     1
 ASSI {   69}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 10   and name HN  ))
      2.420     0.730     0.730 peak    69 spectrum    1 weight  0.11000E+01 volume  0.43816E-02 ppm1      0.803 ppm2      8.714 CV     1
 ASSI {   70}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 81   and name HN  ))
      2.840     1.010     1.010 peak    70 spectrum    1 weight  0.11000E+01 volume  0.19429E-02 ppm1      1.080 ppm2      8.948 CV     1
 ASSI {   71}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      2.610     0.850     0.850 peak    71 spectrum    1 weight  0.11000E+01 volume  0.29989E-02 ppm1      1.764 ppm2      8.950 CV     1
 ASSI {   72}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      2.740     0.940     0.940 peak    72 spectrum    1 weight  0.11000E+01 volume  0.39659E-02 ppm1      1.987 ppm2      8.948 CV     1
 ASSI {   73}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
      3.220     1.300     1.300 peak    73 spectrum    1 weight  0.11000E+01 volume  0.21234E-02 ppm1      2.562 ppm2      8.868 CV     1
 ASSI {   75}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 11   and name HN  ))
      4.210     2.210     2.210 peak    75 spectrum    1 weight  0.11000E+01 volume  0.10737E-02 ppm1      0.784 ppm2      8.873 CV     1
 ASSI {   76}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
      3.570     1.590     1.590 peak    76 spectrum    1 weight  0.11000E+01 volume  0.10552E-02 ppm1      1.368 ppm2      8.865 CV     1
 ASSI {   78}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.810     1.810     1.810 peak    78 spectrum    1 weight  0.11000E+01 volume  0.93718E-03 ppm1      2.337 ppm2      8.948 CV     1
 ASSI {   79}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      2.450     0.750     0.750 peak    79 spectrum    1 weight  0.11000E+01 volume  0.51663E-02 ppm1      8.859 ppm2      7.373 CV     1
 ASSI {   80}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      4.000     2.000     2.000 peak    80 spectrum    1 weight  0.11000E+01 volume  0.53389E-03 ppm1      8.150 ppm2      7.370 CV     1
 ASSI {   81}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      4.100     2.100     2.100 peak    81 spectrum    1 weight  0.11000E+01 volume  0.46707E-03 ppm1      9.316 ppm2      7.377 CV     1
 ASSI {   82}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 6    and name HN  ))
      2.990     1.120     1.120 peak    82 spectrum    1 weight  0.11000E+01 volume  0.21746E-02 ppm1      7.207 ppm2      9.249 CV     1
 ASSI {   83}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      3.310     1.370     1.370 peak    83 spectrum    1 weight  0.11000E+01 volume  0.81910E-03 ppm1      8.437 ppm2      9.194 CV     1
 ASSI {   84}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 15   and name HN  ))
      3.140     1.230     1.230 peak    84 spectrum    1 weight  0.11000E+01 volume  0.15225E-02 ppm1      4.267 ppm2      7.373 CV     1
 ASSI {   85}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 15   and name HN  ))
      3.030     1.140     1.140 peak    85 spectrum    1 weight  0.11000E+01 volume  0.13218E-02 ppm1      4.083 ppm2      7.376 CV     1
 ASSI {   87}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HN  ))
      2.820     1.000     1.000 peak    87 spectrum    1 weight  0.11000E+01 volume  0.21363E-02 ppm1      5.434 ppm2      9.247 CV     1
 ASSI {   88}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.330     0.680     0.680 peak    88 spectrum    1 weight  0.11000E+01 volume  0.68830E-02 ppm1      4.639 ppm2      8.538 CV     1
 ASSI {   89}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      3.040     1.160     1.160 peak    89 spectrum    1 weight  0.11000E+01 volume  0.15923E-02 ppm1      4.119 ppm2      8.532 CV     1
 ASSI {   90}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 23   and name HN  ))
      2.800     0.980     0.980 peak    90 spectrum    1 weight  0.11000E+01 volume  0.25889E-02 ppm1      1.303 ppm2      9.196 CV     1
 ASSI {   91}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      3.380     1.430     1.430 peak    91 spectrum    1 weight  0.11000E+01 volume  0.13250E-02 ppm1      1.894 ppm2      9.197 CV     1
 ASSI {   92}
   (( segid "    " and resid 5    and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
      3.730     1.740     1.740 peak    92 spectrum    1 weight  0.11000E+01 volume  0.14016E-02 ppm1      2.040 ppm2      9.251 CV     1
 OR {   92}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
 ASSI {   93}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 6    and name HN  ))
      3.310     1.370     1.370 peak    93 spectrum    1 weight  0.11000E+01 volume  0.90790E-03 ppm1      2.402 ppm2      9.257 CV     1
 ASSI {   94}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
      3.520     1.550     1.550 peak    94 spectrum    1 weight  0.11000E+01 volume  0.17267E-02 ppm1      2.793 ppm2      9.253 CV     1
 ASSI {   95}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      3.790     1.790     1.790 peak    95 spectrum    1 weight  0.11000E+01 volume  0.11835E-02 ppm1      2.993 ppm2      9.194 CV     1
 ASSI {   97}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
      2.860     1.020     1.020 peak    97 spectrum    1 weight  0.11000E+01 volume  0.26896E-02 ppm1      2.819 ppm2      8.538 CV     1
 ASSI {   98}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      2.790     0.970     0.970 peak    98 spectrum    1 weight  0.11000E+01 volume  0.27589E-02 ppm1      2.551 ppm2      8.539 CV     1
 ASSI {   99}
   (  segid "    " and resid 15   and name HD2%)
   (( segid "    " and resid 15   and name HN  ))
      3.720     1.730     1.730 peak    99 spectrum    1 weight  0.11000E+01 volume  0.10302E-02 ppm1      0.849 ppm2      7.372 CV     1
 ASSI {  100}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 15   and name HN  ))
      4.160     2.160     2.160 peak   100 spectrum    1 weight  0.11000E+01 volume  0.49000E-03 ppm1      1.183 ppm2      7.368 CV     1
 ASSI {  101}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
      2.610     0.850     0.850 peak   101 spectrum    1 weight  0.11000E+01 volume  0.34588E-02 ppm1      1.537 ppm2      7.373 CV     1
 ASSI {  102}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
      2.750     0.950     0.950 peak   102 spectrum    1 weight  0.11000E+01 volume  0.35651E-02 ppm1      1.464 ppm2      7.373 CV     1
 ASSI {  103}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 15   and name HN  ))
      3.720     1.730     1.730 peak   103 spectrum    1 weight  0.11000E+01 volume  0.60515E-03 ppm1      1.808 ppm2      7.374 CV     1
 ASSI {  104}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      2.200     0.610     0.610 peak   104 spectrum    1 weight  0.11000E+01 volume  0.84131E-02 ppm1      5.454 ppm2      9.195 CV     1
 ASSI {  105}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      2.820     0.990     0.990 peak   105 spectrum    1 weight  0.11000E+01 volume  0.23583E-02 ppm1      4.901 ppm2      9.198 CV     1
 ASSI {  106}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      2.710     0.920     0.920 peak   106 spectrum    1 weight  0.11000E+01 volume  0.30949E-02 ppm1      4.174 ppm2      8.506 CV     1
 ASSI {  107}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      2.350     0.690     0.690 peak   107 spectrum    1 weight  0.11000E+01 volume  0.66953E-02 ppm1      4.736 ppm2      8.092 CV     1
 ASSI {  109}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      2.200     0.600     0.600 peak   109 spectrum    1 weight  0.11000E+01 volume  0.11015E-01 ppm1      4.420 ppm2      8.352 CV     1
 ASSI {  112}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      2.830     1.000     1.000 peak   112 spectrum    1 weight  0.11000E+01 volume  0.21440E-02 ppm1      4.056 ppm2      8.435 CV     1
 ASSI {  116}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      3.080     1.190     1.190 peak   116 spectrum    1 weight  0.11000E+01 volume  0.27498E-02 ppm1      1.939 ppm2      8.495 CV     1
 ASSI {  117}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
      3.860     1.870     1.870 peak   117 spectrum    1 weight  0.11000E+01 volume  0.12357E-02 ppm1      1.789 ppm2      8.358 CV     1
 ASSI {  118}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 74   and name HN  ))
      4.140     2.150     2.150 peak   118 spectrum    1 weight  0.11000E+01 volume  0.78138E-03 ppm1      2.037 ppm2      8.350 CV     1
 ASSI {  119}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      2.870     1.030     1.030 peak   119 spectrum    1 weight  0.11000E+01 volume  0.15652E-02 ppm1      2.345 ppm2      8.352 CV     1
 ASSI {  120}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HN  ))
      2.880     1.040     1.040 peak   120 spectrum    1 weight  0.11000E+01 volume  0.14308E-02 ppm1      1.960 ppm2      8.205 CV     1
 ASSI {  121}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HN  ))
      2.920     1.070     1.070 peak   121 spectrum    1 weight  0.11000E+01 volume  0.27025E-02 ppm1      1.912 ppm2      8.098 CV     1
 ASSI {  122}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 16   and name HN  ))
      3.360     1.420     1.420 peak   122 spectrum    1 weight  0.11000E+01 volume  0.26879E-02 ppm1      1.475 ppm2      8.162 CV     1
 ASSI {  124}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HN  ))
      3.270     1.330     1.330 peak   124 spectrum    1 weight  0.11000E+01 volume  0.22413E-02 ppm1      1.136 ppm2      8.434 CV     1
 OR {  124}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HN  ))
 ASSI {  125}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HN  ))
      3.110     1.210     1.210 peak   125 spectrum    1 weight  0.11000E+01 volume  0.51230E-02 ppm1      1.662 ppm2      8.433 CV     1
 ASSI {  126}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HN  ))
      4.050     2.050     2.050 peak   126 spectrum    1 weight  0.11000E+01 volume  0.86775E-03 ppm1      0.557 ppm2      8.433 CV     1
 ASSI {  127}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HN  ))
      3.450     1.490     1.490 peak   127 spectrum    1 weight  0.11000E+01 volume  0.87856E-03 ppm1      0.762 ppm2      8.433 CV     1
 ASSI {  128}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 105  and name HN  ))
      4.950     3.060     1.550 peak   128 spectrum    1 weight  0.11000E+01 volume  0.43106E-03 ppm1      0.215 ppm2      8.432 CV     1
 ASSI {  129}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 16   and name HN  ))
      4.000     2.000     2.000 peak   129 spectrum    1 weight  0.11000E+01 volume  0.91295E-03 ppm1      1.923 ppm2      8.163 CV     1
 ASSI {  130}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 72   and name HN  ))
      3.340     1.390     1.390 peak   130 spectrum    1 weight  0.11000E+01 volume  0.12141E-02 ppm1      2.332 ppm2      8.483 CV     1
 ASSI {  131}
   (( segid "    " and resid 104  and name HD1 ))
   (( segid "    " and resid 105  and name HN  ))
      3.770     1.780     1.780 peak   131 spectrum    1 weight  0.11000E+01 volume  0.14307E-02 ppm1      2.569 ppm2      8.434 CV     1
 ASSI {  132}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      3.720     1.730     1.730 peak   132 spectrum    1 weight  0.11000E+01 volume  0.98244E-03 ppm1      2.846 ppm2      8.435 CV     1
 ASSI {  133}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 105  and name HN  ))
      3.200     1.280     1.280 peak   133 spectrum    1 weight  0.11000E+01 volume  0.83502E-03 ppm1      2.358 ppm2      8.435 CV     1
 ASSI {  134}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      3.000     1.130     1.130 peak   134 spectrum    1 weight  0.11000E+01 volume  0.11182E-02 ppm1      2.983 ppm2      8.921 CV     1
 ASSI {  138}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      2.750     0.940     0.940 peak   138 spectrum    1 weight  0.11000E+01 volume  0.22851E-02 ppm1      4.503 ppm2      8.253 CV     1
 ASSI {  140}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 94   and name HN  ))
      2.420     0.730     0.730 peak   140 spectrum    1 weight  0.11000E+01 volume  0.50608E-02 ppm1      3.654 ppm2      8.833 CV     1
 ASSI {  141}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HN  ))
      2.950     1.090     1.090 peak   141 spectrum    1 weight  0.11000E+01 volume  0.18092E-02 ppm1      4.208 ppm2      8.832 CV     1
 ASSI {  142}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 94   and name HN  ))
      3.140     1.230     1.230 peak   142 spectrum    1 weight  0.11000E+01 volume  0.14040E-02 ppm1      5.797 ppm2      8.833 CV     1
 ASSI {  144}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      2.210     0.610     0.610 peak   144 spectrum    1 weight  0.11000E+01 volume  0.67844E-02 ppm1      4.159 ppm2      7.860 CV     1
 ASSI {  145}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      3.190     1.270     1.270 peak   145 spectrum    1 weight  0.11000E+01 volume  0.12310E-02 ppm1      4.390 ppm2      7.855 CV     1
 ASSI {  146}
   (( segid "    " and resid 94   and name HD2 ))
   (( segid "    " and resid 94   and name HN  ))
      3.730     1.740     1.740 peak   146 spectrum    1 weight  0.11000E+01 volume  0.85147E-03 ppm1      6.896 ppm2      8.834 CV     1
 ASSI {  147}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.300     0.660     0.660 peak   147 spectrum    1 weight  0.11000E+01 volume  0.56386E-02 ppm1      7.013 ppm2      7.859 CV     1
 ASSI {  148}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.770     0.960     0.960 peak   148 spectrum    1 weight  0.11000E+01 volume  0.25393E-02 ppm1      7.393 ppm2      7.862 CV     1
 ASSI {  151}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.560     1.580     1.580 peak   151 spectrum    1 weight  0.11000E+01 volume  0.92607E-03 ppm1      9.110 ppm2      8.266 CV     1
 ASSI {  152}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 94   and name HN  ))
      3.070     1.180     1.180 peak   152 spectrum    1 weight  0.11000E+01 volume  0.16861E-02 ppm1      3.036 ppm2      8.833 CV     1
 ASSI {  153}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HN  ))
      2.710     0.920     0.920 peak   153 spectrum    1 weight  0.11000E+01 volume  0.27354E-02 ppm1      3.300 ppm2      8.833 CV     1
 ASSI {  154}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 57   and name HN  ))
      3.130     1.230     1.230 peak   154 spectrum    1 weight  0.11000E+01 volume  0.13239E-02 ppm1     -0.277 ppm2      8.255 CV     1
 ASSI {  157}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 57   and name HN  ))
      3.670     1.690     1.690 peak   157 spectrum    1 weight  0.11000E+01 volume  0.10630E-02 ppm1      0.757 ppm2      8.252 CV     1
 ASSI {  160}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 58   and name HN  ))
      4.000     2.000     2.000 peak   160 spectrum    1 weight  0.11000E+01 volume  0.67060E-03 ppm1      0.387 ppm2      8.385 CV     1
 ASSI {  161}
   (( segid "    " and resid 53   and name HG1 ))
   (( segid "    " and resid 53   and name HN  ))
      3.130     1.220     1.220 peak   161 spectrum    1 weight  0.11000E+01 volume  0.19804E-02 ppm1      1.377 ppm2      7.860 CV     1
 ASSI {  162}
   (( segid "    " and resid 53   and name HG2 ))
   (( segid "    " and resid 53   and name HN  ))
      3.840     1.840     1.840 peak   162 spectrum    1 weight  0.11000E+01 volume  0.10370E-02 ppm1      1.197 ppm2      7.869 CV     1
 ASSI {  163}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      4.230     2.230     2.230 peak   163 spectrum    1 weight  0.11000E+01 volume  0.67215E-03 ppm1      1.189 ppm2      8.379 CV     1
 ASSI {  167}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      2.860     1.020     1.020 peak   167 spectrum    1 weight  0.11000E+01 volume  0.23462E-02 ppm1      3.129 ppm2      6.960 CV     1
 ASSI {  168}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      3.240     1.310     1.310 peak   168 spectrum    1 weight  0.11000E+01 volume  0.10430E-02 ppm1      3.498 ppm2      6.957 CV     1
 ASSI {  169}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      3.380     1.430     1.430 peak   169 spectrum    1 weight  0.11000E+01 volume  0.98327E-03 ppm1      3.710 ppm2      6.956 CV     1
 ASSI {  170}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 29   and name HN  ))
      2.700     0.910     0.910 peak   170 spectrum    1 weight  0.11000E+01 volume  0.27938E-02 ppm1      4.002 ppm2      6.959 CV     1
 ASSI {  171}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      2.540     0.810     0.810 peak   171 spectrum    1 weight  0.11000E+01 volume  0.35042E-02 ppm1      7.964 ppm2      6.958 CV     1
 ASSI {  173}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
      2.550     0.810     0.810 peak   173 spectrum    1 weight  0.11000E+01 volume  0.31905E-02 ppm1      8.474 ppm2      9.168 CV     1
 ASSI {  175}
   (  segid "    " and resid 36   and name HE% )
   (( segid "    " and resid 37   and name HN  ))
      3.960     1.960     1.960 peak   175 spectrum    1 weight  0.11000E+01 volume  0.80835E-03 ppm1      6.766 ppm2      9.225 CV     1
 ASSI {  176}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 37   and name HN  ))
      3.120     1.220     1.220 peak   176 spectrum    1 weight  0.11000E+01 volume  0.11805E-02 ppm1      6.987 ppm2      9.220 CV     1
 ASSI {  177}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 7    and name HN  ))
      3.440     1.480     1.480 peak   177 spectrum    1 weight  0.11000E+01 volume  0.81464E-03 ppm1      7.190 ppm2      9.133 CV     1
 ASSI {  178}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.910     1.910     1.910 peak   178 spectrum    1 weight  0.11000E+01 volume  0.66478E-03 ppm1      7.458 ppm2      9.215 CV     1
 ASSI {  180}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      2.830     1.000     1.000 peak   180 spectrum    1 weight  0.11000E+01 volume  0.24023E-02 ppm1      8.070 ppm2      8.386 CV     1
 ASSI {  181}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      2.300     0.660     0.660 peak   181 spectrum    1 weight  0.11000E+01 volume  0.70874E-02 ppm1      5.391 ppm2      9.135 CV     1
 ASSI {  183}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      3.120     1.210     1.210 peak   183 spectrum    1 weight  0.11000E+01 volume  0.10900E-02 ppm1      5.214 ppm2      9.137 CV     1
 ASSI {  184}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      2.710     0.920     0.920 peak   184 spectrum    1 weight  0.11000E+01 volume  0.32814E-02 ppm1      3.975 ppm2      8.287 CV     1
 ASSI {  186}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      3.200     1.280     1.280 peak   186 spectrum    1 weight  0.11000E+01 volume  0.15626E-02 ppm1      4.229 ppm2      9.220 CV     1
 ASSI {  189}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.090     1.200     1.200 peak   189 spectrum    1 weight  0.11000E+01 volume  0.56509E-02 ppm1      3.326 ppm2      9.221 CV     1
 ASSI {  191}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 27   and name HN  ))
      3.080     1.190     1.190 peak   191 spectrum    1 weight  0.11000E+01 volume  0.17891E-02 ppm1      3.032 ppm2      8.290 CV     1
 OR {  191}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 27   and name HN  ))
 ASSI {  192}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
      3.280     1.340     1.340 peak   192 spectrum    1 weight  0.11000E+01 volume  0.71604E-03 ppm1      2.812 ppm2      9.136 CV     1
 ASSI {  193}
   (  segid "    " and resid 37   and name HB% )
   (( segid "    " and resid 37   and name HN  ))
      2.180     0.590     0.590 peak   193 spectrum    1 weight  0.11000E+01 volume  0.96142E-02 ppm1      1.869 ppm2      9.220 CV     1
 ASSI {  194}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HN  ))
      2.930     1.080     1.080 peak   194 spectrum    1 weight  0.11000E+01 volume  0.22746E-02 ppm1      2.001 ppm2      9.139 CV     1
 ASSI {  195}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
      2.910     1.060     1.060 peak   195 spectrum    1 weight  0.11000E+01 volume  0.21259E-02 ppm1      1.916 ppm2      9.134 CV     1
 ASSI {  196}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
      2.190     0.600     0.600 peak   196 spectrum    1 weight  0.11000E+01 volume  0.55221E-02 ppm1      1.663 ppm2      9.167 CV     1
 ASSI {  197}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 70   and name HN  ))
      2.820     0.990     0.990 peak   197 spectrum    1 weight  0.11000E+01 volume  0.25023E-02 ppm1      1.872 ppm2      8.252 CV     1
 ASSI {  198}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 27   and name HN  ))
      2.160     0.590     0.590 peak   198 spectrum    1 weight  0.11000E+01 volume  0.11890E-01 ppm1      1.313 ppm2      8.286 CV     1
 ASSI {  199}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HN  ))
      3.270     1.330     1.330 peak   199 spectrum    1 weight  0.11000E+01 volume  0.18109E-02 ppm1      0.864 ppm2      9.166 CV     1
 ASSI {  200}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HN  ))
      2.940     1.080     1.080 peak   200 spectrum    1 weight  0.11000E+01 volume  0.15795E-02 ppm1      0.533 ppm2      9.164 CV     1
 ASSI {  202}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 88   and name HN  ))
      4.120     2.130     2.130 peak   202 spectrum    1 weight  0.11000E+01 volume  0.92560E-03 ppm1      1.164 ppm2      7.652 CV     1
 ASSI {  204}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 88   and name HN  ))
      2.440     0.740     0.740 peak   204 spectrum    1 weight  0.11000E+01 volume  0.43579E-02 ppm1      2.294 ppm2      7.651 CV     1
 ASSI {  205}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.450     1.490     1.490 peak   205 spectrum    1 weight  0.11000E+01 volume  0.93201E-03 ppm1      3.729 ppm2      7.650 CV     1
 ASSI {  206}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HN  ))
      2.990     1.120     1.120 peak   206 spectrum    1 weight  0.11000E+01 volume  0.15407E-02 ppm1      4.191 ppm2      7.650 CV     1
 ASSI {  209}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      2.980     1.110     1.110 peak   209 spectrum    1 weight  0.11000E+01 volume  0.15809E-02 ppm1      9.614 ppm2      7.648 CV     1
 ASSI {  210}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      2.490     0.780     0.780 peak   210 spectrum    1 weight  0.11000E+01 volume  0.39093E-02 ppm1      8.277 ppm2      8.973 CV     1
 ASSI {  211}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      2.530     0.800     0.800 peak   211 spectrum    1 weight  0.11000E+01 volume  0.35366E-02 ppm1      7.425 ppm2      8.974 CV     1
 ASSI {  212}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      2.940     1.080     1.080 peak   212 spectrum    1 weight  0.11000E+01 volume  0.16094E-02 ppm1      9.396 ppm2      9.173 CV     1
 ASSI {  213}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 90   and name HN  ))
      2.750     0.940     0.940 peak   213 spectrum    1 weight  0.11000E+01 volume  0.20659E-02 ppm1      6.766 ppm2      8.726 CV     1
 ASSI {  215}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      2.980     1.110     1.110 peak   215 spectrum    1 weight  0.11000E+01 volume  0.15430E-02 ppm1      8.314 ppm2      8.724 CV     1
 ASSI {  219}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      2.970     1.110     1.110 peak   219 spectrum    1 weight  0.11000E+01 volume  0.14948E-02 ppm1      4.546 ppm2      8.725 CV     1
 ASSI {  220}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      2.650     0.880     0.880 peak   220 spectrum    1 weight  0.11000E+01 volume  0.38679E-02 ppm1      4.374 ppm2      8.976 CV     1
 ASSI {  221}
   (( segid "    " and resid 12   and name HA2 ))
   (( segid "    " and resid 13   and name HN  ))
      2.270     0.640     0.640 peak   221 spectrum    1 weight  0.11000E+01 volume  0.49531E-02 ppm1      4.481 ppm2      9.313 CV     1
 ASSI {  222}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 13   and name HN  ))
      2.670     0.890     0.890 peak   222 spectrum    1 weight  0.11000E+01 volume  0.64049E-02 ppm1      4.074 ppm2      9.313 CV     1
 ASSI {  223}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 13   and name HN  ))
      3.020     1.140     1.140 peak   223 spectrum    1 weight  0.11000E+01 volume  0.77930E-03 ppm1      2.455 ppm2      9.313 CV     1
 ASSI {  224}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      2.930     1.080     1.080 peak   224 spectrum    1 weight  0.11000E+01 volume  0.27374E-02 ppm1      2.581 ppm2      8.975 CV     1
 ASSI {  225}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      2.380     0.710     0.710 peak   225 spectrum    1 weight  0.11000E+01 volume  0.55074E-02 ppm1      2.751 ppm2      8.977 CV     1
 ASSI {  226}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      3.100     1.200     1.200 peak   226 spectrum    1 weight  0.11000E+01 volume  0.48997E-02 ppm1      2.947 ppm2      8.974 CV     1
 ASSI {  227}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
      4.150     2.160     2.160 peak   227 spectrum    1 weight  0.11000E+01 volume  0.10316E-02 ppm1      3.205 ppm2      9.166 CV     1
 ASSI {  229}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 26   and name HN  ))
      2.510     0.790     0.790 peak   229 spectrum    1 weight  0.11000E+01 volume  0.58218E-02 ppm1      3.025 ppm2      8.423 CV     1
 OR {  229}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 26   and name HN  ))
 ASSI {  230}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HN  ))
      2.260     0.640     0.640 peak   230 spectrum    1 weight  0.11000E+01 volume  0.65094E-02 ppm1      1.835 ppm2      9.313 CV     1
 ASSI {  231}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 13   and name HN  ))
      3.390     1.430     1.430 peak   231 spectrum    1 weight  0.11000E+01 volume  0.15743E-02 ppm1      2.173 ppm2      9.313 CV     1
 ASSI {  233}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 13   and name HN  ))
      2.470     0.760     0.760 peak   233 spectrum    1 weight  0.11000E+01 volume  0.27124E-02 ppm1      1.470 ppm2      9.313 CV     1
 ASSI {  234}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 92   and name HN  ))
      3.560     1.580     1.580 peak   234 spectrum    1 weight  0.11000E+01 volume  0.18028E-02 ppm1      0.728 ppm2      9.164 CV     1
 ASSI {  237}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 90   and name HN  ))
      3.870     1.880     1.880 peak   237 spectrum    1 weight  0.11000E+01 volume  0.12558E-02 ppm1      1.636 ppm2      8.727 CV     1
 ASSI {  239}
   (( segid "    " and resid 92   and name HB  ))
   (( segid "    " and resid 80   and name HN  ))
      3.490     1.530     1.530 peak   239 spectrum    1 weight  0.11000E+01 volume  0.75614E-03 ppm1      1.618 ppm2      9.415 CV     1
 ASSI {  240}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HN  ))
      2.790     0.970     0.970 peak   240 spectrum    1 weight  0.11000E+01 volume  0.18437E-02 ppm1      2.019 ppm2      9.415 CV     1
 ASSI {  241}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 80   and name HN  ))
      3.140     1.230     1.230 peak   241 spectrum    1 weight  0.11000E+01 volume  0.11909E-02 ppm1      3.025 ppm2      9.416 CV     1
 ASSI {  243}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      2.430     0.740     0.740 peak   243 spectrum    1 weight  0.11000E+01 volume  0.50622E-02 ppm1      5.795 ppm2      9.417 CV     1
 ASSI {  244}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      2.480     0.770     0.770 peak   244 spectrum    1 weight  0.11000E+01 volume  0.40911E-02 ppm1      9.216 ppm2      8.296 CV     1
 ASSI {  245}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      3.030     1.150     1.150 peak   245 spectrum    1 weight  0.11000E+01 volume  0.14823E-02 ppm1      4.768 ppm2      9.414 CV     1
 ASSI {  246}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 36   and name HN  ))
      4.320     2.330     2.180 peak   246 spectrum    1 weight  0.11000E+01 volume  0.75281E-03 ppm1      7.006 ppm2      8.293 CV     1
 ASSI {  249}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      2.070     0.530     0.530 peak   249 spectrum    1 weight  0.11000E+01 volume  0.96664E-02 ppm1      3.324 ppm2      8.298 CV     1
 OR {  249}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  250}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
      2.640     0.870     0.870 peak   250 spectrum    1 weight  0.11000E+01 volume  0.35986E-02 ppm1      4.266 ppm2      8.622 CV     1
 ASSI {  251}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      2.960     1.090     1.090 peak   251 spectrum    1 weight  0.11000E+01 volume  0.17533E-02 ppm1      4.965 ppm2      8.626 CV     1
 ASSI {  252}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      2.910     1.060     1.060 peak   252 spectrum    1 weight  0.11000E+01 volume  0.20075E-02 ppm1      4.712 ppm2      8.047 CV     1
 ASSI {  253}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      3.440     1.480     1.480 peak   253 spectrum    1 weight  0.11000E+01 volume  0.15217E-02 ppm1      4.506 ppm2      8.048 CV     1
 ASSI {  255}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      2.770     0.960     0.960 peak   255 spectrum    1 weight  0.11000E+01 volume  0.24524E-02 ppm1      4.179 ppm2      8.147 CV     1
 ASSI {  257}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 33   and name HN  ))
      3.660     1.670     1.670 peak   257 spectrum    1 weight  0.11000E+01 volume  0.13379E-02 ppm1      6.770 ppm2      8.475 CV     1
 ASSI {  258}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      3.770     1.770     1.770 peak   258 spectrum    1 weight  0.11000E+01 volume  0.72281E-03 ppm1      7.411 ppm2      8.139 CV     1
 ASSI {  262}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 42   and name HN  ))
      2.930     1.080     1.080 peak   262 spectrum    1 weight  0.11000E+01 volume  0.25470E-02 ppm1      3.951 ppm2      8.142 CV     1
 OR {  262}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {  263}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HN  ))
      3.760     1.770     1.770 peak   263 spectrum    1 weight  0.11000E+01 volume  0.16822E-02 ppm1      3.407 ppm2      8.475 CV     1
 ASSI {  264}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      2.630     0.870     0.870 peak   264 spectrum    1 weight  0.11000E+01 volume  0.30382E-02 ppm1      2.583 ppm2      8.625 CV     1
 ASSI {  265}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.390     1.440     1.440 peak   265 spectrum    1 weight  0.11000E+01 volume  0.17429E-02 ppm1      2.934 ppm2      8.625 CV     1
 ASSI {  266}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      2.280     0.650     0.650 peak   266 spectrum    1 weight  0.11000E+01 volume  0.42810E-02 ppm1      3.003 ppm2      8.473 CV     1
 ASSI {  267}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 33   and name HN  ))
      2.310     0.670     0.670 peak   267 spectrum    1 weight  0.11000E+01 volume  0.48936E-02 ppm1      1.781 ppm2      8.473 CV     1
 ASSI {  268}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HN  ))
      2.410     0.730     0.730 peak   268 spectrum    1 weight  0.11000E+01 volume  0.49564E-02 ppm1      1.749 ppm2      8.143 CV     1
 ASSI {  269}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HN  ))
      2.980     1.110     1.110 peak   269 spectrum    1 weight  0.11000E+01 volume  0.43495E-02 ppm1      2.012 ppm2      8.050 CV     1
 ASSI {  272}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 33   and name HN  ))
      3.880     1.890     1.890 peak   272 spectrum    1 weight  0.11000E+01 volume  0.16962E-02 ppm1      0.878 ppm2      8.474 CV     1
 ASSI {  273}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 48   and name HN  ))
      3.790     1.800     1.800 peak   273 spectrum    1 weight  0.11000E+01 volume  0.15647E-02 ppm1      1.218 ppm2      8.625 CV     1
 ASSI {  274}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 33   and name HN  ))
      3.830     1.830     1.830 peak   274 spectrum    1 weight  0.11000E+01 volume  0.49559E-03 ppm1      0.564 ppm2      8.477 CV     1
 ASSI {  276}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 45   and name HN  ))
      2.460     0.750     0.750 peak   276 spectrum    1 weight  0.11000E+01 volume  0.67221E-02 ppm1      3.814 ppm2      8.046 CV     1
 ASSI {  277}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 45   and name HN  ))
      3.400     1.440     1.440 peak   277 spectrum    1 weight  0.11000E+01 volume  0.86875E-03 ppm1      3.969 ppm2      8.049 CV     1
 ASSI {  280}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      2.520     0.790     0.790 peak   280 spectrum    1 weight  0.11000E+01 volume  0.46050E-02 ppm1      4.633 ppm2      8.447 CV     1
 ASSI {  282}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HN  ))
      2.840     1.010     1.010 peak   282 spectrum    1 weight  0.11000E+01 volume  0.22966E-02 ppm1      4.553 ppm2      7.847 CV     1
 ASSI {  283}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 108  and name HN  ))
      3.660     1.670     1.670 peak   283 spectrum    1 weight  0.11000E+01 volume  0.74485E-03 ppm1      4.310 ppm2      7.844 CV     1
 ASSI {  284}
   (( segid "    " and resid 107  and name HA2 ))
   (( segid "    " and resid 108  and name HN  ))
      3.390     1.440     1.440 peak   284 spectrum    1 weight  0.11000E+01 volume  0.13863E-02 ppm1      3.963 ppm2      7.848 CV     1
 ASSI {  285}
   (( segid "    " and resid 107  and name HA1 ))
   (( segid "    " and resid 108  and name HN  ))
      3.090     1.190     1.190 peak   285 spectrum    1 weight  0.11000E+01 volume  0.14690E-02 ppm1      3.725 ppm2      7.845 CV     1
 ASSI {  286}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HN  ))
      2.810     0.980     0.980 peak   286 spectrum    1 weight  0.11000E+01 volume  0.44152E-02 ppm1      2.883 ppm2      7.845 CV     1
 ASSI {  287}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 108  and name HN  ))
      3.090     1.200     1.200 peak   287 spectrum    1 weight  0.11000E+01 volume  0.17186E-02 ppm1      3.096 ppm2      7.849 CV     1
 ASSI {  288}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HN  ))
      3.130     1.230     1.230 peak   288 spectrum    1 weight  0.11000E+01 volume  0.48408E-02 ppm1      1.412 ppm2      8.401 CV     1
 ASSI {  289}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 32   and name HN  ))
      2.230     0.620     0.620 peak   289 spectrum    1 weight  0.11000E+01 volume  0.78881E-02 ppm1      1.799 ppm2      7.439 CV     1
 ASSI {  290}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 32   and name HN  ))
      4.130     2.130     2.130 peak   290 spectrum    1 weight  0.11000E+01 volume  0.69424E-03 ppm1      1.571 ppm2      7.439 CV     1
 ASSI {  291}
   (( segid "    " and resid 31   and name HG1 ))
   (( segid "    " and resid 32   and name HN  ))
      4.740     2.810     1.760 peak   291 spectrum    1 weight  0.11000E+01 volume  0.46619E-03 ppm1      1.304 ppm2      7.442 CV     1
 ASSI {  292}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 32   and name HN  ))
      4.110     2.120     2.120 peak   292 spectrum    1 weight  0.11000E+01 volume  0.44756E-03 ppm1      1.224 ppm2      7.439 CV     1
 ASSI {  294}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 32   and name HN  ))
      4.160     2.170     2.170 peak   294 spectrum    1 weight  0.11000E+01 volume  0.51950E-03 ppm1      0.525 ppm2      7.439 CV     1
 ASSI {  296}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 45   and name HN  ))
      3.500     1.530     1.530 peak   296 spectrum    1 weight  0.11000E+01 volume  0.10271E-02 ppm1     -0.341 ppm2      8.044 CV     1
 ASSI {  297}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      2.130     0.570     0.570 peak   297 spectrum    1 weight  0.11000E+01 volume  0.75127E-02 ppm1      1.764 ppm2      8.404 CV     1
 ASSI {  298}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HN  ))
      3.320     1.380     1.380 peak   298 spectrum    1 weight  0.11000E+01 volume  0.15654E-02 ppm1      1.994 ppm2      8.452 CV     1
 ASSI {  299}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
      3.650     1.660     1.660 peak   299 spectrum    1 weight  0.11000E+01 volume  0.72507E-03 ppm1      3.646 ppm2      8.295 CV     1
 ASSI {  303}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      2.510     0.790     0.790 peak   303 spectrum    1 weight  0.11000E+01 volume  0.42607E-02 ppm1      8.477 ppm2      7.439 CV     1
 ASSI {  304}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      3.240     1.310     1.310 peak   304 spectrum    1 weight  0.11000E+01 volume  0.10859E-02 ppm1      8.613 ppm2      7.845 CV     1
 ASSI {  305}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      3.820     1.820     1.820 peak   305 spectrum    1 weight  0.11000E+01 volume  0.39627E-03 ppm1      9.139 ppm2      7.438 CV     1
 ASSI {  306}
   (  segid "    " and resid 108  and name HD% )
   (( segid "    " and resid 108  and name HN  ))
      3.200     1.280     1.280 peak   306 spectrum    1 weight  0.11000E+01 volume  0.15509E-02 ppm1      7.163 ppm2      7.847 CV     1
 ASSI {  307}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      3.370     1.420     1.420 peak   307 spectrum    1 weight  0.11000E+01 volume  0.14423E-02 ppm1      2.557 ppm2      8.313 CV     1
 ASSI {  308}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      2.660     0.880     0.880 peak   308 spectrum    1 weight  0.11000E+01 volume  0.39266E-02 ppm1      4.122 ppm2      8.316 CV     1
 ASSI {  309}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      2.650     0.880     0.880 peak   309 spectrum    1 weight  0.11000E+01 volume  0.28546E-02 ppm1      7.018 ppm2      8.316 CV     1
 ASSI {  310}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 5    and name HN  ))
      3.920     1.920     1.920 peak   310 spectrum    1 weight  0.11000E+01 volume  0.89632E-03 ppm1      2.400 ppm2      8.038 CV     1
 ASSI {  311}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HN  ))
      2.440     0.740     0.740 peak   311 spectrum    1 weight  0.11000E+01 volume  0.77229E-02 ppm1      2.032 ppm2      8.040 CV     1
 ASSI {  312}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
      3.840     1.840     1.840 peak   312 spectrum    1 weight  0.11000E+01 volume  0.68058E-03 ppm1      2.807 ppm2      8.314 CV     1
 ASSI {  313}
   (( segid "    " and resid 68   and name HA1 ))
   (( segid "    " and resid 69   and name HN  ))
      3.340     1.390     1.390 peak   313 spectrum    1 weight  0.11000E+01 volume  0.10682E-02 ppm1      3.955 ppm2      8.199 CV     1
 OR {  313}
   (( segid "    " and resid 68   and name HA2 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  315}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
      2.900     1.050     1.050 peak   315 spectrum    1 weight  0.11000E+01 volume  0.19677E-02 ppm1      4.860 ppm2      8.039 CV     1
 ASSI {  318}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.130     1.220     1.220 peak   318 spectrum    1 weight  0.11000E+01 volume  0.12902E-02 ppm1      3.675 ppm2      7.495 CV     1
 ASSI {  319}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.610     0.850     0.850 peak   319 spectrum    1 weight  0.11000E+01 volume  0.35539E-02 ppm1      4.064 ppm2      7.495 CV     1
 ASSI {  320}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      2.340     0.690     0.690 peak   320 spectrum    1 weight  0.11000E+01 volume  0.42159E-02 ppm1      6.628 ppm2      8.036 CV     1
 ASSI {  322}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      2.410     0.730     0.730 peak   322 spectrum    1 weight  0.11000E+01 volume  0.42596E-02 ppm1      8.285 ppm2      7.494 CV     1
 ASSI {  323}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      2.460     0.750     0.750 peak   323 spectrum    1 weight  0.11000E+01 volume  0.42514E-02 ppm1      9.172 ppm2      7.495 CV     1
 ASSI {  325}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HN  ))
      3.100     1.200     1.200 peak   325 spectrum    1 weight  0.11000E+01 volume  0.12994E-02 ppm1      1.533 ppm2      8.035 CV     1
 OR {  325}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI {  326}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 97   and name HN  ))
      3.170     1.260     1.260 peak   326 spectrum    1 weight  0.11000E+01 volume  0.58297E-03 ppm1      1.146 ppm2      8.034 CV     1
 ASSI {  327}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      2.600     0.850     0.850 peak   327 spectrum    1 weight  0.11000E+01 volume  0.23879E-02 ppm1      1.653 ppm2      7.496 CV     1
 ASSI {  328}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HN  ))
      3.760     1.760     1.760 peak   328 spectrum    1 weight  0.11000E+01 volume  0.20539E-02 ppm1      2.449 ppm2      7.495 CV     1
 ASSI {  329}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 35   and name HN  ))
      5.230     3.420     1.270 peak   329 spectrum    1 weight  0.11000E+01 volume  0.19954E-03 ppm1      0.537 ppm2      7.497 CV     1
 ASSI {  330}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 51   and name HN  ))
      2.280     0.650     0.650 peak   330 spectrum    1 weight  0.11000E+01 volume  0.87060E-02 ppm1      1.515 ppm2      8.315 CV     1
 ASSI {  331}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      4.440     2.460     2.060 peak   331 spectrum    1 weight  0.11000E+01 volume  0.47626E-03 ppm1      3.315 ppm2      7.495 CV     1
 ASSI {  332}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      4.610     2.650     1.890 peak   332 spectrum    1 weight  0.11000E+01 volume  0.28067E-03 ppm1      2.951 ppm2      7.494 CV     1
 ASSI {  333}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      2.910     1.060     1.060 peak   333 spectrum    1 weight  0.11000E+01 volume  0.18418E-02 ppm1      5.614 ppm2      8.431 CV     1
 ASSI {  334}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 18   and name HN  ))
      2.570     0.820     0.820 peak   334 spectrum    1 weight  0.11000E+01 volume  0.67945E-02 ppm1      4.154 ppm2      8.430 CV     1
 ASSI {  335}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 18   and name HN  ))
      2.340     0.680     0.680 peak   335 spectrum    1 weight  0.11000E+01 volume  0.65878E-02 ppm1      4.313 ppm2      8.429 CV     1
 ASSI {  336}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      3.090     1.190     1.190 peak   336 spectrum    1 weight  0.11000E+01 volume  0.13581E-02 ppm1      1.962 ppm2      8.435 CV     1
 ASSI {  337}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HN  ))
      3.540     1.570     1.570 peak   337 spectrum    1 weight  0.11000E+01 volume  0.14902E-02 ppm1      2.126 ppm2      8.429 CV     1
 ASSI {  338}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 18   and name HN  ))
      3.660     1.680     1.680 peak   338 spectrum    1 weight  0.11000E+01 volume  0.61245E-03 ppm1      0.764 ppm2      8.429 CV     1
 ASSI {  339}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.060     1.170     1.170 peak   339 spectrum    1 weight  0.11000E+01 volume  0.15035E-02 ppm1      5.802 ppm2      7.817 CV     1
 ASSI {  340}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HN  ))
      2.920     1.070     1.070 peak   340 spectrum    1 weight  0.11000E+01 volume  0.18177E-02 ppm1      7.045 ppm2      7.815 CV     1
 ASSI {  341}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.270     1.340     1.340 peak   341 spectrum    1 weight  0.11000E+01 volume  0.97722E-03 ppm1      9.014 ppm2      7.819 CV     1
 ASSI {  342}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      4.380     2.400     2.120 peak   342 spectrum    1 weight  0.11000E+01 volume  0.50918E-03 ppm1      9.404 ppm2      7.819 CV     1
 ASSI {  344}
   (( segid "    " and resid 78   and name HA2 ))
   (( segid "    " and resid 79   and name HN  ))
      3.710     1.720     1.720 peak   344 spectrum    1 weight  0.11000E+01 volume  0.79011E-03 ppm1      4.267 ppm2      7.820 CV     1
 ASSI {  346}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      2.490     0.780     0.780 peak   346 spectrum    1 weight  0.11000E+01 volume  0.31316E-02 ppm1      3.311 ppm2      7.817 CV     1
 ASSI {  347}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HN  ))
      3.720     1.730     1.730 peak   347 spectrum    1 weight  0.11000E+01 volume  0.17588E-02 ppm1      3.025 ppm2      7.816 CV     1
 ASSI {  348}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      4.150     2.160     2.160 peak   348 spectrum    1 weight  0.11000E+01 volume  0.42148E-03 ppm1      1.798 ppm2      7.815 CV     1
 ASSI {  349}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 79   and name HN  ))
      4.130     2.130     2.130 peak   349 spectrum    1 weight  0.11000E+01 volume  0.36976E-03 ppm1      1.403 ppm2      7.813 CV     1
 ASSI {  353}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      3.500     1.530     1.530 peak   353 spectrum    1 weight  0.11000E+01 volume  0.92916E-03 ppm1      4.358 ppm2      9.274 CV     1
 ASSI {  354}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      3.350     1.400     1.400 peak   354 spectrum    1 weight  0.11000E+01 volume  0.84250E-03 ppm1      4.884 ppm2      9.268 CV     1
 ASSI {  355}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      2.450     0.750     0.750 peak   355 spectrum    1 weight  0.11000E+01 volume  0.47010E-02 ppm1      5.296 ppm2      9.270 CV     1
 ASSI {  356}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 100  and name HN  ))
      3.640     1.660     1.660 peak   356 spectrum    1 weight  0.11000E+01 volume  0.50783E-03 ppm1      6.764 ppm2      9.272 CV     1
 ASSI {  358}
   (( segid "    " and resid 95   and name HD22))
   (( segid "    " and resid 95   and name HD21))
      1.910     0.460     0.460 peak   358 spectrum    1 weight  0.11000E+01 volume  0.72917E-02 ppm1      7.717 ppm2      8.057 CV     1
 ASSI {  360}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
      2.270     0.640     0.640 peak   360 spectrum    1 weight  0.11000E+01 volume  0.86388E-02 ppm1      2.957 ppm2      8.273 CV     1
 ASSI {  364}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      3.280     1.340     1.340 peak   364 spectrum    1 weight  0.11000E+01 volume  0.13833E-02 ppm1      4.084 ppm2      8.274 CV     1
 ASSI {  366}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      2.510     0.780     0.780 peak   366 spectrum    1 weight  0.11000E+01 volume  0.35675E-02 ppm1      9.199 ppm2      8.273 CV     1
 ASSI {  368}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 95   and name HD22))
      4.070     2.080     2.080 peak   368 spectrum    1 weight  0.11000E+01 volume  0.68468E-03 ppm1      4.299 ppm2      7.718 CV     1
 ASSI {  370}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      3.810     1.810     1.810 peak   370 spectrum    1 weight  0.11000E+01 volume  0.50315E-03 ppm1      4.274 ppm2      8.280 CV     1
 ASSI {  371}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 100  and name HN  ))
      4.200     2.210     2.210 peak   371 spectrum    1 weight  0.11000E+01 volume  0.43865E-03 ppm1      3.157 ppm2      9.274 CV     1
 ASSI {  372}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 95   and name HD21))
      4.370     2.390     2.130 peak   372 spectrum    1 weight  0.11000E+01 volume  0.46348E-03 ppm1      4.287 ppm2      8.057 CV     1
 ASSI {  374}
   (( segid "    " and resid 84   and name HB  ))
   (( segid "    " and resid 86   and name HN  ))
      4.160     2.160     2.160 peak   374 spectrum    1 weight  0.11000E+01 volume  0.66116E-03 ppm1      4.978 ppm2      7.759 CV     1
 OR {  374}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
 ASSI {  375}
   (( segid "    " and resid 86   and name HG1 ))
   (( segid "    " and resid 86   and name HN  ))
      3.210     1.290     1.290 peak   375 spectrum    1 weight  0.11000E+01 volume  0.12433E-02 ppm1      2.307 ppm2      7.753 CV     1
 ASSI {  376}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HN  ))
      3.970     1.970     1.970 peak   376 spectrum    1 weight  0.11000E+01 volume  0.69323E-03 ppm1      1.918 ppm2      7.761 CV     1
 ASSI {  377}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 86   and name HN  ))
      5.390     3.630     1.110 peak   377 spectrum    1 weight  0.11000E+01 volume  0.20098E-03 ppm1      1.485 ppm2      7.759 CV     1
 ASSI {  379}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      4.710     2.770     1.790 peak   379 spectrum    1 weight  0.11000E+01 volume  0.31027E-03 ppm1     10.313 ppm2      9.126 CV     1
 ASSI {  380}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 56   and name HN  ))
      3.710     1.720     1.720 peak   380 spectrum    1 weight  0.11000E+01 volume  0.66258E-03 ppm1      7.614 ppm2      9.122 CV     1
 ASSI {  381}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.240     0.630     0.630 peak   381 spectrum    1 weight  0.11000E+01 volume  0.80906E-02 ppm1      5.634 ppm2      9.126 CV     1
 ASSI {  382}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      3.090     1.190     1.190 peak   382 spectrum    1 weight  0.11000E+01 volume  0.11817E-02 ppm1      5.231 ppm2      9.128 CV     1
 ASSI {  383}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      3.560     1.590     1.590 peak   383 spectrum    1 weight  0.11000E+01 volume  0.91461E-03 ppm1      5.005 ppm2      9.123 CV     1
 ASSI {  384}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      4.000     2.000     2.000 peak   384 spectrum    1 weight  0.11000E+01 volume  0.72163E-03 ppm1      5.435 ppm2      9.131 CV     1
 ASSI {  386}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.660     1.670     1.670 peak   386 spectrum    1 weight  0.11000E+01 volume  0.18411E-02 ppm1      3.207 ppm2      9.126 CV     1
 ASSI {  388}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 56   and name HN  ))
      4.630     2.680     1.870 peak   388 spectrum    1 weight  0.11000E+01 volume  0.31405E-03 ppm1      1.202 ppm2      9.126 CV     1
 ASSI {  389}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 56   and name HN  ))
      4.270     2.280     2.230 peak   389 spectrum    1 weight  0.11000E+01 volume  0.28954E-03 ppm1      0.581 ppm2      9.121 CV     1
 ASSI {  390}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 28   and name HN  ))
      4.730     2.800     1.770 peak   390 spectrum    1 weight  0.11000E+01 volume  0.39770E-03 ppm1      0.480 ppm2      8.371 CV     1
 ASSI {  391}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 28   and name HN  ))
      2.620     0.860     0.860 peak   391 spectrum    1 weight  0.11000E+01 volume  0.41996E-02 ppm1      1.303 ppm2      8.369 CV     1
 ASSI {  392}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      2.910     1.060     1.060 peak   392 spectrum    1 weight  0.11000E+01 volume  0.19836E-02 ppm1      3.722 ppm2      8.368 CV     1
 ASSI {  393}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 28   and name HN  ))
      2.580     0.830     0.830 peak   393 spectrum    1 weight  0.11000E+01 volume  0.37301E-02 ppm1      3.986 ppm2      8.369 CV     1
 ASSI {  394}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      2.590     0.840     0.840 peak   394 spectrum    1 weight  0.11000E+01 volume  0.33692E-02 ppm1      6.961 ppm2      8.369 CV     1
 ASSI {  395}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      3.890     1.900     1.900 peak   395 spectrum    1 weight  0.11000E+01 volume  0.53656E-03 ppm1      7.287 ppm2      8.370 CV     1
 ASSI {  396}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      2.690     0.910     0.910 peak   396 spectrum    1 weight  0.11000E+01 volume  0.25433E-02 ppm1      7.954 ppm2      7.068 CV     1
 ASSI {  397}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      2.520     0.790     0.790 peak   397 spectrum    1 weight  0.11000E+01 volume  0.34725E-02 ppm1      7.449 ppm2      7.070 CV     1
 ASSI {  398}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.810     1.810     1.810 peak   398 spectrum    1 weight  0.11000E+01 volume  0.59891E-03 ppm1      3.975 ppm2      7.069 CV     1
 ASSI {  399}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      2.430     0.740     0.740 peak   399 spectrum    1 weight  0.11000E+01 volume  0.47744E-02 ppm1      3.734 ppm2      7.070 CV     1
 ASSI {  400}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.530     1.560     1.560 peak   400 spectrum    1 weight  0.11000E+01 volume  0.78263E-03 ppm1      2.776 ppm2      7.069 CV     1
 ASSI {  401}
   (( segid "    " and resid 31   and name HG1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.930     1.930     1.930 peak   401 spectrum    1 weight  0.11000E+01 volume  0.11527E-02 ppm1      1.323 ppm2      7.070 CV     1
 ASSI {  402}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HN  ))
      2.290     0.650     0.650 peak   402 spectrum    1 weight  0.11000E+01 volume  0.37239E-02 ppm1      1.552 ppm2      7.070 CV     1
 ASSI {  403}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
      1.950     0.480     0.480 peak   403 spectrum    1 weight  0.11000E+01 volume  0.10730E-01 ppm1      1.840 ppm2      7.069 CV     1
 ASSI {  404}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 31   and name HN  ))
      4.670     2.720     1.830 peak   404 spectrum    1 weight  0.11000E+01 volume  0.32850E-03 ppm1      0.494 ppm2      7.071 CV     1
 ASSI {  405}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 31   and name HN  ))
      4.430     2.450     2.070 peak   405 spectrum    1 weight  0.11000E+01 volume  0.59772E-03 ppm1      0.931 ppm2      7.070 CV     1
 ASSI {  406}
   (( segid "    " and resid 34   and name HD1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.650     1.660     1.660 peak   406 spectrum    1 weight  0.11000E+01 volume  0.25153E-03 ppm1      1.150 ppm2      7.067 CV     1
 ASSI {  407}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      3.310     1.370     1.370 peak   407 spectrum    1 weight  0.11000E+01 volume  0.10659E-02 ppm1      3.973 ppm2      7.962 CV     1
 ASSI {  408}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.720     0.930     0.930 peak   408 spectrum    1 weight  0.11000E+01 volume  0.27915E-02 ppm1      2.775 ppm2      7.964 CV     1
 ASSI {  410}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HN  ))
      2.240     0.630     0.630 peak   410 spectrum    1 weight  0.11000E+01 volume  0.50974E-02 ppm1      1.965 ppm2      7.964 CV     1
 ASSI {  411}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
      2.950     1.090     1.090 peak   411 spectrum    1 weight  0.11000E+01 volume  0.43562E-02 ppm1      1.822 ppm2      7.965 CV     1
 ASSI {  412}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 30   and name HN  ))
      3.970     1.970     1.970 peak   412 spectrum    1 weight  0.11000E+01 volume  0.79100E-03 ppm1      1.301 ppm2      7.962 CV     1
 ASSI {  413}
   (( segid "    " and resid 30   and name HG1 ))
   (( segid "    " and resid 30   and name HN  ))
      3.470     1.500     1.500 peak   413 spectrum    1 weight  0.11000E+01 volume  0.22378E-02 ppm1      1.574 ppm2      7.965 CV     1
 ASSI {  415}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 91   and name HN  ))
      2.940     1.080     1.080 peak   415 spectrum    1 weight  0.11000E+01 volume  0.19107E-02 ppm1      6.971 ppm2      9.098 CV     1
 ASSI {  416}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 91   and name HN  ))
      3.110     1.210     1.210 peak   416 spectrum    1 weight  0.11000E+01 volume  0.15575E-02 ppm1      6.772 ppm2      9.097 CV     1
 ASSI {  419}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      3.230     1.310     1.310 peak   419 spectrum    1 weight  0.11000E+01 volume  0.10118E-02 ppm1      5.315 ppm2      9.099 CV     1
 ASSI {  420}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      3.790     1.790     1.790 peak   420 spectrum    1 weight  0.11000E+01 volume  0.85462E-03 ppm1      4.326 ppm2      8.758 CV     1
 ASSI {  421}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.850     1.010     1.010 peak   421 spectrum    1 weight  0.11000E+01 volume  0.21795E-02 ppm1      4.724 ppm2      8.759 CV     1
 ASSI {  422}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.100     0.550     0.550 peak   422 spectrum    1 weight  0.11000E+01 volume  0.11782E-01 ppm1      5.608 ppm2      8.758 CV     1
 ASSI {  423}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 19   and name HN  ))
      3.590     1.610     1.610 peak   423 spectrum    1 weight  0.11000E+01 volume  0.72863E-03 ppm1      3.858 ppm2      8.759 CV     1
 ASSI {  425}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 91   and name HN  ))
      2.910     1.060     1.060 peak   425 spectrum    1 weight  0.11000E+01 volume  0.14781E-02 ppm1      2.558 ppm2      9.094 CV     1
 ASSI {  426}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HN  ))
      3.680     1.690     1.690 peak   426 spectrum    1 weight  0.11000E+01 volume  0.24924E-02 ppm1      2.306 ppm2      9.100 CV     1
 ASSI {  427}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 91   and name HN  ))
      3.770     1.770     1.770 peak   427 spectrum    1 weight  0.11000E+01 volume  0.63681E-03 ppm1      1.537 ppm2      9.101 CV     1
 ASSI {  428}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      2.950     1.090     1.090 peak   428 spectrum    1 weight  0.11000E+01 volume  0.14421E-02 ppm1      2.085 ppm2      8.759 CV     1
 ASSI {  429}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.180     1.270     1.270 peak   429 spectrum    1 weight  0.11000E+01 volume  0.19265E-02 ppm1      1.958 ppm2      8.760 CV     1
 ASSI {  430}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.520     1.550     1.550 peak   430 spectrum    1 weight  0.11000E+01 volume  0.22490E-02 ppm1      0.770 ppm2      8.758 CV     1
 ASSI {  431}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 91   and name HN  ))
      4.300     2.310     2.200 peak   431 spectrum    1 weight  0.11000E+01 volume  0.34877E-03 ppm1      1.080 ppm2      9.101 CV     1
 ASSI {  432}
   (( segid "    " and resid 9    and name HG12))
   (( segid "    " and resid 19   and name HN  ))
      4.240     2.240     2.240 peak   432 spectrum    1 weight  0.11000E+01 volume  0.45823E-03 ppm1      1.437 ppm2      8.760 CV     1
 ASSI {  433}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 19   and name HN  ))
      3.900     1.910     1.910 peak   433 spectrum    1 weight  0.11000E+01 volume  0.41569E-03 ppm1      1.219 ppm2      8.762 CV     1
 ASSI {  435}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.530     1.560     1.560 peak   435 spectrum    1 weight  0.11000E+01 volume  0.50788E-03 ppm1     -1.126 ppm2      8.760 CV     1
 ASSI {  436}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
      2.600     0.840     0.840 peak   436 spectrum    1 weight  0.11000E+01 volume  0.33945E-02 ppm1      0.882 ppm2      8.472 CV     1
 ASSI {  438}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 24   and name HN  ))
      3.190     1.270     1.270 peak   438 spectrum    1 weight  0.11000E+01 volume  0.21475E-02 ppm1      2.076 ppm2      8.473 CV     1
 ASSI {  441}
   (( segid "    " and resid 95   and name HD21))
   (( segid "    " and resid 95   and name HN  ))
      2.320     0.670     0.670 peak   441 spectrum    1 weight  0.11000E+01 volume  0.33338E-02 ppm1      8.046 ppm2      8.340 CV     1
 ASSI {  442}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      2.580     0.830     0.830 peak   442 spectrum    1 weight  0.11000E+01 volume  0.30527E-02 ppm1      8.830 ppm2      8.340 CV     1
 ASSI {  445}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HN  ))
      2.850     1.020     1.020 peak   445 spectrum    1 weight  0.11000E+01 volume  0.18866E-02 ppm1      6.677 ppm2      7.423 CV     1
 ASSI {  446}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      2.430     0.740     0.740 peak   446 spectrum    1 weight  0.11000E+01 volume  0.41728E-02 ppm1      6.616 ppm2      8.340 CV     1
 ASSI {  447}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      2.910     1.050     1.050 peak   447 spectrum    1 weight  0.11000E+01 volume  0.21250E-02 ppm1      4.613 ppm2      7.425 CV     1
 ASSI {  449}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      2.750     0.950     0.950 peak   449 spectrum    1 weight  0.11000E+01 volume  0.26254E-02 ppm1      4.444 ppm2      8.340 CV     1
 ASSI {  450}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      3.080     1.190     1.190 peak   450 spectrum    1 weight  0.11000E+01 volume  0.13839E-02 ppm1      4.233 ppm2      8.338 CV     1
 ASSI {  451}
   (( segid "    " and resid 99   and name HB  ))
   (( segid "    " and resid 99   and name HN  ))
      3.250     1.320     1.320 peak   451 spectrum    1 weight  0.11000E+01 volume  0.19468E-02 ppm1      3.954 ppm2      8.331 CV     1
 ASSI {  452}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      3.340     1.400     1.400 peak   452 spectrum    1 weight  0.11000E+01 volume  0.11538E-02 ppm1      4.390 ppm2      7.421 CV     1
 ASSI {  453}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      3.220     1.290     1.290 peak   453 spectrum    1 weight  0.11000E+01 volume  0.10695E-02 ppm1      3.881 ppm2      7.421 CV     1
 ASSI {  454}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      3.510     1.540     1.540 peak   454 spectrum    1 weight  0.11000E+01 volume  0.94259E-03 ppm1      3.693 ppm2      8.337 CV     1
 ASSI {  455}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 95   and name HN  ))
      3.210     1.290     1.290 peak   455 spectrum    1 weight  0.11000E+01 volume  0.37482E-02 ppm1      3.271 ppm2      8.339 CV     1
 ASSI {  456}
   (( segid "    " and resid 95   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      2.880     1.030     1.030 peak   456 spectrum    1 weight  0.11000E+01 volume  0.16782E-02 ppm1      2.709 ppm2      8.339 CV     1
 ASSI {  457}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      3.010     1.130     1.130 peak   457 spectrum    1 weight  0.11000E+01 volume  0.40747E-02 ppm1      2.136 ppm2      7.424 CV     1
 ASSI {  458}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 99   and name HN  ))
      3.170     1.250     1.250 peak   458 spectrum    1 weight  0.11000E+01 volume  0.18314E-02 ppm1      1.138 ppm2      8.335 CV     1
 ASSI {  460}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HD22))
      1.900     0.450     0.450 peak   460 spectrum    1 weight  0.11000E+01 volume  0.11805E-01 ppm1      6.668 ppm2      6.293 CV     1
 ASSI {  461}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      2.110     0.560     0.560 peak   461 spectrum    1 weight  0.11000E+01 volume  0.11384E-01 ppm1      5.400 ppm2      9.323 CV     1
 ASSI {  462}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 47   and name HN  ))
      3.280     1.350     1.350 peak   462 spectrum    1 weight  0.11000E+01 volume  0.14111E-02 ppm1      3.355 ppm2      9.320 CV     1
 ASSI {  463}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 47   and name HN  ))
      4.110     2.110     2.110 peak   463 spectrum    1 weight  0.11000E+01 volume  0.10745E-02 ppm1      3.197 ppm2      9.322 CV     1
 ASSI {  464}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      3.470     1.510     1.510 peak   464 spectrum    1 weight  0.11000E+01 volume  0.99800E-03 ppm1      4.498 ppm2      9.319 CV     1
 ASSI {  465}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 21   and name HN  ))
      2.530     0.800     0.800 peak   465 spectrum    1 weight  0.11000E+01 volume  0.40161E-02 ppm1      4.334 ppm2      8.995 CV     1
 ASSI {  468}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
      3.110     1.210     1.210 peak   468 spectrum    1 weight  0.11000E+01 volume  0.16981E-02 ppm1      1.211 ppm2      9.320 CV     1
 ASSI {  469}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 21   and name HN  ))
      4.200     2.210     2.210 peak   469 spectrum    1 weight  0.11000E+01 volume  0.91520E-03 ppm1      1.201 ppm2      8.995 CV     1
 ASSI {  470}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      2.940     1.080     1.080 peak   470 spectrum    1 weight  0.11000E+01 volume  0.19476E-02 ppm1      4.656 ppm2      7.295 CV     1
 ASSI {  471}
   (( segid "    " and resid 28   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      2.710     0.920     0.920 peak   471 spectrum    1 weight  0.11000E+01 volume  0.28625E-02 ppm1      4.024 ppm2      7.293 CV     1
 ASSI {  472}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HN  ))
      3.260     1.330     1.330 peak   472 spectrum    1 weight  0.11000E+01 volume  0.11873E-02 ppm1      3.030 ppm2      7.294 CV     1
 OR {  472}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  475}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      3.720     1.730     1.730 peak   475 spectrum    1 weight  0.11000E+01 volume  0.84707E-03 ppm1      2.081 ppm2      7.293 CV     1
 ASSI {  476}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
      2.560     0.820     0.820 peak   476 spectrum    1 weight  0.11000E+01 volume  0.45221E-02 ppm1      1.300 ppm2      7.294 CV     1
 ASSI {  477}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HD22))
      3.930     1.940     1.940 peak   477 spectrum    1 weight  0.11000E+01 volume  0.11084E-02 ppm1      2.139 ppm2      6.292 CV     1
 ASSI {  478}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HD22))
      4.150     2.150     2.150 peak   478 spectrum    1 weight  0.11000E+01 volume  0.82462E-03 ppm1      2.705 ppm2      6.294 CV     1
 ASSI {  480}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      2.780     0.970     0.970 peak   480 spectrum    1 weight  0.11000E+01 volume  0.23855E-02 ppm1      9.107 ppm2      9.321 CV     1
 ASSI {  481}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      2.880     1.030     1.030 peak   481 spectrum    1 weight  0.11000E+01 volume  0.17243E-02 ppm1      9.220 ppm2      8.998 CV     1
 ASSI {  482}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      3.900     1.910     1.910 peak   482 spectrum    1 weight  0.11000E+01 volume  0.76219E-03 ppm1      5.220 ppm2      8.997 CV     1
 ASSI {  484}
   (  segid "    " and resid 90   and name HD% )
   (( segid "    " and resid 84   and name HN  ))
      3.440     1.480     1.480 peak   484 spectrum    1 weight  0.11000E+01 volume  0.10213E-02 ppm1      6.773 ppm2      9.610 CV     1
 ASSI {  488}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HN  ))
      3.030     1.150     1.150 peak   488 spectrum    1 weight  0.11000E+01 volume  0.10840E-02 ppm1      2.783 ppm2      9.611 CV     1
 ASSI {  489}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 83   and name HN  ))
      2.900     1.050     1.050 peak   489 spectrum    1 weight  0.11000E+01 volume  0.17296E-02 ppm1     -0.093 ppm2      8.018 CV     1
 ASSI {  490}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
      2.930     1.070     1.070 peak   490 spectrum    1 weight  0.11000E+01 volume  0.35980E-02 ppm1      1.344 ppm2      8.014 CV     1
 ASSI {  491}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
      2.720     0.920     0.920 peak   491 spectrum    1 weight  0.11000E+01 volume  0.21759E-02 ppm1      2.657 ppm2      8.014 CV     1
 ASSI {  492}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HN  ))
      3.950     1.950     1.950 peak   492 spectrum    1 weight  0.11000E+01 volume  0.12777E-02 ppm1      2.807 ppm2      8.014 CV     1
 ASSI {  493}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      2.380     0.710     0.710 peak   493 spectrum    1 weight  0.11000E+01 volume  0.59636E-02 ppm1      4.310 ppm2      8.015 CV     1
 ASSI {  495}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HN  ))
      3.000     1.130     1.130 peak   495 spectrum    1 weight  0.11000E+01 volume  0.16158E-02 ppm1      6.854 ppm2      8.014 CV     1
 ASSI {  496}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 40   and name HD21))
      3.540     1.570     1.570 peak   496 spectrum    1 weight  0.11000E+01 volume  0.71711E-03 ppm1      6.986 ppm2      6.673 CV     1
 ASSI {  497}
   (  segid "    " and resid 36   and name HD% )
   (( segid "    " and resid 40   and name HD22))
      3.630     1.650     1.650 peak   497 spectrum    1 weight  0.11000E+01 volume  0.55699E-03 ppm1      6.975 ppm2      6.293 CV     1
 ASSI {  499}
   (  segid "    " and resid 90   and name HE% )
   (( segid "    " and resid 84   and name HN  ))
      3.660     1.680     1.680 peak   499 spectrum    1 weight  0.11000E+01 volume  0.60503E-03 ppm1      6.277 ppm2      9.611 CV     1
 ASSI {  500}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      2.560     0.820     0.820 peak   500 spectrum    1 weight  0.11000E+01 volume  0.40199E-02 ppm1      4.558 ppm2      8.832 CV     1
 ASSI {  502}
   (( segid "    " and resid 60   and name HA1 ))
   (( segid "    " and resid 60   and name HN  ))
      2.890     1.040     1.040 peak   502 spectrum    1 weight  0.11000E+01 volume  0.21948E-02 ppm1      4.050 ppm2      8.832 CV     1
 ASSI {  505}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.100     2.110     2.110 peak   505 spectrum    1 weight  0.11000E+01 volume  0.79950E-03 ppm1      2.459 ppm2      8.832 CV     1
 OR {  505}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  507}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      3.940     1.940     1.940 peak   507 spectrum    1 weight  0.11000E+01 volume  0.38610E-03 ppm1      2.185 ppm2      8.832 CV     1
 ASSI {  508}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      4.710     2.780     1.790 peak   508 spectrum    1 weight  0.11000E+01 volume  0.30625E-03 ppm1      2.084 ppm2      8.828 CV     1
 ASSI {  510}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 60   and name HN  ))
      4.030     2.030     2.030 peak   510 spectrum    1 weight  0.11000E+01 volume  0.46864E-03 ppm1      3.804 ppm2      8.832 CV     1
 ASSI {  511}
   (( segid "    " and resid 5    and name HE22))
   (( segid "    " and resid 5    and name HE21))
      1.840     0.420     0.420 peak   511 spectrum    1 weight  0.11000E+01 volume  0.16299E-01 ppm1      6.922 ppm2      7.804 CV     1
 ASSI {  513}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 38   and name HD22))
      1.760     0.390     0.440 peak   513 spectrum    1 weight  0.11000E+01 volume  0.22874E-01 ppm1      7.637 ppm2      6.992 CV     1
 ASSI {  515}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HE21))
      3.190     1.270     1.270 peak   515 spectrum    1 weight  0.11000E+01 volume  0.10830E-02 ppm1      2.391 ppm2      7.804 CV     1
 ASSI {  517}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HE22))
      4.600     2.650     1.900 peak   517 spectrum    1 weight  0.11000E+01 volume  0.36506E-03 ppm1      2.383 ppm2      6.919 CV     1
 ASSI {  518}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HE22))
      5.160     3.330     1.340 peak   518 spectrum    1 weight  0.11000E+01 volume  0.18615E-03 ppm1      2.194 ppm2      6.918 CV     1
 ASSI {  519}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HE22))
      4.830     2.910     1.670 peak   519 spectrum    1 weight  0.11000E+01 volume  0.23797E-03 ppm1      2.057 ppm2      6.921 CV     1
 ASSI {  520}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 5    and name HE22))
      3.450     1.490     1.490 peak   520 spectrum    1 weight  0.11000E+01 volume  0.35423E-03 ppm1      1.196 ppm2      6.924 CV     1
 ASSI {  521}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 5    and name HE21))
      3.400     1.450     1.450 peak   521 spectrum    1 weight  0.11000E+01 volume  0.38390E-03 ppm1      1.210 ppm2      7.805 CV     1
 ASSI {  522}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.910     1.060     1.060 peak   522 spectrum    1 weight  0.11000E+01 volume  0.16837E-02 ppm1      5.810 ppm2      8.059 CV     1
 ASSI {  523}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.330     0.680     0.680 peak   523 spectrum    1 weight  0.11000E+01 volume  0.74182E-02 ppm1      4.740 ppm2      8.060 CV     1
 ASSI {  524}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 20   and name HN  ))
      3.790     1.800     1.800 peak   524 spectrum    1 weight  0.11000E+01 volume  0.71771E-03 ppm1      4.325 ppm2      8.061 CV     1
 ASSI {  525}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 20   and name HN  ))
      3.720     1.730     1.730 peak   525 spectrum    1 weight  0.11000E+01 volume  0.12688E-02 ppm1      3.865 ppm2      8.060 CV     1
 ASSI {  526}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 20   and name HN  ))
      3.060     1.170     1.170 peak   526 spectrum    1 weight  0.11000E+01 volume  0.17232E-02 ppm1      1.200 ppm2      8.059 CV     1
 ASSI {  527}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 20   and name HN  ))
      3.120     1.210     1.210 peak   527 spectrum    1 weight  0.11000E+01 volume  0.18707E-02 ppm1      0.373 ppm2      8.058 CV     1
 ASSI {  529}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 11   and name HD21))
      3.890     1.890     1.890 peak   529 spectrum    1 weight  0.11000E+01 volume  0.51501E-03 ppm1      0.814 ppm2      7.158 CV     1
 ASSI {  531}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 11   and name HD22))
      3.450     1.490     1.490 peak   531 spectrum    1 weight  0.11000E+01 volume  0.77906E-03 ppm1      0.969 ppm2      6.818 CV     1
 ASSI {  532}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 11   and name HD22))
      4.390     2.410     2.110 peak   532 spectrum    1 weight  0.11000E+01 volume  0.58184E-03 ppm1      1.172 ppm2      6.821 CV     1
 ASSI {  534}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HD22))
      4.820     2.900     1.680 peak   534 spectrum    1 weight  0.11000E+01 volume  0.37012E-03 ppm1      2.556 ppm2      6.821 CV     1
 ASSI {  535}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HD22))
      4.800     2.880     1.700 peak   535 spectrum    1 weight  0.11000E+01 volume  0.38157E-03 ppm1      2.988 ppm2      6.818 CV     1
 ASSI {  538}
   (( segid "    " and resid 11   and name HD21))
   (( segid "    " and resid 11   and name HD22))
      1.720     0.370     0.480 peak   538 spectrum    1 weight  0.11000E+01 volume  0.21123E-01 ppm1      7.158 ppm2      6.821 CV     1
 ASSI {  539}
   (  segid "    " and resid 54   and name HG2%)
   (( segid "    " and resid 54   and name HN  ))
      4.150     2.150     2.150 peak   539 spectrum    1 weight  0.11000E+01 volume  0.76802E-03 ppm1      1.005 ppm2      7.398 CV     1
 ASSI {  540}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 54   and name HN  ))
      4.610     2.650     1.890 peak   540 spectrum    1 weight  0.11000E+01 volume  0.33290E-03 ppm1      1.359 ppm2      7.398 CV     1
 ASSI {  541}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 54   and name HN  ))
      3.330     1.390     1.390 peak   541 spectrum    1 weight  0.11000E+01 volume  0.88562E-03 ppm1      2.624 ppm2      7.402 CV     1
 ASSI {  542}
   (( segid "    " and resid 54   and name HB  ))
   (( segid "    " and resid 54   and name HN  ))
      2.760     0.950     0.950 peak   542 spectrum    1 weight  0.11000E+01 volume  0.26497E-02 ppm1      3.771 ppm2      7.396 CV     1
 ASSI {  543}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      2.640     0.870     0.870 peak   543 spectrum    1 weight  0.11000E+01 volume  0.31182E-02 ppm1      4.144 ppm2      7.404 CV     1
 ASSI {  544}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 54   and name HN  ))
      3.590     1.610     1.610 peak   544 spectrum    1 weight  0.11000E+01 volume  0.82064E-03 ppm1      4.365 ppm2      7.404 CV     1
 ASSI {  545}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      3.150     1.240     1.240 peak   545 spectrum    1 weight  0.11000E+01 volume  0.11331E-02 ppm1      5.551 ppm2      7.404 CV     1
 ASSI {  546}
   (  segid "    " and resid 48   and name HE% )
   (( segid "    " and resid 54   and name HN  ))
      4.130     2.140     2.140 peak   546 spectrum    1 weight  0.11000E+01 volume  0.48003E-03 ppm1      6.429 ppm2      7.403 CV     1
 ASSI {  547}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      3.880     1.880     1.880 peak   547 spectrum    1 weight  0.11000E+01 volume  0.49470E-03 ppm1      7.002 ppm2      7.404 CV     1
 ASSI {  549}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      3.100     1.200     1.200 peak   549 spectrum    1 weight  0.11000E+01 volume  0.14425E-02 ppm1      4.630 ppm2      7.432 CV     1
 ASSI {  550}
   (  segid "    " and resid 98   and name HG2%)
   (( segid "    " and resid 98   and name HN  ))
      3.220     1.290     1.290 peak   550 spectrum    1 weight  0.11000E+01 volume  0.13493E-02 ppm1      1.140 ppm2      7.432 CV     1
 ASSI {  551}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 98   and name HN  ))
      3.010     1.140     1.140 peak   551 spectrum    1 weight  0.11000E+01 volume  0.15272E-02 ppm1      1.933 ppm2      7.429 CV     1
 ASSI {  553}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.180     2.190     2.190 peak   553 spectrum    1 weight  0.11000E+01 volume  0.49419E-03 ppm1      6.628 ppm2      7.429 CV     1
 ASSI {  554}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      2.790     0.980     0.980 peak   554 spectrum    1 weight  0.11000E+01 volume  0.25496E-02 ppm1      8.034 ppm2      7.431 CV     1
 ASSI {  555}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      3.210     1.290     1.290 peak   555 spectrum    1 weight  0.11000E+01 volume  0.11355E-02 ppm1      8.212 ppm2      7.431 CV     1
 ASSI {  556}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 98   and name HN  ))
      4.530     2.560     1.970 peak   556 spectrum    1 weight  0.11000E+01 volume  0.34485E-03 ppm1      0.238 ppm2      7.432 CV     1
 ASSI {  557}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 98   and name HN  ))
      3.730     1.740     1.740 peak   557 spectrum    1 weight  0.11000E+01 volume  0.69953E-03 ppm1      0.044 ppm2      7.429 CV     1
 ASSI {  558}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      4.680     2.740     1.820 peak   558 spectrum    1 weight  0.11000E+01 volume  0.29322E-03 ppm1     10.310 ppm2      7.402 CV     1
 ASSI {  559}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      4.910     3.010     1.590 peak   559 spectrum    1 weight  0.11000E+01 volume  0.17894E-03 ppm1      9.122 ppm2      7.399 CV     1
 ASSI {  562}
   (( segid "    " and resid 107  and name HA1 ))
   (( segid "    " and resid 107  and name HN  ))
      3.290     1.350     1.350 peak   562 spectrum    1 weight  0.11000E+01 volume  0.18533E-02 ppm1      3.747 ppm2      8.605 CV     1
 ASSI {  563}
   (( segid "    " and resid 17   and name HA2 ))
   (( segid "    " and resid 17   and name HN  ))
      2.740     0.940     0.940 peak   563 spectrum    1 weight  0.11000E+01 volume  0.28811E-02 ppm1      4.153 ppm2      8.452 CV     1
 ASSI {  564}
   (( segid "    " and resid 17   and name HA1 ))
   (( segid "    " and resid 17   and name HN  ))
      2.680     0.900     0.900 peak   564 spectrum    1 weight  0.11000E+01 volume  0.32982E-02 ppm1      4.312 ppm2      8.452 CV     1
 ASSI {  565}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      2.020     0.510     0.510 peak   565 spectrum    1 weight  0.11000E+01 volume  0.13217E-01 ppm1      5.156 ppm2      8.456 CV     1
 ASSI {  566}
   (  segid "    " and resid 10   and name HD2%)
   (( segid "    " and resid 17   and name HN  ))
      3.270     1.340     1.340 peak   566 spectrum    1 weight  0.11000E+01 volume  0.13605E-02 ppm1      0.798 ppm2      8.454 CV     1
 ASSI {  567}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      2.400     0.720     0.720 peak   567 spectrum    1 weight  0.11000E+01 volume  0.39460E-02 ppm1      1.442 ppm2      8.453 CV     1
 ASSI {  568}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
      3.100     1.200     1.200 peak   568 spectrum    1 weight  0.11000E+01 volume  0.16682E-02 ppm1      1.904 ppm2      8.452 CV     1
 ASSI {  569}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      3.790     1.800     1.800 peak   569 spectrum    1 weight  0.11000E+01 volume  0.12035E-02 ppm1      1.703 ppm2      8.451 CV     1
 ASSI {  570}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      3.050     1.160     1.160 peak   570 spectrum    1 weight  0.11000E+01 volume  0.12700E-02 ppm1      9.306 ppm2      8.852 CV     1
 ASSI {  572}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      3.170     1.260     1.260 peak   572 spectrum    1 weight  0.11000E+01 volume  0.13243E-02 ppm1      4.419 ppm2      8.855 CV     1
 ASSI {  573}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 14   and name HN  ))
      3.440     1.480     1.480 peak   573 spectrum    1 weight  0.11000E+01 volume  0.79967E-03 ppm1      4.289 ppm2      8.857 CV     1
 ASSI {  574}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      3.390     1.440     1.440 peak   574 spectrum    1 weight  0.11000E+01 volume  0.97419E-03 ppm1      4.063 ppm2      8.853 CV     1
 ASSI {  575}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HN  ))
      3.740     1.750     1.750 peak   575 spectrum    1 weight  0.11000E+01 volume  0.79088E-03 ppm1      1.163 ppm2      8.855 CV     1
 ASSI {  576}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 14   and name HN  ))
      3.440     1.480     1.480 peak   576 spectrum    1 weight  0.11000E+01 volume  0.76766E-03 ppm1      1.476 ppm2      8.852 CV     1
 ASSI {  577}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 14   and name HN  ))
      2.780     0.970     0.970 peak   577 spectrum    1 weight  0.11000E+01 volume  0.19660E-02 ppm1      1.833 ppm2      8.855 CV     1
 ASSI {  578}
   (( segid "    " and resid 63   and name HA2 ))
   (( segid "    " and resid 63   and name HN  ))
      3.830     1.840     1.840 peak   578 spectrum    1 weight  0.11000E+01 volume  0.41786E-03 ppm1      3.999 ppm2      8.351 CV     1
 OR {  578}
   (( segid "    " and resid 63   and name HA1 ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  579}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 66   and name HN  ))
      3.810     1.810     1.810 peak   579 spectrum    1 weight  0.11000E+01 volume  0.43703E-03 ppm1      3.995 ppm2      8.301 CV     1
 OR {  579}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 66   and name HN  ))
 ASSI {  580}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      3.360     1.410     1.410 peak   580 spectrum    1 weight  0.11000E+01 volume  0.10808E-02 ppm1      4.415 ppm2      7.826 CV     1
 ASSI {  581}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      3.400     1.440     1.440 peak   581 spectrum    1 weight  0.11000E+01 volume  0.99539E-03 ppm1      4.610 ppm2      7.827 CV     1
 ASSI {  582}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 41   and name HN  ))
      2.150     0.580     0.580 peak   582 spectrum    1 weight  0.11000E+01 volume  0.12007E-01 ppm1      3.950 ppm2      7.821 CV     1
 OR {  582}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  583}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 41   and name HN  ))
      4.340     2.360     2.160 peak   583 spectrum    1 weight  0.11000E+01 volume  0.43028E-03 ppm1      2.128 ppm2      7.830 CV     1
 ASSI {  584}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
      3.850     1.860     1.860 peak   584 spectrum    1 weight  0.11000E+01 volume  0.46970E-03 ppm1      2.711 ppm2      7.824 CV     1
 ASSI {  585}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HN  ))
      4.640     2.690     1.860 peak   585 spectrum    1 weight  0.11000E+01 volume  0.37665E-03 ppm1      0.834 ppm2      7.825 CV     1
 ASSI {  586}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 87   and name HN  ))
      3.350     1.400     1.400 peak   586 spectrum    1 weight  0.11000E+01 volume  0.41992E-03 ppm1      0.927 ppm2      8.231 CV     1
 ASSI {  587}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      4.250     2.260     2.250 peak   587 spectrum    1 weight  0.11000E+01 volume  0.40996E-03 ppm1      1.900 ppm2      8.235 CV     1
 ASSI {  588}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 87   and name HN  ))
      3.680     1.700     1.700 peak   588 spectrum    1 weight  0.11000E+01 volume  0.84096E-03 ppm1      2.311 ppm2      8.236 CV     1
 ASSI {  589}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 87   and name HN  ))
      2.810     0.990     0.990 peak   589 spectrum    1 weight  0.11000E+01 volume  0.46051E-02 ppm1      3.731 ppm2      8.232 CV     1
 ASSI {  590}
   (( segid "    " and resid 87   and name HA2 ))
   (( segid "    " and resid 87   and name HN  ))
      2.530     0.800     0.800 peak   590 spectrum    1 weight  0.11000E+01 volume  0.34043E-02 ppm1      4.276 ppm2      8.232 CV     1
 ASSI {  591}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      3.230     1.310     1.310 peak   591 spectrum    1 weight  0.11000E+01 volume  0.11702E-02 ppm1      4.484 ppm2      8.232 CV     1
 ASSI {  592}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.370     0.700     0.700 peak   592 spectrum    1 weight  0.11000E+01 volume  0.51715E-02 ppm1      7.432 ppm2      7.819 CV     1
 ASSI {  593}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      2.650     0.880     0.880 peak   593 spectrum    1 weight  0.11000E+01 volume  0.28019E-02 ppm1      7.658 ppm2      8.232 CV     1
 ASSI {  594}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.550     0.810     0.810 peak   594 spectrum    1 weight  0.11000E+01 volume  0.35662E-02 ppm1      8.132 ppm2      7.823 CV     1
 ASSI {  596}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      4.040     2.040     2.040 peak   596 spectrum    1 weight  0.11000E+01 volume  0.29838E-03 ppm1      9.621 ppm2      8.235 CV     1
 ASSI {  597}
   (( segid "    " and resid 44   and name HA1 ))
   (( segid "    " and resid 44   and name HN  ))
      2.640     0.870     0.870 peak   597 spectrum    1 weight  0.11000E+01 volume  0.32630E-02 ppm1      4.253 ppm2      7.974 CV     1
 ASSI {  598}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 44   and name HN  ))
      2.670     0.890     0.890 peak   598 spectrum    1 weight  0.11000E+01 volume  0.30206E-02 ppm1     -0.319 ppm2      7.973 CV     1
 ASSI {  599}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 44   and name HN  ))
      2.940     1.080     1.080 peak   599 spectrum    1 weight  0.11000E+01 volume  0.21037E-02 ppm1      3.767 ppm2      7.973 CV     1
 ASSI {  600}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.240     0.630     0.630 peak   600 spectrum    1 weight  0.11000E+01 volume  0.83620E-02 ppm1      4.924 ppm2      7.987 CV     1
 ASSI {  602}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 96   and name HN  ))
      3.230     1.310     1.310 peak   602 spectrum    1 weight  0.11000E+01 volume  0.11941E-02 ppm1      3.279 ppm2      6.615 CV     1
 ASSI {  608}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      2.930     1.080     1.080 peak   608 spectrum    1 weight  0.11000E+01 volume  0.19292E-02 ppm1      4.417 ppm2      7.004 CV     1
 ASSI {  609}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.310     1.370     1.370 peak   609 spectrum    1 weight  0.11000E+01 volume  0.13098E-02 ppm1      4.124 ppm2      7.013 CV     1
 ASSI {  613}
   (( segid "    " and resid 46   and name HE3 ))
   (( segid "    " and resid 47   and name HN  ))
      3.580     1.610     1.610 peak   613 spectrum    1 weight  0.11000E+01 volume  0.79332E-03 ppm1      7.603 ppm2      9.320 CV     1
 ASSI {  614}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
      3.280     1.350     1.350 peak   614 spectrum    1 weight  0.11000E+01 volume  0.47395E-03 ppm1      0.819 ppm2      7.423 CV     1
 ASSI {  615}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      3.440     1.480     1.480 peak   615 spectrum    1 weight  0.11000E+01 volume  0.69727E-03 ppm1      5.285 ppm2      8.331 CV     1
 ASSI {  618}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 6    and name HN  ))
      3.730     1.740     1.740 peak   618 spectrum    1 weight  0.11000E+01 volume  0.64364E-03 ppm1      0.525 ppm2      9.246 CV     1
 ASSI {  620}
   (  segid "    " and resid 6    and name HD% )
   (( segid "    " and resid 23   and name HN  ))
      2.820     0.990     0.990 peak   620 spectrum    1 weight  0.11000E+01 volume  0.19671E-02 ppm1      7.208 ppm2      9.198 CV     1
 ASSI {  621}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 23   and name HN  ))
      3.330     1.390     1.390 peak   621 spectrum    1 weight  0.11000E+01 volume  0.10603E-02 ppm1      6.962 ppm2      9.195 CV     1
 ASSI {  622}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      2.880     1.040     1.040 peak   622 spectrum    1 weight  0.11000E+01 volume  0.17626E-02 ppm1      8.733 ppm2      8.452 CV     1
 ASSI {  623}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 44   and name HN  ))
      3.020     1.140     1.140 peak   623 spectrum    1 weight  0.11000E+01 volume  0.18833E-02 ppm1     10.549 ppm2      7.979 CV     1
 ASSI {  624}
   (  segid "    " and resid 55   and name HD% )
   (( segid "    " and resid 55   and name HN  ))
      3.220     1.300     1.300 peak   624 spectrum    1 weight  0.11000E+01 volume  0.94591E-03 ppm1      7.602 ppm2     10.314 CV     1
 ASSI {  626}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.360     1.420     1.420 peak   626 spectrum    1 weight  0.11000E+01 volume  0.10270E-02 ppm1      9.119 ppm2     10.308 CV     1
 ASSI {  629}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HN  ))
      4.490     2.520     2.010 peak   629 spectrum    1 weight  0.11000E+01 volume  0.77657E-03 ppm1      0.866 ppm2      8.487 CV     1
 ASSI {  631}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HN  ))
      3.390     1.440     1.440 peak   631 spectrum    1 weight  0.11000E+01 volume  0.61572E-03 ppm1      1.074 ppm2      8.312 CV     1
 ASSI {  632}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HN  ))
      4.240     2.250     2.250 peak   632 spectrum    1 weight  0.11000E+01 volume  0.47600E-03 ppm1      0.873 ppm2      8.314 CV     1
 ASSI {  633}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 109  and name HN  ))
      4.190     2.200     2.200 peak   633 spectrum    1 weight  0.11000E+01 volume  0.49691E-03 ppm1      2.865 ppm2      8.053 CV     1
 ASSI {  635}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 8    and name HN  ))
      4.140     2.140     2.140 peak   635 spectrum    1 weight  0.11000E+01 volume  0.48005E-03 ppm1      1.246 ppm2      8.583 CV     1
 ASSI {  636}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 8    and name HN  ))
      3.770     1.780     1.780 peak   636 spectrum    1 weight  0.11000E+01 volume  0.55939E-03 ppm1      0.381 ppm2      8.583 CV     1
 ASSI {  637}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
      3.660     1.670     1.670 peak   637 spectrum    1 weight  0.11000E+01 volume  0.51424E-03 ppm1      2.037 ppm2      8.582 CV     1
 ASSI {  638}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      4.580     2.630     1.920 peak   638 spectrum    1 weight  0.11000E+01 volume  0.53733E-03 ppm1      1.972 ppm2      8.706 CV     1
 ASSI {  639}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HN  ))
      3.300     1.360     1.360 peak   639 spectrum    1 weight  0.11000E+01 volume  0.10717E-02 ppm1      1.979 ppm2      8.496 CV     1
 ASSI {  640}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 71   and name HN  ))
      3.860     1.860     1.860 peak   640 spectrum    1 weight  0.11000E+01 volume  0.70897E-03 ppm1      2.317 ppm2      8.533 CV     1
 ASSI {  641}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 71   and name HN  ))
      4.070     2.070     2.070 peak   641 spectrum    1 weight  0.11000E+01 volume  0.42795E-03 ppm1      0.896 ppm2      8.494 CV     1
 ASSI {  642}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 71   and name HN  ))
      6.100     4.650     0.400 peak   642 spectrum    1 weight  0.11000E+01 volume  0.69133E-04 ppm1      1.496 ppm2      8.488 CV     1
 ASSI {  643}
   (  segid "    " and resid 21   and name HG2%)
   (( segid "    " and resid 22   and name HN  ))
      3.440     1.480     1.480 peak   643 spectrum    1 weight  0.11000E+01 volume  0.92061E-03 ppm1      0.539 ppm2      8.092 CV     1
 ASSI {  644}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
      3.720     1.730     1.730 peak   644 spectrum    1 weight  0.11000E+01 volume  0.13147E-02 ppm1      0.051 ppm2      8.210 CV     1
 ASSI {  646}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 93   and name HN  ))
      3.910     1.910     1.910 peak   646 spectrum    1 weight  0.11000E+01 volume  0.46832E-03 ppm1      0.720 ppm2      8.208 CV     1
 ASSI {  648}
   (( segid "    " and resid 102  and name HG1 ))
   (( segid "    " and resid 102  and name HN  ))
      3.610     1.630     1.630 peak   648 spectrum    1 weight  0.11000E+01 volume  0.70505E-03 ppm1      1.342 ppm2      8.663 CV     1
 ASSI {  649}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 102  and name HN  ))
      4.670     2.730     1.830 peak   649 spectrum    1 weight  0.11000E+01 volume  0.45970E-03 ppm1      2.979 ppm2      8.661 CV     1
 ASSI {  650}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.630     2.670     1.870 peak   650 spectrum    1 weight  0.11000E+01 volume  0.29629E-03 ppm1     10.321 ppm2      9.119 CV     1
 ASSI {  651}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      3.800     1.810     1.810 peak   651 spectrum    1 weight  0.11000E+01 volume  0.62950E-03 ppm1      7.991 ppm2      8.872 CV     1
 ASSI {  652}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      3.430     1.470     1.470 peak   652 spectrum    1 weight  0.11000E+01 volume  0.81595E-03 ppm1      8.269 ppm2      8.869 CV     1
 ASSI {  653}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
      3.830     1.840     1.840 peak   653 spectrum    1 weight  0.11000E+01 volume  0.48446E-03 ppm1      0.969 ppm2      8.865 CV     1
 ASSI {  655}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 102  and name HN  ))
      4.450     2.470     2.050 peak   655 spectrum    1 weight  0.11000E+01 volume  0.30144E-03 ppm1      3.582 ppm2      8.656 CV     1
 ASSI {  656}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 101  and name HN  ))
      4.280     2.290     2.220 peak   656 spectrum    1 weight  0.11000E+01 volume  0.33630E-03 ppm1      1.522 ppm2      8.924 CV     1
 ASSI {  657}
   (  segid "    " and resid 101  and name HD% )
   (( segid "    " and resid 101  and name HN  ))
      3.980     1.980     1.980 peak   657 spectrum    1 weight  0.11000E+01 volume  0.46595E-03 ppm1      7.575 ppm2      8.921 CV     1
 ASSI {  658}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 94   and name HN  ))
      4.450     2.480     2.050 peak   658 spectrum    1 weight  0.11000E+01 volume  0.48686E-03 ppm1      0.226 ppm2      8.829 CV     1
 ASSI {  659}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 94   and name HN  ))
      4.380     2.400     2.120 peak   659 spectrum    1 weight  0.11000E+01 volume  0.40742E-03 ppm1      0.042 ppm2      8.836 CV     1
 ASSI {  660}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 94   and name HN  ))
      4.920     3.030     1.580 peak   660 spectrum    1 weight  0.11000E+01 volume  0.27824E-03 ppm1      1.969 ppm2      8.827 CV     1
 ASSI {  661}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 29   and name HN  ))
      4.610     2.650     1.890 peak   661 spectrum    1 weight  0.11000E+01 volume  0.29813E-03 ppm1      0.897 ppm2      6.960 CV     1
 ASSI {  662}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      4.870     2.960     1.630 peak   662 spectrum    1 weight  0.11000E+01 volume  0.33408E-03 ppm1      1.943 ppm2      6.960 CV     1
 ASSI {  663}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 29   and name HN  ))
      5.120     3.280     1.380 peak   663 spectrum    1 weight  0.11000E+01 volume  0.38824E-03 ppm1      1.844 ppm2      6.957 CV     1
 ASSI {  664}
   (( segid "    " and resid 30   and name HG1 ))
   (( segid "    " and resid 29   and name HN  ))
      5.330     3.550     1.170 peak   664 spectrum    1 weight  0.11000E+01 volume  0.22505E-03 ppm1      1.561 ppm2      6.961 CV     1
 ASSI {  665}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      5.150     3.310     1.350 peak   665 spectrum    1 weight  0.11000E+01 volume  0.21272E-03 ppm1      2.800 ppm2      6.954 CV     1
 ASSI {  666}
   (( segid "    " and resid 9    and name HB  ))
   (( segid "    " and resid 57   and name HN  ))
      3.830     1.830     1.830 peak   666 spectrum    1 weight  0.11000E+01 volume  0.58573E-03 ppm1      1.952 ppm2      8.254 CV     1
 ASSI {  667}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 58   and name HN  ))
      3.920     1.920     1.920 peak   667 spectrum    1 weight  0.11000E+01 volume  0.53790E-03 ppm1      2.013 ppm2      8.393 CV     1
 ASSI {  668}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      4.400     2.420     2.100 peak   668 spectrum    1 weight  0.11000E+01 volume  0.23257E-03 ppm1      0.968 ppm2      8.374 CV     1
 ASSI {  669}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      4.150     2.160     2.160 peak   669 spectrum    1 weight  0.11000E+01 volume  0.34129E-03 ppm1      3.509 ppm2      8.284 CV     1
 ASSI {  670}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
      4.080     2.080     2.080 peak   670 spectrum    1 weight  0.11000E+01 volume  0.51839E-03 ppm1      2.044 ppm2      8.251 CV     1
 ASSI {  671}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      3.440     1.480     1.480 peak   671 spectrum    1 weight  0.11000E+01 volume  0.78340E-03 ppm1      4.192 ppm2      8.260 CV     1
 ASSI {  672}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
      3.040     1.160     1.160 peak   672 spectrum    1 weight  0.11000E+01 volume  0.13358E-02 ppm1      3.003 ppm2      9.168 CV     1
 ASSI {  673}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 37   and name HN  ))
      4.890     2.990     1.610 peak   673 spectrum    1 weight  0.11000E+01 volume  0.32743E-03 ppm1      2.975 ppm2      9.227 CV     1
 ASSI {  674}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 70   and name HN  ))
      3.990     1.990     1.990 peak   674 spectrum    1 weight  0.11000E+01 volume  0.59091E-03 ppm1      1.506 ppm2      8.247 CV     1
 ASSI {  675}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      4.540     2.580     1.960 peak   675 spectrum    1 weight  0.11000E+01 volume  0.37140E-03 ppm1      0.918 ppm2      8.248 CV     1
 ASSI {  676}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      4.140     2.150     2.150 peak   676 spectrum    1 weight  0.11000E+01 volume  0.38990E-03 ppm1      6.963 ppm2      8.287 CV     1
 ASSI {  678}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 37   and name HN  ))
      3.690     1.700     1.700 peak   678 spectrum    1 weight  0.11000E+01 volume  0.70927E-03 ppm1      0.595 ppm2      9.220 CV     1
 ASSI {  679}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 37   and name HN  ))
      4.020     2.020     2.020 peak   679 spectrum    1 weight  0.11000E+01 volume  0.52264E-03 ppm1      0.819 ppm2      9.220 CV     1
 ASSI {  680}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      4.010     2.010     2.010 peak   680 spectrum    1 weight  0.11000E+01 volume  0.43886E-03 ppm1      1.908 ppm2      7.653 CV     1
 ASSI {  681}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      4.620     2.670     1.880 peak   681 spectrum    1 weight  0.11000E+01 volume  0.37244E-03 ppm1      8.768 ppm2      7.643 CV     1
 ASSI {  682}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      4.150     2.160     2.160 peak   682 spectrum    1 weight  0.11000E+01 volume  0.58048E-03 ppm1      4.063 ppm2      8.974 CV     1
 ASSI {  683}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      4.040     2.040     2.040 peak   683 spectrum    1 weight  0.11000E+01 volume  0.61204E-03 ppm1      7.829 ppm2      8.976 CV     1
 ASSI {  685}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
      3.820     1.820     1.820 peak   685 spectrum    1 weight  0.11000E+01 volume  0.46221E-03 ppm1      2.019 ppm2      9.155 CV     1
 ASSI {  687}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 92   and name HN  ))
      3.830     1.840     1.840 peak   687 spectrum    1 weight  0.11000E+01 volume  0.54142E-03 ppm1      4.595 ppm2      9.164 CV     1
 ASSI {  688}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      2.430     0.740     0.740 peak   688 spectrum    1 weight  0.11000E+01 volume  0.55796E-02 ppm1      4.668 ppm2      8.423 CV     1
 ASSI {  689}
   (  segid "    " and resid 6    and name HE% )
   (( segid "    " and resid 26   and name HN  ))
      4.360     2.370     2.140 peak   689 spectrum    1 weight  0.11000E+01 volume  0.30563E-03 ppm1      6.974 ppm2      8.420 CV     1
 ASSI {  690}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      4.550     2.590     1.950 peak   690 spectrum    1 weight  0.11000E+01 volume  0.29112E-03 ppm1      7.286 ppm2      8.422 CV     1
 ASSI {  691}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 92   and name HN  ))
      4.150     2.150     2.150 peak   691 spectrum    1 weight  0.11000E+01 volume  0.44414E-03 ppm1      6.997 ppm2      9.171 CV     1
 ASSI {  692}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 92   and name HN  ))
      4.350     2.370     2.150 peak   692 spectrum    1 weight  0.11000E+01 volume  0.28584E-03 ppm1      7.306 ppm2      9.176 CV     1
 ASSI {  693}
   (  segid "    " and resid 92   and name HG1%)
   (( segid "    " and resid 80   and name HN  ))
      4.530     2.560     1.970 peak   693 spectrum    1 weight  0.11000E+01 volume  0.32856E-03 ppm1      0.734 ppm2      9.413 CV     1
 ASSI {  694}
   (  segid "    " and resid 92   and name HG2%)
   (( segid "    " and resid 80   and name HN  ))
      4.580     2.620     1.920 peak   694 spectrum    1 weight  0.11000E+01 volume  0.33315E-03 ppm1      0.235 ppm2      9.414 CV     1
 ASSI {  697}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 80   and name HN  ))
      3.980     1.980     1.980 peak   697 spectrum    1 weight  0.11000E+01 volume  0.42770E-03 ppm1      7.288 ppm2      9.414 CV     1
 ASSI {  698}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HN  ))
      4.170     2.180     2.180 peak   698 spectrum    1 weight  0.11000E+01 volume  0.56416E-03 ppm1      2.573 ppm2      8.727 CV     1
 ASSI {  699}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
      3.750     1.760     1.760 peak   699 spectrum    1 weight  0.11000E+01 volume  0.41181E-03 ppm1      2.298 ppm2      8.728 CV     1
 ASSI {  700}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 13   and name HN  ))
      4.570     2.610     1.930 peak   700 spectrum    1 weight  0.11000E+01 volume  0.33424E-03 ppm1      0.675 ppm2      9.315 CV     1
 ASSI {  701}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 13   and name HN  ))
      4.560     2.600     1.940 peak   701 spectrum    1 weight  0.11000E+01 volume  0.27930E-03 ppm1      0.870 ppm2      9.315 CV     1
 ASSI {  702}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      4.770     2.850     1.730 peak   702 spectrum    1 weight  0.11000E+01 volume  0.25579E-03 ppm1      9.600 ppm2      8.720 CV     1
 ASSI {  703}
   (  segid "    " and resid 8    and name HD2%)
   (( segid "    " and resid 36   and name HN  ))
      5.010     3.140     1.490 peak   703 spectrum    1 weight  0.11000E+01 volume  0.25195E-03 ppm1      0.597 ppm2      8.304 CV     1
 ASSI {  704}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 36   and name HN  ))
      4.410     2.430     2.090 peak   704 spectrum    1 weight  0.11000E+01 volume  0.47443E-03 ppm1      0.835 ppm2      8.303 CV     1
 ASSI {  705}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 51   and name HN  ))
      3.440     1.470     1.470 peak   705 spectrum    1 weight  0.11000E+01 volume  0.36159E-03 ppm1      1.098 ppm2      8.312 CV     1
 ASSI {  706}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      3.860     1.870     1.870 peak   706 spectrum    1 weight  0.11000E+01 volume  0.99486E-03 ppm1      4.624 ppm2      8.318 CV     1
 ASSI {  707}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.280     1.340     1.340 peak   707 spectrum    1 weight  0.11000E+01 volume  0.10763E-02 ppm1      4.191 ppm2      7.494 CV     1
 ASSI {  708}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      3.190     1.270     1.270 peak   708 spectrum    1 weight  0.11000E+01 volume  0.17789E-02 ppm1      1.581 ppm2      7.495 CV     1
 ASSI {  709}
   (( segid "    " and resid 34   and name HE2 ))
   (( segid "    " and resid 35   and name HN  ))
      4.970     3.090     1.530 peak   709 spectrum    1 weight  0.11000E+01 volume  0.29499E-03 ppm1      1.928 ppm2      7.490 CV     1
 ASSI {  710}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
      3.830     1.840     1.840 peak   710 spectrum    1 weight  0.11000E+01 volume  0.55680E-03 ppm1      2.031 ppm2      8.195 CV     1
 ASSI {  711}
   (( segid "    " and resid 79   and name HE1 ))
   (( segid "    " and resid 79   and name HN  ))
      5.250     3.440     1.250 peak   711 spectrum    1 weight  0.11000E+01 volume  0.23851E-03 ppm1     10.334 ppm2      7.808 CV     1
 ASSI {  715}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      4.050     2.050     2.050 peak   715 spectrum    1 weight  0.11000E+01 volume  0.53216E-03 ppm1      7.415 ppm2      8.272 CV     1
 ASSI {  717}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 86   and name HN  ))
      4.980     3.090     1.520 peak   717 spectrum    1 weight  0.11000E+01 volume  0.16522E-03 ppm1      0.899 ppm2      7.760 CV     1
 ASSI {  718}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      4.240     2.250     2.250 peak   718 spectrum    1 weight  0.11000E+01 volume  0.35193E-03 ppm1      3.055 ppm2      8.368 CV     1
 ASSI {  719}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
      4.720     2.780     1.780 peak   719 spectrum    1 weight  0.11000E+01 volume  0.24417E-03 ppm1      0.904 ppm2      8.367 CV     1
 ASSI {  720}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      4.320     2.340     2.180 peak   720 spectrum    1 weight  0.11000E+01 volume  0.26356E-03 ppm1      3.084 ppm2      7.072 CV     1
 ASSI {  721}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      4.220     2.230     2.230 peak   721 spectrum    1 weight  0.11000E+01 volume  0.35369E-03 ppm1      8.484 ppm2      7.066 CV     1
 ASSI {  722}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      4.610     2.660     1.890 peak   722 spectrum    1 weight  0.11000E+01 volume  0.15171E-03 ppm1      9.148 ppm2      7.064 CV     1
 ASSI {  723}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      4.280     2.290     2.220 peak   723 spectrum    1 weight  0.11000E+01 volume  0.47603E-03 ppm1      5.213 ppm2      8.759 CV     1
 ASSI {  724}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      4.270     2.280     2.230 peak   724 spectrum    1 weight  0.11000E+01 volume  0.43883E-03 ppm1      7.448 ppm2      8.341 CV     1
 ASSI {  725}
   (( segid "    " and resid 95   and name HD22))
   (( segid "    " and resid 95   and name HN  ))
      4.140     2.140     2.140 peak   725 spectrum    1 weight  0.11000E+01 volume  0.10076E-02 ppm1      7.730 ppm2      8.339 CV     1
 ASSI {  726}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      3.630     1.650     1.650 peak   726 spectrum    1 weight  0.11000E+01 volume  0.47046E-03 ppm1      3.079 ppm2      8.339 CV     1
 ASSI {  727}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 99   and name HN  ))
      4.360     2.370     2.140 peak   727 spectrum    1 weight  0.11000E+01 volume  0.23847E-03 ppm1      1.943 ppm2      8.332 CV     1
 ASSI {  728}
   (( segid "    " and resid 40   and name HD22))
   (( segid "    " and resid 40   and name HN  ))
      3.940     1.940     1.940 peak   728 spectrum    1 weight  0.11000E+01 volume  0.80995E-03 ppm1      6.289 ppm2      7.424 CV     1
 ASSI {  729}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      3.490     1.520     1.520 peak   729 spectrum    1 weight  0.11000E+01 volume  0.77081E-03 ppm1      2.518 ppm2      7.418 CV     1
 ASSI {  732}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HD21))
      4.610     2.660     1.890 peak   732 spectrum    1 weight  0.11000E+01 volume  0.24868E-03 ppm1      4.613 ppm2      6.674 CV     1
 ASSI {  733}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HD22))
      5.040     3.180     1.460 peak   733 spectrum    1 weight  0.11000E+01 volume  0.18264E-03 ppm1      4.612 ppm2      6.292 CV     1
 ASSI {  734}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name HD22))
      5.450     3.720     1.050 peak   734 spectrum    1 weight  0.11000E+01 volume  0.12161E-03 ppm1      3.846 ppm2      6.289 CV     1
 ASSI {  735}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name HD21))
      4.010     2.010     2.010 peak   735 spectrum    1 weight  0.11000E+01 volume  0.21412E-03 ppm1      3.848 ppm2      6.671 CV     1
 ASSI {  736}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 40   and name HD22))
      4.790     2.870     1.710 peak   736 spectrum    1 weight  0.11000E+01 volume  0.21192E-03 ppm1      0.817 ppm2      6.290 CV     1
 ASSI {  737}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 40   and name HD21))
      4.190     2.190     2.190 peak   737 spectrum    1 weight  0.11000E+01 volume  0.31381E-03 ppm1      0.810 ppm2      6.671 CV     1
 ASSI {  738}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
      4.540     2.570     1.960 peak   738 spectrum    1 weight  0.11000E+01 volume  0.28189E-03 ppm1      0.980 ppm2      9.323 CV     1
 ASSI {  739}
   (( segid "    " and resid 56   and name HB  ))
   (( segid "    " and resid 47   and name HN  ))
      3.670     1.690     1.690 peak   739 spectrum    1 weight  0.11000E+01 volume  0.62552E-03 ppm1      3.841 ppm2      9.321 CV     1
 ASSI {  740}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 47   and name HN  ))
      3.730     1.740     1.740 peak   740 spectrum    1 weight  0.11000E+01 volume  0.72679E-03 ppm1      4.270 ppm2      9.321 CV     1
 ASSI {  741}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      4.150     2.150     2.150 peak   741 spectrum    1 weight  0.11000E+01 volume  0.64708E-03 ppm1      5.622 ppm2      9.320 CV     1
 ASSI {  743}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 21   and name HN  ))
      4.460     2.490     2.040 peak   743 spectrum    1 weight  0.11000E+01 volume  0.32649E-03 ppm1      2.156 ppm2      8.993 CV     1
 ASSI {  744}
   (( segid "    " and resid 5    and name HB1 ))
   (( segid "    " and resid 21   and name HN  ))
      5.130     3.280     1.370 peak   744 spectrum    1 weight  0.11000E+01 volume  0.26992E-03 ppm1      2.016 ppm2      8.992 CV     1
 ASSI {  745}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 21   and name HN  ))
      3.990     1.990     1.990 peak   745 spectrum    1 weight  0.11000E+01 volume  0.39971E-03 ppm1      2.392 ppm2      8.993 CV     1
 ASSI {  746}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 21   and name HN  ))
      4.490     2.520     2.010 peak   746 spectrum    1 weight  0.11000E+01 volume  0.27967E-03 ppm1      2.791 ppm2      8.995 CV     1
 ASSI {  747}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      4.550     2.590     1.950 peak   747 spectrum    1 weight  0.11000E+01 volume  0.35297E-03 ppm1      4.934 ppm2      8.996 CV     1
 ASSI {  748}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      4.370     2.380     2.130 peak   748 spectrum    1 weight  0.11000E+01 volume  0.37892E-03 ppm1      8.063 ppm2      9.001 CV     1
 ASSI {  749}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
      3.470     1.510     1.510 peak   749 spectrum    1 weight  0.11000E+01 volume  0.33928E-03 ppm1      0.482 ppm2      7.294 CV     1
 ASSI {  750}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 84   and name HN  ))
      4.960     3.070     1.540 peak   750 spectrum    1 weight  0.11000E+01 volume  0.27126E-03 ppm1      0.915 ppm2      9.613 CV     1
 ASSI {  751}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 84   and name HN  ))
      4.540     2.580     1.960 peak   751 spectrum    1 weight  0.11000E+01 volume  0.29143E-03 ppm1      1.163 ppm2      9.613 CV     1
 ASSI {  752}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 84   and name HN  ))
      3.950     1.950     1.950 peak   752 spectrum    1 weight  0.11000E+01 volume  0.48552E-03 ppm1      2.290 ppm2      9.612 CV     1
 ASSI {  754}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      5.180     3.360     1.320 peak   754 spectrum    1 weight  0.11000E+01 volume  0.17598E-03 ppm1      8.029 ppm2      9.622 CV     1
 ASSI {  756}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      4.280     2.280     2.220 peak   756 spectrum    1 weight  0.11000E+01 volume  0.29242E-03 ppm1      8.738 ppm2      9.612 CV     1
 ASSI {  759}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HD22))
      4.700     2.760     1.800 peak   759 spectrum    1 weight  0.11000E+01 volume  0.32453E-03 ppm1      2.967 ppm2      6.985 CV     1
 ASSI {  760}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 38   and name HD21))
      4.860     2.960     1.640 peak   760 spectrum    1 weight  0.11000E+01 volume  0.20809E-03 ppm1      4.089 ppm2      7.642 CV     1
 ASSI {  761}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 38   and name HD22))
      6.000     4.510     0.500 peak   761 spectrum    1 weight  0.11000E+01 volume  0.11755E-03 ppm1      4.092 ppm2      6.991 CV     1
 ASSI {  762}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HD21))
      4.010     2.010     2.010 peak   762 spectrum    1 weight  0.11000E+01 volume  0.39216E-03 ppm1      4.455 ppm2      7.642 CV     1
 ASSI {  763}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HD22))
      5.240     3.430     1.260 peak   763 spectrum    1 weight  0.11000E+01 volume  0.13566E-03 ppm1      4.466 ppm2      6.988 CV     1
 ASSI {  764}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 5    and name HE21))
      4.330     2.340     2.170 peak   764 spectrum    1 weight  0.11000E+01 volume  0.16379E-03 ppm1      4.354 ppm2      7.801 CV     1
 ASSI {  766}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      2.530     0.800     0.800 peak   766 spectrum    1 weight  0.11000E+01 volume  0.40125E-02 ppm1      3.763 ppm2      7.427 CV     1
 ASSI {  767}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      2.260     0.640     0.640 peak   767 spectrum    1 weight  0.11000E+01 volume  0.76629E-02 ppm1      5.270 ppm2      7.976 CV     1
 ASSI {  768}
   (( segid "    " and resid 12   and name HA2 ))
   (( segid "    " and resid 12   and name HN  ))
      2.750     0.940     0.940 peak   768 spectrum    1 weight  0.11000E+01 volume  0.31340E-02 ppm1      4.468 ppm2      7.974 CV     1
 ASSI {  769}
   (( segid "    " and resid 12   and name HA1 ))
   (( segid "    " and resid 12   and name HN  ))
      2.230     0.620     0.620 peak   769 spectrum    1 weight  0.11000E+01 volume  0.76511E-02 ppm1      4.067 ppm2      7.976 CV     1
 ASSI {  770}
   (( segid "    " and resid 16   and name HG1 ))
   (( segid "    " and resid 12   and name HN  ))
      2.980     1.110     1.110 peak   770 spectrum    1 weight  0.11000E+01 volume  0.14364E-02 ppm1      1.468 ppm2      7.976 CV     1
 OR {  770}
   (( segid "    " and resid 16   and name HG2 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI {  771}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
      4.550     2.590     1.950 peak   771 spectrum    1 weight  0.11000E+01 volume  0.58360E-03 ppm1      1.746 ppm2      7.975 CV     1
 ASSI {  772}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
      3.880     1.880     1.880 peak   772 spectrum    1 weight  0.11000E+01 volume  0.46821E-03 ppm1      0.827 ppm2      7.970 CV     1
 ASSI {  773}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 107  and name HN  ))
      4.350     2.360     2.150 peak   773 spectrum    1 weight  0.11000E+01 volume  0.35242E-03 ppm1      2.240 ppm2      8.603 CV     1
 ASSI {  774}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
      4.950     3.070     1.550 peak   774 spectrum    1 weight  0.11000E+01 volume  0.34730E-03 ppm1      1.880 ppm2      8.609 CV     1
 ASSI {  775}
   (( segid "    " and resid 107  and name HA2 ))
   (( segid "    " and resid 107  and name HN  ))
      2.840     1.010     1.010 peak   775 spectrum    1 weight  0.11000E+01 volume  0.17937E-02 ppm1      3.948 ppm2      8.603 CV     1
 ASSI {  776}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      4.410     2.430     2.090 peak   776 spectrum    1 weight  0.11000E+01 volume  0.36394E-03 ppm1      4.528 ppm2      8.453 CV     1
 ASSI {  777}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 41   and name HN  ))
      5.420     3.680     1.080 peak   777 spectrum    1 weight  0.11000E+01 volume  0.16503E-03 ppm1      1.769 ppm2      7.828 CV     1
 ASSI {  778}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 44   and name HN  ))
      4.070     2.070     2.070 peak   778 spectrum    1 weight  0.11000E+01 volume  0.37043E-03 ppm1      0.662 ppm2      7.972 CV     1
 ASSI {  779}
   (  segid "    " and resid 57   and name HG1%)
   (( segid "    " and resid 44   and name HN  ))
      5.040     3.170     1.460 peak   779 spectrum    1 weight  0.11000E+01 volume  0.21264E-03 ppm1      0.399 ppm2      7.966 CV     1
 ASSI {  781}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 98   and name HN  ))
      4.300     2.310     2.200 peak   781 spectrum    1 weight  0.11000E+01 volume  0.58721E-03 ppm1      1.548 ppm2      7.428 CV     1
 ASSI {  782}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      4.830     2.910     1.670 peak   782 spectrum    1 weight  0.11000E+01 volume  0.22916E-03 ppm1      8.144 ppm2      8.824 CV     1
 ASSI {  784}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      3.010     1.140     1.140 peak   784 spectrum    1 weight  0.11000E+01 volume  0.13788E-02 ppm1      2.155 ppm2      8.947 CV     1
 ASSI {  785}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.820     1.000     1.000 peak   785 spectrum    1 weight  0.11000E+01 volume  0.16911E-02 ppm1      4.506 ppm2      8.716 CV     1
 ASSI {  786}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      3.050     1.160     1.160 peak   786 spectrum    1 weight  0.11000E+01 volume  0.17407E-02 ppm1      4.014 ppm2      8.435 CV     1
 ASSI {  787}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HN  ))
      3.100     1.200     1.200 peak   787 spectrum    1 weight  0.11000E+01 volume  0.30554E-02 ppm1      1.941 ppm2      8.040 CV     1
 ASSI {  788}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 5    and name HN  ))
      4.410     2.430     2.090 peak   788 spectrum    1 weight  0.11000E+01 volume  0.41778E-03 ppm1      2.467 ppm2      8.040 CV     1
 ASSI {  789}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 87   and name HN  ))
      5.060     3.200     1.440 peak   789 spectrum    1 weight  0.11000E+01 volume  0.22323E-03 ppm1      1.470 ppm2      8.229 CV     1
 ASSI {  790}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 6    and name HN  ))
      3.370     1.420     1.420 peak   790 spectrum    1 weight  0.11000E+01 volume  0.69947E-03 ppm1      2.163 ppm2      9.247 CV     1
 ASSI {  792}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      3.030     1.140     1.140 peak   792 spectrum    1 weight  0.11000E+01 volume  0.21453E-02 ppm1      4.401 ppm2      7.374 CV     1
 ASSI {  793}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      2.720     0.930     0.930 peak   793 spectrum    1 weight  0.11000E+01 volume  0.27989E-02 ppm1      4.470 ppm2      7.374 CV     1
 ASSI {  794}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HE21))
      3.810     1.820     1.820 peak   794 spectrum    1 weight  0.11000E+01 volume  0.44227E-03 ppm1      2.048 ppm2      7.805 CV     1
 OR {  794}
   (( segid "    " and resid 5    and name HB1 ))
   (( segid "    " and resid 5    and name HE21))
 ASSI {  795}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 89   and name HN  ))
      4.240     2.250     2.250 peak   795 spectrum    1 weight  0.11000E+01 volume  0.49160E-03 ppm1      2.285 ppm2      8.758 CV     1
 ASSI {  798}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
      3.400     1.450     1.450 peak   798 spectrum    1 weight  0.11000E+01 volume  0.68753E-03 ppm1      1.989 ppm2      9.380 CV     1
 ASSI {  799}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      3.990     1.990     1.990 peak   799 spectrum    1 weight  0.11000E+01 volume  0.81643E-03 ppm1      2.073 ppm2      9.380 CV     1
 ASSI {  800}
   (  segid "    " and resid 24   and name HG1%)
   (( segid "    " and resid 25   and name HN  ))
      3.430     1.470     1.470 peak   800 spectrum    1 weight  0.11000E+01 volume  0.19790E-02 ppm1      0.835 ppm2      7.297 CV     1
 ASSI {  801}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      3.240     1.310     1.310 peak   801 spectrum    1 weight  0.11000E+01 volume  0.18771E-02 ppm1      0.913 ppm2      7.298 CV     1
 ASSI {  803}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 9    and name HN  ))
      3.610     1.630     1.630 peak   803 spectrum    1 weight  0.11000E+01 volume  0.12503E-02 ppm1      0.829 ppm2      9.119 CV     1
 ASSI {  805}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      2.190     0.600     0.600 peak   805 spectrum    1 weight  0.11000E+01 volume  0.10589E-01 ppm1      4.843 ppm2      8.625 CV     1
 ASSI {  806}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
      3.910     1.910     1.910 peak   806 spectrum    1 weight  0.11000E+01 volume  0.91241E-03 ppm1      1.907 ppm2      7.859 CV     1
 ASSI {  807}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      3.290     1.360     1.360 peak   807 spectrum    1 weight  0.11000E+01 volume  0.10656E-02 ppm1      1.969 ppm2      7.858 CV     1
 ASSI {  808}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 35   and name HN  ))
      4.570     2.610     1.930 peak   808 spectrum    1 weight  0.11000E+01 volume  0.45659E-03 ppm1      0.873 ppm2      7.498 CV     1
 ASSI {  810}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
      2.680     0.900     0.900 peak   810 spectrum    1 weight  0.11000E+01 volume  0.23326E-02 ppm1      1.737 ppm2      8.158 CV     1
 ASSI {  811}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HN  ))
      2.430     0.740     0.740 peak   811 spectrum    1 weight  0.11000E+01 volume  0.41181E-02 ppm1      1.609 ppm2      8.764 CV     1
 ASSI {  812}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HN  ))
      2.620     0.860     0.860 peak   812 spectrum    1 weight  0.11000E+01 volume  0.38859E-02 ppm1      1.653 ppm2      8.764 CV     1
 ASSI {  813}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HN  ))
      3.340     1.390     1.390 peak   813 spectrum    1 weight  0.11000E+01 volume  0.23624E-02 ppm1      1.362 ppm2      8.710 CV     1
 ASSI {  814}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      2.510     0.790     0.790 peak   814 spectrum    1 weight  0.11000E+01 volume  0.28712E-02 ppm1      1.454 ppm2      8.709 CV     1
 ASSI {  815}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      2.280     0.650     0.650 peak   815 spectrum    1 weight  0.11000E+01 volume  0.70761E-02 ppm1      2.217 ppm2      7.496 CV     1
 ASSI {  816}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      2.190     0.600     0.600 peak   816 spectrum    1 weight  0.11000E+01 volume  0.92512E-02 ppm1      2.267 ppm2      7.495 CV     1
 ASSI {  817}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 95   and name HN  ))
      3.940     1.950     1.950 peak   817 spectrum    1 weight  0.11000E+01 volume  0.15759E-03 ppm1      1.531 ppm2      8.347 CV     1
 ASSI {  818}
   (( segid "    " and resid 53   and name HG1 ))
   (( segid "    " and resid 54   and name HN  ))
      4.780     2.850     1.720 peak   818 spectrum    1 weight  0.11000E+01 volume  0.32240E-03 ppm1      1.344 ppm2      7.399 CV     1
 ASSI {  819}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 78   and name HN  ))
      4.970     3.090     1.530 peak   819 spectrum    1 weight  0.11000E+01 volume  0.18845E-03 ppm1      2.354 ppm2      9.009 CV     1
 ASSI {  820}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HD21))
      3.290     1.360     1.360 peak   820 spectrum    1 weight  0.11000E+01 volume  0.92465E-03 ppm1      2.933 ppm2      7.640 CV     1
 ASSI {  821}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HD21))
      3.220     1.290     1.290 peak   821 spectrum    1 weight  0.11000E+01 volume  0.84511E-03 ppm1      2.985 ppm2      7.640 CV     1
 ASSI {  822}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      4.920     3.020     1.580 peak   822 spectrum    1 weight  0.11000E+01 volume  0.28044E-03 ppm1      2.995 ppm2      7.494 CV     1
 ASSI {  823}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HN  ))
      3.800     1.810     1.810 peak   823 spectrum    1 weight  0.11000E+01 volume  0.18016E-02 ppm1      2.482 ppm2      7.495 CV     1
 ASSI {  824}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
      2.960     1.100     1.100 peak   824 spectrum    1 weight  0.11000E+01 volume  0.33303E-02 ppm1      2.733 ppm2      7.422 CV     1
 ASSI {  825}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 31   and name HN  ))
      3.280     1.350     1.350 peak   825 spectrum    1 weight  0.11000E+01 volume  0.22277E-02 ppm1      1.948 ppm2      7.071 CV     1
 ASSI {  826}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      3.350     1.400     1.400 peak   826 spectrum    1 weight  0.11000E+01 volume  0.27672E-02 ppm1      2.214 ppm2      8.297 CV     1
 ASSI {  827}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 36   and name HN  ))
      2.460     0.750     0.750 peak   827 spectrum    1 weight  0.11000E+01 volume  0.38115E-02 ppm1      2.271 ppm2      8.296 CV     1
 ASSI {  828}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 36   and name HN  ))
      4.010     2.010     2.010 peak   828 spectrum    1 weight  0.11000E+01 volume  0.97116E-03 ppm1      2.441 ppm2      8.296 CV     1
 ASSI {  829}
   (( segid "    " and resid 77   and name HG2 ))
   (( segid "    " and resid 78   and name HN  ))
      5.080     3.220     1.420 peak   829 spectrum    1 weight  0.11000E+01 volume  0.34119E-03 ppm1      2.058 ppm2      9.010 CV     1
 ASSI {  830}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      3.290     1.360     1.360 peak   830 spectrum    1 weight  0.11000E+01 volume  0.21060E-02 ppm1      8.904 ppm2      8.662 CV     1
 ASSI {  831}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      2.470     0.770     0.770 peak   831 spectrum    1 weight  0.11000E+01 volume  0.40797E-02 ppm1      3.185 ppm2      9.375 CV     1
 ASSI {  832}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 75   and name HN  ))
      2.630     0.870     0.870 peak   832 spectrum    1 weight  0.11000E+01 volume  0.47632E-02 ppm1      1.388 ppm2      8.401 CV     1
 ASSI {  834}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HN  ))
      2.830     1.000     1.000 peak   834 spectrum    1 weight  0.11000E+01 volume  0.26545E-02 ppm1      1.699 ppm2      8.659 CV     1
 ASSI {  835}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HN  ))
      2.770     0.960     0.960 peak   835 spectrum    1 weight  0.11000E+01 volume  0.24237E-02 ppm1      1.794 ppm2      8.659 CV     1
 ASSI {  836}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
      3.550     1.580     1.580 peak   836 spectrum    1 weight  0.11000E+01 volume  0.19125E-02 ppm1      0.784 ppm2      9.116 CV     1
 ASSI {   23}
   (  segid "    " and resid 48   and name HD% )
   (  segid "    " and resid 55   and name HD% )
      2.700     0.910     0.910 peak    23 spectrum    1 weight  0.11000E+01 volume  0.23069E-02 ppm1      6.631 ppm2      7.575 CV     1
 ASSI {   34}
   (  segid "    " and resid 6    and name HD% )
   (  segid "    " and resid 6    and name HE% )
      2.130     0.570     0.570 peak    34 spectrum    1 weight  0.11000E+01 volume  0.84078E-02 ppm1      7.198 ppm2      6.963 CV     1
 ASSI {   35}
   (  segid "    " and resid 90   and name HD% )
   (  segid "    " and resid 90   and name HE% )
      2.260     0.640     0.640 peak    35 spectrum    1 weight  0.11000E+01 volume  0.60372E-02 ppm1      6.766 ppm2      6.272 CV     1
 ASSI {   40}
   (  segid "    " and resid 36   and name HD% )
   (  segid "    " and resid 36   and name HE% )
      2.060     0.530     0.530 peak    40 spectrum    1 weight  0.11000E+01 volume  0.10070E-01 ppm1      6.991 ppm2      6.746 CV     1
 ASSI {   43}
   (( segid "    " and resid 46   and name HE3 ))
   (( segid "    " and resid 46   and name HZ3 ))
      2.350     0.690     0.690 peak    43 spectrum    1 weight  0.11000E+01 volume  0.48346E-02 ppm1      7.591 ppm2      6.630 CV     1
 ASSI {   45}
   (  segid "    " and resid 101  and name HE% )
   (  segid "    " and resid 101  and name HD% )
      2.180     0.590     0.590 peak    45 spectrum    1 weight  0.11000E+01 volume  0.80900E-02 ppm1      7.109 ppm2      7.584 CV     1
 ASSI {   48}
   (( segid "    " and resid 79   and name HZ2 ))
   (( segid "    " and resid 79   and name HH2 ))
      2.580     0.830     0.830 peak    48 spectrum    1 weight  0.11000E+01 volume  0.32738E-02 ppm1      7.380 ppm2      7.108 CV     1
 ASSI {   70}
   (  segid "    " and resid 91   and name HE% )
   (  segid "    " and resid 91   and name HD% )
      2.060     0.530     0.530 peak    70 spectrum    1 weight  0.11000E+01 volume  0.10911E-01 ppm1      7.115 ppm2      6.985 CV     1
 ASSI {   72}
   (( segid "    " and resid 79   and name HZ3 ))
   (( segid "    " and resid 79   and name HH2 ))
      2.630     0.860     0.860 peak    72 spectrum    1 weight  0.11000E+01 volume  0.28453E-02 ppm1      6.773 ppm2      7.111 CV     1
 ASSI {   73}
   (( segid "    " and resid 46   and name HZ2 ))
   (( segid "    " and resid 46   and name HH2 ))
      2.590     0.840     0.840 peak    73 spectrum    1 weight  0.11000E+01 volume  0.27267E-02 ppm1      7.368 ppm2      6.780 CV     1
 ASSI {   75}
   (( segid "    " and resid 79   and name HE3 ))
   (( segid "    " and resid 79   and name HZ3 ))
      2.840     1.010     1.010 peak    75 spectrum    1 weight  0.11000E+01 volume  0.17131E-02 ppm1      7.281 ppm2      6.776 CV     1
 ASSI {   76}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HD1 ))
      2.960     1.100     1.100 peak    76 spectrum    1 weight  0.11000E+01 volume  0.15992E-02 ppm1      9.366 ppm2      7.599 CV     1
 ASSI {   96}
   (( segid "    " and resid 46   and name HH2 ))
   (( segid "    " and resid 46   and name HZ3 ))
      2.190     0.600     0.600 peak    96 spectrum    1 weight  0.11000E+01 volume  0.71729E-02 ppm1      6.752 ppm2      6.634 CV     1
 ASSI {   97}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 83   and name HE% )
      2.040     0.520     0.520 peak    97 spectrum    1 weight  0.11000E+01 volume  0.12342E-01 ppm1      6.861 ppm2      6.740 CV     1
 ASSI {  129}
   (  segid "    " and resid 6    and name HD% )
   (  segid "    " and resid 48   and name HD% )
      3.200     1.280     1.280 peak   129 spectrum    1 weight  0.11000E+01 volume  0.10853E-02 ppm1      7.200 ppm2      6.629 CV     1
# Restraints file 3: GB1_WW4_dihedrals.tbl
 ASSIGN  (resid 2    and name C   ) (resid 3    and name N   )
         (resid 3    and name CA  ) (resid 3    and name C   )  1.00 -64.63 55.37 2

 ASSIGN  (resid 3    and name N   ) (resid 3    and name CA  )
         (resid 3    and name C   ) (resid 4    and name N   )  1.00 143.61 53.61 2

 ASSIGN  (resid 3    and name C   ) (resid 4    and name N   )
         (resid 4    and name CA  ) (resid 4    and name C   )  1.00 -134.25 35.75 2

 ASSIGN  (resid 4    and name N   ) (resid 4    and name CA  )
         (resid 4    and name C   ) (resid 5    and name N   )  1.00 156.64 46.64 2

 ASSIGN  (resid 4    and name C   ) (resid 5    and name N   )
         (resid 5    and name CA  ) (resid 5    and name C   )  1.00 -105.05 34.95 2

 ASSIGN  (resid 5    and name N   ) (resid 5    and name CA  )
         (resid 5    and name C   ) (resid 6    and name N   )  1.00 124.96 24.96 2

 ASSIGN  (resid 5    and name C   ) (resid 6    and name N   )
         (resid 6    and name CA  ) (resid 6    and name C   )  1.00 -115.13 34.87 2

 ASSIGN  (resid 6    and name N   ) (resid 6    and name CA  )
         (resid 6    and name C   ) (resid 7    and name N   )  1.00 134.71 24.71 2

 ASSIGN  (resid 6    and name C   ) (resid 7    and name N   )
         (resid 7    and name CA  ) (resid 7    and name C   )  1.00 -129.01 30.99 2

 ASSIGN  (resid 7    and name N   ) (resid 7    and name CA  )
         (resid 7    and name C   ) (resid 8    and name N   )  1.00 136.14 26.14 2

 ASSIGN  (resid 7    and name C   ) (resid 8    and name N   )
         (resid 8    and name CA  ) (resid 8    and name C   )  1.00 -116.13 33.87 2

 ASSIGN  (resid 8    and name N   ) (resid 8    and name CA  )
         (resid 8    and name C   ) (resid 9    and name N   )  1.00 128.13 28.13 2

 ASSIGN  (resid 8    and name C   ) (resid 9    and name N   )
         (resid 9    and name CA  ) (resid 9    and name C   )  1.00 -114.92 25.08 2

 ASSIGN  (resid 9    and name N   ) (resid 9    and name CA  )
         (resid 9    and name C   ) (resid 10   and name N   )  1.00 125.01 25.01 2

 ASSIGN  (resid 9    and name C   ) (resid 10   and name N   )
         (resid 10   and name CA  ) (resid 10   and name C   )  1.00 -104.09 35.91 2

 ASSIGN  (resid 10   and name N   ) (resid 10   and name CA  )
         (resid 10   and name C   ) (resid 11   and name N   )  1.00 118.62 28.62 2

 ASSIGN  (resid 10   and name C   ) (resid 11   and name N   )
         (resid 11   and name CA  ) (resid 11   and name C   )  1.00 -83.93 56.07 2

 ASSIGN  (resid 11   and name N   ) (resid 11   and name CA  )
         (resid 11   and name C   ) (resid 12   and name N   )  1.00 127.98 37.98 2

 ASSIGN  (resid 12   and name C   ) (resid 13   and name N   )
         (resid 13   and name CA  ) (resid 13   and name C   )  1.00 -76.76 43.24 2

 ASSIGN  (resid 13   and name N   ) (resid 13   and name CA  )
         (resid 13   and name C   ) (resid 14   and name N   )  1.00 -23.93 36.07 2

 ASSIGN  (resid 14   and name C   ) (resid 15   and name N   )
         (resid 15   and name CA  ) (resid 15   and name C   )  1.00 -70.70 89.30 2

 ASSIGN  (resid 15   and name N   ) (resid 15   and name CA  )
         (resid 15   and name C   ) (resid 16   and name N   )  1.00 137.57 37.57 2

 ASSIGN  (resid 15   and name C   ) (resid 16   and name N   )
         (resid 16   and name CA  ) (resid 16   and name C   )  1.00 -124.65 35.35 2

 ASSIGN  (resid 16   and name N   ) (resid 16   and name CA  )
         (resid 16   and name C   ) (resid 17   and name N   )  1.00 144.31 34.31 2

 ASSIGN  (resid 16   and name C   ) (resid 17   and name N   )
         (resid 17   and name CA  ) (resid 17   and name C   )  1.00 -130.60 49.40 2

 ASSIGN  (resid 17   and name N   ) (resid 17   and name CA  )
         (resid 17   and name C   ) (resid 18   and name N   )  1.00 145.62 55.62 2

 ASSIGN  (resid 17   and name C   ) (resid 18   and name N   )
         (resid 18   and name CA  ) (resid 18   and name C   )  1.00 -134.62 35.38 2

 ASSIGN  (resid 18   and name N   ) (resid 18   and name CA  )
         (resid 18   and name C   ) (resid 19   and name N   )  1.00 151.02 41.02 2

 ASSIGN  (resid 18   and name C   ) (resid 19   and name N   )
         (resid 19   and name CA  ) (resid 19   and name C   )  1.00 -112.69 57.31 2

 ASSIGN  (resid 19   and name N   ) (resid 19   and name CA  )
         (resid 19   and name C   ) (resid 20   and name N   )  1.00 141.96 41.96 2

 ASSIGN  (resid 19   and name C   ) (resid 20   and name N   )
         (resid 20   and name CA  ) (resid 20   and name C   )  1.00 -127.02 32.98 2

 ASSIGN  (resid 20   and name N   ) (resid 20   and name CA  )
         (resid 20   and name C   ) (resid 21   and name N   )  1.00 142.46 32.46 2

 ASSIGN  (resid 20   and name C   ) (resid 21   and name N   )
         (resid 21   and name CA  ) (resid 21   and name C   )  1.00 -130.29 29.71 2

 ASSIGN  (resid 21   and name N   ) (resid 21   and name CA  )
         (resid 21   and name C   ) (resid 22   and name N   )  1.00 127.88 27.88 2

 ASSIGN  (resid 21   and name C   ) (resid 22   and name N   )
         (resid 22   and name CA  ) (resid 22   and name C   )  1.00 -114.87 45.13 2

 ASSIGN  (resid 22   and name N   ) (resid 22   and name CA  )
         (resid 22   and name C   ) (resid 23   and name N   )  1.00 135.32 35.32 2

 ASSIGN  (resid 22   and name C   ) (resid 23   and name N   )
         (resid 23   and name CA  ) (resid 23   and name C   )  1.00 -124.65 45.35 2

 ASSIGN  (resid 23   and name N   ) (resid 23   and name CA  )
         (resid 23   and name C   ) (resid 24   and name N   )  1.00 144.78 34.78 2

 ASSIGN  (resid 23   and name C   ) (resid 24   and name N   )
         (resid 24   and name CA  ) (resid 24   and name C   )  1.00 -75.94 44.06 2

 ASSIGN  (resid 24   and name N   ) (resid 24   and name CA  )
         (resid 24   and name C   ) (resid 25   and name N   )  1.00 -21.68 28.32 2

 ASSIGN  (resid 24   and name C   ) (resid 25   and name N   )
         (resid 25   and name CA  ) (resid 25   and name C   )  1.00 -131.28 48.72 2

 ASSIGN  (resid 25   and name N   ) (resid 25   and name CA  )
         (resid 25   and name C   ) (resid 26   and name N   )  1.00 157.78 27.78 2

 ASSIGN  (resid 25   and name C   ) (resid 26   and name N   )
         (resid 26   and name CA  ) (resid 26   and name C   )  1.00 -55.10 24.90 2

 ASSIGN  (resid 26   and name N   ) (resid 26   and name CA  )
         (resid 26   and name C   ) (resid 27   and name N   )  1.00 -42.94 27.06 2

 ASSIGN  (resid 26   and name C   ) (resid 27   and name N   )
         (resid 27   and name CA  ) (resid 27   and name C   )  1.00 -64.90 25.10 2

 ASSIGN  (resid 27   and name N   ) (resid 27   and name CA  )
         (resid 27   and name C   ) (resid 28   and name N   )  1.00 -42.37 27.63 2

 ASSIGN  (resid 27   and name C   ) (resid 28   and name N   )
         (resid 28   and name CA  ) (resid 28   and name C   )  1.00 -64.93 25.07 2

 ASSIGN  (resid 28   and name N   ) (resid 28   and name CA  )
         (resid 28   and name C   ) (resid 29   and name N   )  1.00 -44.48 15.52 2

 ASSIGN  (resid 28   and name C   ) (resid 29   and name N   )
         (resid 29   and name CA  ) (resid 29   and name C   )  1.00 -64.09 25.91 2

 ASSIGN  (resid 29   and name N   ) (resid 29   and name CA  )
         (resid 29   and name C   ) (resid 30   and name N   )  1.00 -43.76 26.24 2

 ASSIGN  (resid 29   and name C   ) (resid 30   and name N   )
         (resid 30   and name CA  ) (resid 30   and name C   )  1.00 -60.65 29.35 2

 ASSIGN  (resid 30   and name N   ) (resid 30   and name CA  )
         (resid 30   and name C   ) (resid 31   and name N   )  1.00 -44.81 25.19 2

 ASSIGN  (resid 30   and name C   ) (resid 31   and name N   )
         (resid 31   and name CA  ) (resid 31   and name C   )  1.00 -64.50 15.50 2

 ASSIGN  (resid 31   and name N   ) (resid 31   and name CA  )
         (resid 31   and name C   ) (resid 32   and name N   )  1.00 -44.90 25.10 2

 ASSIGN  (resid 31   and name C   ) (resid 32   and name N   )
         (resid 32   and name CA  ) (resid 32   and name C   )  1.00 -63.77 26.23 2

 ASSIGN  (resid 32   and name N   ) (resid 32   and name CA  )
         (resid 32   and name C   ) (resid 33   and name N   )  1.00 -43.29 26.71 2

 ASSIGN  (resid 32   and name C   ) (resid 33   and name N   )
         (resid 33   and name CA  ) (resid 33   and name C   )  1.00 -65.18 24.82 2

 ASSIGN  (resid 33   and name N   ) (resid 33   and name CA  )
         (resid 33   and name C   ) (resid 34   and name N   )  1.00 -34.96 25.04 2

 ASSIGN  (resid 33   and name C   ) (resid 34   and name N   )
         (resid 34   and name CA  ) (resid 34   and name C   )  1.00 -63.06 26.94 2

 ASSIGN  (resid 34   and name N   ) (resid 34   and name CA  )
         (resid 34   and name C   ) (resid 35   and name N   )  1.00 -40.66 29.34 2

 ASSIGN  (resid 34   and name C   ) (resid 35   and name N   )
         (resid 35   and name CA  ) (resid 35   and name C   )  1.00 -64.93 25.07 2

 ASSIGN  (resid 35   and name N   ) (resid 35   and name CA  )
         (resid 35   and name C   ) (resid 36   and name N   )  1.00 -43.79 26.21 2

 ASSIGN  (resid 35   and name C   ) (resid 36   and name N   )
         (resid 36   and name CA  ) (resid 36   and name C   )  1.00 -64.87 25.13 2

 ASSIGN  (resid 36   and name N   ) (resid 36   and name CA  )
         (resid 36   and name C   ) (resid 37   and name N   )  1.00 -44.11 25.89 2

 ASSIGN  (resid 36   and name C   ) (resid 37   and name N   )
         (resid 37   and name CA  ) (resid 37   and name C   )  1.00 -64.73 25.27 2

 ASSIGN  (resid 37   and name N   ) (resid 37   and name CA  )
         (resid 37   and name C   ) (resid 38   and name N   )  1.00 -40.41 29.59 2

 ASSIGN  (resid 37   and name C   ) (resid 38   and name N   )
         (resid 38   and name CA  ) (resid 38   and name C   )  1.00 -64.73 25.27 2

 ASSIGN  (resid 38   and name N   ) (resid 38   and name CA  )
         (resid 38   and name C   ) (resid 39   and name N   )  1.00 -44.38 25.62 2

 ASSIGN  (resid 38   and name C   ) (resid 39   and name N   )
         (resid 39   and name CA  ) (resid 39   and name C   )  1.00 -64.97 15.03 2

 ASSIGN  (resid 39   and name N   ) (resid 39   and name CA  )
         (resid 39   and name C   ) (resid 40   and name N   )  1.00 -23.68 26.32 2

 ASSIGN  (resid 39   and name C   ) (resid 40   and name N   )
         (resid 40   and name CA  ) (resid 40   and name C   )  1.00 -94.96 25.04 2

 ASSIGN  (resid 40   and name N   ) (resid 40   and name CA  )
         (resid 40   and name C   ) (resid 41   and name N   )  1.00   4.97 24.97 2

 ASSIGN  (resid 40   and name C   ) (resid 41   and name N   )
         (resid 41   and name CA  ) (resid 41   and name C   )  1.00  83.51 33.51 2

 ASSIGN  (resid 41   and name N   ) (resid 41   and name CA  )
         (resid 41   and name C   ) (resid 42   and name N   )  1.00  16.22 46.22 2

 ASSIGN  (resid 41   and name C   ) (resid 42   and name N   )
         (resid 42   and name CA  ) (resid 42   and name C   )  1.00 -116.62 33.38 2

 ASSIGN  (resid 42   and name N   ) (resid 42   and name CA  )
         (resid 42   and name C   ) (resid 43   and name N   )  1.00 127.19 27.19 2

 ASSIGN  (resid 42   and name C   ) (resid 43   and name N   )
         (resid 43   and name CA  ) (resid 43   and name C   )  1.00 -107.85 42.15 2

 ASSIGN  (resid 43   and name N   ) (resid 43   and name CA  )
         (resid 43   and name C   ) (resid 44   and name N   )  1.00 132.86 32.86 2

 ASSIGN  (resid 43   and name C   ) (resid 44   and name N   )
         (resid 44   and name CA  ) (resid 44   and name C   )  1.00 -134.84 45.16 2

 ASSIGN  (resid 44   and name N   ) (resid 44   and name CA  )
         (resid 44   and name C   ) (resid 45   and name N   )  1.00 143.28 43.28 2

 ASSIGN  (resid 44   and name C   ) (resid 45   and name N   )
         (resid 45   and name CA  ) (resid 45   and name C   )  1.00 -107.44 52.56 2

 ASSIGN  (resid 45   and name N   ) (resid 45   and name CA  )
         (resid 45   and name C   ) (resid 46   and name N   )  1.00 134.36 34.36 2

 ASSIGN  (resid 45   and name C   ) (resid 46   and name N   )
         (resid 46   and name CA  ) (resid 46   and name C   )  1.00 -108.05 41.95 2

 ASSIGN  (resid 46   and name N   ) (resid 46   and name CA  )
         (resid 46   and name C   ) (resid 47   and name N   )  1.00 127.12 27.12 2

 ASSIGN  (resid 46   and name C   ) (resid 47   and name N   )
         (resid 47   and name CA  ) (resid 47   and name C   )  1.00 -128.50 41.50 2

 ASSIGN  (resid 47   and name N   ) (resid 47   and name CA  )
         (resid 47   and name C   ) (resid 48   and name N   )  1.00 148.06 38.06 2

 ASSIGN  (resid 47   and name C   ) (resid 48   and name N   )
         (resid 48   and name CA  ) (resid 48   and name C   )  1.00 -121.87 38.13 2

 ASSIGN  (resid 48   and name N   ) (resid 48   and name CA  )
         (resid 48   and name C   ) (resid 49   and name N   )  1.00 137.32 37.32 2

 ASSIGN  (resid 48   and name C   ) (resid 49   and name N   )
         (resid 49   and name CA  ) (resid 49   and name C   )  1.00 -132.58 37.42 2

 ASSIGN  (resid 49   and name N   ) (resid 49   and name CA  )
         (resid 49   and name C   ) (resid 50   and name N   )  1.00 162.34 62.34 2

 ASSIGN  (resid 49   and name C   ) (resid 50   and name N   )
         (resid 50   and name CA  ) (resid 50   and name C   )  1.00 -61.27 28.73 2

 ASSIGN  (resid 50   and name N   ) (resid 50   and name CA  )
         (resid 50   and name C   ) (resid 51   and name N   )  1.00 -27.08 32.92 2

 ASSIGN  (resid 50   and name C   ) (resid 51   and name N   )
         (resid 51   and name CA  ) (resid 51   and name C   )  1.00 -64.94 25.06 2

 ASSIGN  (resid 51   and name N   ) (resid 51   and name CA  )
         (resid 51   and name C   ) (resid 52   and name N   )  1.00 -24.84 25.16 2

 ASSIGN  (resid 51   and name C   ) (resid 52   and name N   )
         (resid 52   and name CA  ) (resid 52   and name C   )  1.00 -95.75 34.25 2

 ASSIGN  (resid 52   and name N   ) (resid 52   and name CA  )
         (resid 52   and name C   ) (resid 53   and name N   )  1.00   4.43 24.43 2

 ASSIGN  (resid 52   and name C   ) (resid 53   and name N   )
         (resid 53   and name CA  ) (resid 53   and name C   )  1.00  55.00 15.00 2

 ASSIGN  (resid 53   and name N   ) (resid 53   and name CA  )
         (resid 53   and name C   ) (resid 54   and name N   )  1.00  44.80 34.80 2

 ASSIGN  (resid 53   and name C   ) (resid 54   and name N   )
         (resid 54   and name CA  ) (resid 54   and name C   )  1.00 -85.97 54.03 2

 ASSIGN  (resid 54   and name N   ) (resid 54   and name CA  )
         (resid 54   and name C   ) (resid 55   and name N   )  1.00 125.37 35.37 2

 ASSIGN  (resid 54   and name C   ) (resid 55   and name N   )
         (resid 55   and name CA  ) (resid 55   and name C   )  1.00 -117.10 32.90 2

 ASSIGN  (resid 55   and name N   ) (resid 55   and name CA  )
         (resid 55   and name C   ) (resid 56   and name N   )  1.00 126.96 26.96 2

 ASSIGN  (resid 55   and name C   ) (resid 56   and name N   )
         (resid 56   and name CA  ) (resid 56   and name C   )  1.00 -115.54 34.46 2

 ASSIGN  (resid 56   and name N   ) (resid 56   and name CA  )
         (resid 56   and name C   ) (resid 57   and name N   )  1.00 124.66 24.66 2

 ASSIGN  (resid 56   and name C   ) (resid 57   and name N   )
         (resid 57   and name CA  ) (resid 57   and name C   )  1.00 -112.83 27.17 2

 ASSIGN  (resid 57   and name N   ) (resid 57   and name CA  )
         (resid 57   and name C   ) (resid 58   and name N   )  1.00 125.78 25.78 2

 ASSIGN  (resid 57   and name C   ) (resid 58   and name N   )
         (resid 58   and name CA  ) (resid 58   and name C   )  1.00 -122.33 27.67 2

 ASSIGN  (resid 58   and name N   ) (resid 58   and name CA  )
         (resid 58   and name C   ) (resid 59   and name N   )  1.00 125.25 25.25 2

 ASSIGN  (resid 58   and name C   ) (resid 59   and name N   )
         (resid 59   and name CA  ) (resid 59   and name C   )  1.00 -107.31 42.69 2

 ASSIGN  (resid 59   and name N   ) (resid 59   and name CA  )
         (resid 59   and name C   ) (resid 60   and name N   )  1.00 121.36 31.36 2

 ASSIGN  (resid 59   and name C   ) (resid 60   and name N   )
         (resid 60   and name CA  ) (resid 60   and name C   )  1.00 -150.41 -320.41 2

 ASSIGN  (resid 60   and name N   ) (resid 60   and name CA  )
         (resid 60   and name C   ) (resid 61   and name N   )  1.00 168.16 58.16 2

 ASSIGN  (resid 62   and name C   ) (resid 63   and name N   )
         (resid 63   and name CA  ) (resid 63   and name C   )  1.00 -85.07 44.93 2

 ASSIGN  (resid 63   and name N   ) (resid 63   and name CA  )
         (resid 63   and name C   ) (resid 64   and name N   )  1.00  -5.22 34.78 2

 ASSIGN  (resid 65   and name C   ) (resid 66   and name N   )
         (resid 66   and name CA  ) (resid 66   and name C   )  1.00 -85.17 44.83 2

 ASSIGN  (resid 66   and name N   ) (resid 66   and name CA  )
         (resid 66   and name C   ) (resid 67   and name N   )  1.00  -3.93 36.07 2

 ASSIGN  (resid 70   and name C   ) (resid 71   and name N   )
         (resid 71   and name CA  ) (resid 71   and name C   )  1.00 -76.74 53.26 2

 ASSIGN  (resid 71   and name N   ) (resid 71   and name CA  )
         (resid 71   and name C   ) (resid 72   and name N   )  1.00 -19.61 40.39 2

 ASSIGN  (resid 71   and name C   ) (resid 72   and name N   )
         (resid 72   and name CA  ) (resid 72   and name C   )  1.00 -74.00 36.00 2

 ASSIGN  (resid 72   and name N   ) (resid 72   and name CA  )
         (resid 72   and name C   ) (resid 73   and name N   )  1.00 153.41 33.41 2

 ASSIGN  (resid 72   and name C   ) (resid 73   and name N   )
         (resid 73   and name CA  ) (resid 73   and name C   )  1.00 -64.64 25.36 2

 ASSIGN  (resid 73   and name N   ) (resid 73   and name CA  )
         (resid 73   and name C   ) (resid 74   and name N   )  1.00 153.16 33.16 2

 ASSIGN  (resid 74   and name C   ) (resid 75   and name N   )
         (resid 75   and name CA  ) (resid 75   and name C   )  1.00 -74.16 25.84 2

 ASSIGN  (resid 75   and name N   ) (resid 75   and name CA  )
         (resid 75   and name C   ) (resid 76   and name N   )  1.00 144.29 34.29 2

 ASSIGN  (resid 75   and name C   ) (resid 76   and name N   )
         (resid 76   and name CA  ) (resid 76   and name C   )  1.00 -66.38 33.62 2

 ASSIGN  (resid 76   and name N   ) (resid 76   and name CA  )
         (resid 76   and name C   ) (resid 77   and name N   )  1.00 140.86 40.86 2

 ASSIGN  (resid 76   and name C   ) (resid 77   and name N   )
         (resid 77   and name CA  ) (resid 77   and name C   )  1.00 -60.23 39.77 2

 ASSIGN  (resid 77   and name N   ) (resid 77   and name CA  )
         (resid 77   and name C   ) (resid 78   and name N   )  1.00 140.24 30.24 2

 ASSIGN  (resid 77   and name C   ) (resid 78   and name N   )
         (resid 78   and name CA  ) (resid 78   and name C   )  1.00  83.96 33.96 2

 ASSIGN  (resid 78   and name N   ) (resid 78   and name CA  )
         (resid 78   and name C   ) (resid 79   and name N   )  1.00  -2.52 27.48 2

 ASSIGN  (resid 78   and name C   ) (resid 79   and name N   )
         (resid 79   and name CA  ) (resid 79   and name C   )  1.00 -80.79 69.21 2

 ASSIGN  (resid 79   and name N   ) (resid 79   and name CA  )
         (resid 79   and name C   ) (resid 80   and name N   )  1.00 138.42 38.42 2

 ASSIGN  (resid 79   and name C   ) (resid 80   and name N   )
         (resid 80   and name CA  ) (resid 80   and name C   )  1.00 -133.86 36.14 2

 ASSIGN  (resid 80   and name N   ) (resid 80   and name CA  )
         (resid 80   and name C   ) (resid 81   and name N   )  1.00 132.48 32.48 2

 ASSIGN  (resid 80   and name C   ) (resid 81   and name N   )
         (resid 81   and name CA  ) (resid 81   and name C   )  1.00 -107.22 42.78 2

 ASSIGN  (resid 81   and name N   ) (resid 81   and name CA  )
         (resid 81   and name C   ) (resid 82   and name N   )  1.00 125.72 25.72 2

 ASSIGN  (resid 81   and name C   ) (resid 82   and name N   )
         (resid 82   and name CA  ) (resid 82   and name C   )  1.00 -130.66 29.34 2

 ASSIGN  (resid 82   and name N   ) (resid 82   and name CA  )
         (resid 82   and name C   ) (resid 83   and name N   )  1.00 154.91 34.91 2

 ASSIGN  (resid 82   and name C   ) (resid 83   and name N   )
         (resid 83   and name CA  ) (resid 83   and name C   )  1.00 -117.08 32.92 2

 ASSIGN  (resid 83   and name N   ) (resid 83   and name CA  )
         (resid 83   and name C   ) (resid 84   and name N   )  1.00 134.34 34.34 2

 ASSIGN  (resid 84   and name C   ) (resid 85   and name N   )
         (resid 85   and name CA  ) (resid 85   and name C   )  1.00 -63.92 26.08 2

 ASSIGN  (resid 85   and name N   ) (resid 85   and name CA  )
         (resid 85   and name C   ) (resid 86   and name N   )  1.00 -16.67 33.33 2

 ASSIGN  (resid 85   and name C   ) (resid 86   and name N   )
         (resid 86   and name CA  ) (resid 86   and name C   )  1.00 -87.30 32.70 2

 ASSIGN  (resid 86   and name N   ) (resid 86   and name CA  )
         (resid 86   and name C   ) (resid 87   and name N   )  1.00   0.19 20.19 2

 ASSIGN  (resid 86   and name C   ) (resid 87   and name N   )
         (resid 87   and name CA  ) (resid 87   and name C   )  1.00  85.15 25.15 2

 ASSIGN  (resid 87   and name N   ) (resid 87   and name CA  )
         (resid 87   and name C   ) (resid 88   and name N   )  1.00  13.71 33.71 2

 ASSIGN  (resid 87   and name C   ) (resid 88   and name N   )
         (resid 88   and name CA  ) (resid 88   and name C   )  1.00 -70.56 49.44 2

 ASSIGN  (resid 88   and name N   ) (resid 88   and name CA  )
         (resid 88   and name C   ) (resid 89   and name N   )  1.00 137.48 47.48 2

 ASSIGN  (resid 88   and name C   ) (resid 89   and name N   )
         (resid 89   and name CA  ) (resid 89   and name C   )  1.00 -94.74 25.26 2

 ASSIGN  (resid 89   and name N   ) (resid 89   and name CA  )
         (resid 89   and name C   ) (resid 90   and name N   )  1.00 134.99 34.99 2

 ASSIGN  (resid 89   and name C   ) (resid 90   and name N   )
         (resid 90   and name CA  ) (resid 90   and name C   )  1.00 -144.80 25.20 2

 ASSIGN  (resid 90   and name N   ) (resid 90   and name CA  )
         (resid 90   and name C   ) (resid 91   and name N   )  1.00 163.85 33.85 2

 ASSIGN  (resid 90   and name C   ) (resid 91   and name N   )
         (resid 91   and name CA  ) (resid 91   and name C   )  1.00 -115.15 34.85 2

 ASSIGN  (resid 91   and name N   ) (resid 91   and name CA  )
         (resid 91   and name C   ) (resid 92   and name N   )  1.00 134.96 34.96 2

 ASSIGN  (resid 91   and name C   ) (resid 92   and name N   )
         (resid 92   and name CA  ) (resid 92   and name C   )  1.00 -123.21 46.79 2

 ASSIGN  (resid 92   and name N   ) (resid 92   and name CA  )
         (resid 92   and name C   ) (resid 93   and name N   )  1.00 131.73 41.73 2

 ASSIGN  (resid 92   and name C   ) (resid 93   and name N   )
         (resid 93   and name CA  ) (resid 93   and name C   )  1.00 -104.60 35.40 2

 ASSIGN  (resid 93   and name N   ) (resid 93   and name CA  )
         (resid 93   and name C   ) (resid 94   and name N   )  1.00 115.06 35.06 2

 ASSIGN  (resid 93   and name C   ) (resid 94   and name N   )
         (resid 94   and name CA  ) (resid 94   and name C   )  1.00 -58.99 31.01 2

 ASSIGN  (resid 94   and name N   ) (resid 94   and name CA  )
         (resid 94   and name C   ) (resid 95   and name N   )  1.00 -21.94 28.06 2

 ASSIGN  (resid 94   and name C   ) (resid 95   and name N   )
         (resid 95   and name CA  ) (resid 95   and name C   )  1.00 -65.05 34.95 2

 ASSIGN  (resid 95   and name N   ) (resid 95   and name CA  )
         (resid 95   and name C   ) (resid 96   and name N   )  1.00 -25.05 24.95 2

 ASSIGN  (resid 95   and name C   ) (resid 96   and name N   )
         (resid 96   and name CA  ) (resid 96   and name C   )  1.00 -90.87 29.13 2

 ASSIGN  (resid 96   and name N   ) (resid 96   and name CA  )
         (resid 96   and name C   ) (resid 97   and name N   )  1.00  -4.82 25.18 2

 ASSIGN  (resid 96   and name C   ) (resid 97   and name N   )
         (resid 97   and name CA  ) (resid 97   and name C   )  1.00  55.00 15.00 2

 ASSIGN  (resid 97   and name N   ) (resid 97   and name CA  )
         (resid 97   and name C   ) (resid 98   and name N   )  1.00  43.02 33.02 2

 ASSIGN  (resid 97   and name C   ) (resid 98   and name N   )
         (resid 98   and name CA  ) (resid 98   and name C   )  1.00 -123.54 36.46 2

 ASSIGN  (resid 98   and name N   ) (resid 98   and name CA  )
         (resid 98   and name C   ) (resid 99   and name N   )  1.00 148.81 48.81 2

 ASSIGN  (resid 98   and name C   ) (resid 99   and name N   )
         (resid 99   and name CA  ) (resid 99   and name C   )  1.00 -115.01 34.99 2

 ASSIGN  (resid 99   and name N   ) (resid 99   and name CA  )
         (resid 99   and name C   ) (resid 100  and name N   )  1.00 125.06 25.06 2

 ASSIGN  (resid 99   and name C   ) (resid 100  and name N   )
         (resid 100  and name CA  ) (resid 100  and name C   )  1.00 -114.16 35.84 2

 ASSIGN  (resid 100  and name N   ) (resid 100  and name CA  )
         (resid 100  and name C   ) (resid 101  and name N   )  1.00 124.02 34.02 2

 ASSIGN  (resid 100  and name C   ) (resid 101  and name N   )
         (resid 101  and name CA  ) (resid 101  and name C   )  1.00 -85.85 44.15 2

 ASSIGN  (resid 101  and name N   ) (resid 101  and name CA  )
         (resid 101  and name C   ) (resid 102  and name N   )  1.00 125.40 25.40 2

 ASSIGN  (resid 101  and name C   ) (resid 102  and name N   )
         (resid 102  and name CA  ) (resid 102  and name C   )  1.00 -99.52 40.48 2

 ASSIGN  (resid 102  and name N   ) (resid 102  and name CA  )
         (resid 102  and name C   ) (resid 103  and name N   )  1.00 122.91 32.91 2

 ASSIGN  (resid 102  and name C   ) (resid 103  and name N   )
         (resid 103  and name CA  ) (resid 103  and name C   )  1.00 -80.61 39.39 2

 ASSIGN  (resid 103  and name N   ) (resid 103  and name CA  )
         (resid 103  and name C   ) (resid 104  and name N   )  1.00 126.12 26.12 2

 ASSIGN  (resid 103  and name C   ) (resid 104  and name N   )
         (resid 104  and name CA  ) (resid 104  and name C   )  1.00 -64.49 25.51 2

 ASSIGN  (resid 104  and name N   ) (resid 104  and name CA  )
         (resid 104  and name C   ) (resid 105  and name N   )  1.00 -15.61 34.39 2

 ASSIGN  (resid 104  and name C   ) (resid 105  and name N   )
         (resid 105  and name CA  ) (resid 105  and name C   )  1.00 -83.19 26.81 2

 ASSIGN  (resid 105  and name N   ) (resid 105  and name CA  )
         (resid 105  and name C   ) (resid 106  and name N   )  1.00 154.66 44.66 2

 ASSIGN  (resid 105  and name C   ) (resid 106  and name N   )
         (resid 106  and name CA  ) (resid 106  and name C   )  1.00 -55.00 25.00 2

 ASSIGN  (resid 106  and name N   ) (resid 106  and name CA  )
         (resid 106  and name C   ) (resid 107  and name N   )  1.00 135.00 15.00 2

 ASSIGN  (resid 106  and name C   ) (resid 107  and name N   )
         (resid 107  and name CA  ) (resid 107  and name C   )  1.00  93.95 43.95 2

 ASSIGN  (resid 107  and name N   ) (resid 107  and name CA  )
         (resid 107  and name C   ) (resid 108  and name N   )  1.00 -13.95 26.05 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1 -39.414   4.687  -4.190
    2    H2   GLY   1           HT2      GLY   1 -41.008   4.179  -4.431
    3    H3   GLY   1           HT3      GLY   1 -40.379   4.262  -2.859
    4    HA2  GLY   1           HA1      GLY   1 -40.962   6.520  -4.690
    5    HA3  GLY   1           HA2      GLY   1 -41.806   6.132  -3.200
    6    H    SER   2           HN       SER   2 -40.696   6.439  -1.182
    7    HA   SER   2           HA       SER   2 -39.005   8.771  -1.281
    8    HB2  SER   2           HB2      SER   2 -39.156   8.441   1.291
    9    HB3  SER   2           HB1      SER   2 -40.626   8.879   0.415
   10    HG   SER   2           HG       SER   2 -39.923   6.492   1.673
   11    H    HIS   3           HN       HIS   3 -38.600   5.384  -1.018
   12    HA   HIS   3           HA       HIS   3 -36.010   5.504   0.249
   13    HB2  HIS   3           HB2      HIS   3 -37.924   3.450  -0.463
   14    HB3  HIS   3           HB1      HIS   3 -36.301   2.996  -0.960
   15    HD1  HIS   3           HD1      HIS   3 -36.441   1.103   0.911
   16    HD2  HIS   3           HD2      HIS   3 -36.477   5.026   2.311
   17    HE1  HIS   3           HE1      HIS   3 -35.947   0.951   3.369
   18    HE2  HIS   3           HE2      HIS   3 -36.118   3.320   4.228
   19    H    MET   4           HN       MET   4 -34.004   5.516  -0.826
   20    HA   MET   4           HA       MET   4 -34.107   5.341  -3.759
   21    HB2  MET   4           HB2      MET   4 -32.205   6.958  -3.787
   22    HB3  MET   4           HB1      MET   4 -33.685   7.630  -3.134
   23    HG2  MET   4           HG2      MET   4 -32.812   7.258  -0.862
   24    HG3  MET   4           HG1      MET   4 -31.299   6.692  -1.569
   25    HE1  MET   4           HE1      MET   4 -33.613   9.600  -2.903
   26    HE2  MET   4           HE2      MET   4 -32.916  10.990  -2.070
   27    HE3  MET   4           HE3      MET   4 -33.745   9.736  -1.148
   28    H    GLN   5           HN       GLN   5 -32.565   4.114  -4.773
   29    HA   GLN   5           HA       GLN   5 -31.270   2.110  -3.203
   30    HB2  GLN   5           HB2      GLN   5 -32.253   1.572  -5.364
   31    HB3  GLN   5           HB1      GLN   5 -31.187   2.711  -6.163
   32    HG2  GLN   5           HG2      GLN   5 -29.251   1.329  -5.421
   33    HG3  GLN   5           HG1      GLN   5 -30.405   0.146  -4.813
   34   HE21  GLN   5          HE21      GLN   5 -29.044   1.643  -7.645
   35   HE22  GLN   5          HE22      GLN   5 -29.626   0.445  -8.790
   36    H    TYR   6           HN       TYR   6 -29.154   1.746  -2.850
   37    HA   TYR   6           HA       TYR   6 -27.167   3.606  -3.935
   38    HB2  TYR   6           HB2      TYR   6 -27.630   2.909  -1.040
   39    HB3  TYR   6           HB1      TYR   6 -25.996   3.288  -1.570
   40    HD1  TYR   6           HD1      TYR   6 -25.447   5.554  -2.330
   41    HD2  TYR   6           HD2      TYR   6 -29.330   4.611  -0.865
   42    HE1  TYR   6           HE1      TYR   6 -25.924   7.951  -2.069
   43    HE2  TYR   6           HE2      TYR   6 -29.814   7.006  -0.596
   44    HH   TYR   6           HH       TYR   6 -28.773   9.088  -0.428
   45    H    LYS   7           HN       LYS   7 -25.164   2.638  -4.384
   46    HA   LYS   7           HA       LYS   7 -25.223  -0.302  -4.271
   47    HB2  LYS   7           HB2      LYS   7 -23.315   1.297  -5.960
   48    HB3  LYS   7           HB1      LYS   7 -23.836  -0.383  -6.203
   49    HG2  LYS   7           HG2      LYS   7 -26.106   0.586  -6.761
   50    HG3  LYS   7           HG1      LYS   7 -25.307   2.164  -6.792
   51    HD2  LYS   7           HD2      LYS   7 -23.765   1.379  -8.494
   52    HD3  LYS   7           HD1      LYS   7 -24.503  -0.222  -8.444
   53    HE2  LYS   7           HE2      LYS   7 -26.656   0.821  -9.124
   54    HE3  LYS   7           HE1      LYS   7 -25.804   2.348  -9.318
   55    HZ1  LYS   7           HZ1      LYS   7 -24.489   1.443 -11.057
   56    HZ2  LYS   7           HZ2      LYS   7 -26.099   1.036 -11.400
   57    HZ3  LYS   7           HZ3      LYS   7 -25.051  -0.129 -10.759
   58    H    LEU   8           HN       LEU   8 -23.185  -1.395  -4.075
   59    HA   LEU   8           HA       LEU   8 -20.971   0.124  -2.929
   60    HB2  LEU   8           HB2      LEU   8 -22.395  -0.756  -1.016
   61    HB3  LEU   8           HB1      LEU   8 -22.016  -2.361  -1.584
   62    HG   LEU   8           HG       LEU   8 -19.594  -1.851  -1.208
   63   HD11  LEU   8          HD11      LEU   8 -19.205   0.008   0.509
   64   HD12  LEU   8          HD12      LEU   8 -20.747   0.671  -0.028
   65   HD13  LEU   8          HD13      LEU   8 -19.416   0.494  -1.170
   66   HD21  LEU   8          HD21      LEU   8 -21.576  -1.825   1.028
   67   HD22  LEU   8          HD22      LEU   8 -19.840  -2.022   1.283
   68   HD23  LEU   8          HD23      LEU   8 -20.731  -3.206   0.327
   69    H    ILE   9           HN       ILE   9 -18.997  -0.728  -3.402
   70    HA   ILE   9           HA       ILE   9 -18.946  -3.375  -4.692
   71    HB   ILE   9           HB       ILE   9 -17.336  -0.969  -5.619
   72   HG12  ILE   9          HG12      ILE   9 -19.486  -2.537  -7.108
   73   HG13  ILE   9          HG11      ILE   9 -19.775  -0.942  -6.324
   74   HG21  ILE   9          HG21      ILE   9 -17.361  -3.841  -6.552
   75   HG22  ILE   9          HG22      ILE   9 -16.012  -2.966  -5.821
   76   HG23  ILE   9          HG23      ILE   9 -16.590  -2.520  -7.427
   77   HD11  ILE   9          HD11      ILE   9 -19.416  -0.731  -8.734
   78   HD12  ILE   9          HD12      ILE   9 -17.836  -1.503  -8.580
   79   HD13  ILE   9          HD13      ILE   9 -18.126   0.064  -7.827
   80    H    LEU  10           HN       LEU  10 -17.587  -4.697  -3.628
   81    HA   LEU  10           HA       LEU  10 -15.689  -3.451  -1.775
   82    HB2  LEU  10           HB2      LEU  10 -16.439  -6.374  -1.865
   83    HB3  LEU  10           HB1      LEU  10 -15.449  -5.590  -0.663
   84    HG   LEU  10           HG       LEU  10 -17.408  -5.855   0.478
   85   HD11  LEU  10          HD11      LEU  10 -18.498  -3.777   0.771
   86   HD12  LEU  10          HD12      LEU  10 -17.932  -3.210  -0.801
   87   HD13  LEU  10          HD13      LEU  10 -16.774  -3.503   0.507
   88   HD21  LEU  10          HD21      LEU  10 -19.612  -5.824  -0.390
   89   HD22  LEU  10          HD22      LEU  10 -18.626  -6.726  -1.542
   90   HD23  LEU  10          HD23      LEU  10 -19.081  -5.058  -1.885
   91    H    ASN  11           HN       ASN  11 -14.020  -2.905  -3.081
   92    HA   ASN  11           HA       ASN  11 -12.912  -4.943  -4.843
   93    HB2  ASN  11           HB2      ASN  11 -11.589  -2.280  -4.228
   94    HB3  ASN  11           HB1      ASN  11 -11.390  -3.288  -5.644
   95   HD21  ASN  11          HD21      ASN  11 -11.766  -1.706  -7.067
   96   HD22  ASN  11          HD22      ASN  11 -13.298  -0.946  -7.280
   97    H    GLY  12           HN       GLY  12 -12.321  -6.471  -3.307
   98    HA2  GLY  12           HA2      GLY  12  -9.941  -5.695  -1.733
   99    HA3  GLY  12           HA1      GLY  12 -11.106  -6.898  -1.150
  100    H    LYS  13           HN       LYS  13  -8.794  -7.894  -1.056
  101    HA   LYS  13           HA       LYS  13  -8.141  -9.154  -3.585
  102    HB2  LYS  13           HB2      LYS  13  -6.718  -9.409  -0.921
  103    HB3  LYS  13           HB1      LYS  13  -6.124  -9.979  -2.477
  104    HG2  LYS  13           HG2      LYS  13  -6.180  -7.631  -3.291
  105    HG3  LYS  13           HG1      LYS  13  -6.627  -7.122  -1.663
  106    HD2  LYS  13           HD2      LYS  13  -4.531  -8.121  -0.817
  107    HD3  LYS  13           HD1      LYS  13  -4.080  -8.513  -2.475
  108    HE2  LYS  13           HE2      LYS  13  -2.966  -6.488  -1.915
  109    HE3  LYS  13           HE1      LYS  13  -4.285  -6.061  -3.011
  110    HZ1  LYS  13           HZ1      LYS  13  -4.356  -4.495  -1.281
  111    HZ2  LYS  13           HZ2      LYS  13  -4.122  -5.656  -0.079
  112    HZ3  LYS  13           HZ3      LYS  13  -5.601  -5.583  -0.902
  113    H    THR  14           HN       THR  14  -8.870 -10.449  -0.267
  114    HA   THR  14           HA       THR  14  -9.622 -12.954  -1.599
  115    HB   THR  14           HB       THR  14  -8.075 -12.898   0.482
  116    HG1  THR  14           HG1      THR  14 -10.367 -14.544   0.183
  117   HG21  THR  14          HG21      THR  14 -10.762 -12.455   1.795
  118   HG22  THR  14          HG22      THR  14  -9.300 -11.492   2.008
  119   HG23  THR  14          HG23      THR  14  -9.374 -13.134   2.637
  120    H    LEU  15           HN       LEU  15 -11.075 -10.222  -1.119
  121    HA   LEU  15           HA       LEU  15 -13.701 -11.381  -0.655
  122    HB2  LEU  15           HB2      LEU  15 -12.443 -10.040   1.364
  123    HB3  LEU  15           HB1      LEU  15 -13.292  -8.735   0.580
  124    HG   LEU  15           HG       LEU  15 -14.652  -9.487   2.367
  125   HD11  LEU  15          HD11      LEU  15 -15.881  -8.965   0.374
  126   HD12  LEU  15          HD12      LEU  15 -16.662 -10.300   1.224
  127   HD13  LEU  15          HD13      LEU  15 -15.687 -10.613  -0.212
  128   HD21  LEU  15          HD21      LEU  15 -15.176 -11.701   2.881
  129   HD22  LEU  15          HD22      LEU  15 -13.461 -11.752   2.457
  130   HD23  LEU  15          HD23      LEU  15 -14.675 -12.288   1.298
  131    H    LYS  16           HN       LYS  16 -14.453 -11.020  -2.671
  132    HA   LYS  16           HA       LYS  16 -14.508  -8.231  -3.579
  133    HB2  LYS  16           HB2      LYS  16 -13.867 -10.595  -5.352
  134    HB3  LYS  16           HB1      LYS  16 -14.017  -8.935  -5.879
  135    HG2  LYS  16           HG2      LYS  16 -12.026  -8.319  -4.918
  136    HG3  LYS  16           HG1      LYS  16 -11.985  -9.693  -3.809
  137    HD2  LYS  16           HD2      LYS  16 -11.551  -9.648  -6.770
  138    HD3  LYS  16           HD1      LYS  16 -10.352  -9.980  -5.528
  139    HE2  LYS  16           HE2      LYS  16 -11.313 -12.068  -4.996
  140    HE3  LYS  16           HE1      LYS  16 -12.799 -11.690  -5.864
  141    HZ1  LYS  16           HZ1      LYS  16 -11.288 -13.274  -7.020
  142    HZ2  LYS  16           HZ2      LYS  16 -10.169 -12.010  -7.209
  143    HZ3  LYS  16           HZ3      LYS  16 -11.697 -11.905  -7.928
  144    H    GLY  17           HN       GLY  17 -16.442  -7.615  -4.312
  145    HA2  GLY  17           HA2      GLY  17 -18.357  -9.167  -5.573
  146    HA3  GLY  17           HA1      GLY  17 -18.706  -9.252  -3.849
  147    H    GLU  18           HN       GLU  18 -20.677  -8.175  -5.140
  148    HA   GLU  18           HA       GLU  18 -20.462  -5.319  -4.524
  149    HB2  GLU  18           HB2      GLU  18 -21.755  -6.447  -7.032
  150    HB3  GLU  18           HB1      GLU  18 -21.824  -4.767  -6.524
  151    HG2  GLU  18           HG2      GLU  18 -19.475  -4.497  -6.839
  152    HG3  GLU  18           HG1      GLU  18 -19.265  -6.220  -7.128
  153    H    THR  19           HN       THR  19 -22.583  -4.344  -4.095
  154    HA   THR  19           HA       THR  19 -24.832  -6.113  -3.749
  155    HB   THR  19           HB       THR  19 -23.452  -6.589  -1.725
  156    HG1  THR  19           HG1      THR  19 -25.314  -6.900  -0.802
  157   HG21  THR  19          HG21      THR  19 -23.363  -4.841   0.048
  158   HG22  THR  19          HG22      THR  19 -24.025  -3.678  -1.102
  159   HG23  THR  19          HG23      THR  19 -22.435  -4.385  -1.385
  160    H    THR  20           HN       THR  20 -26.613  -4.822  -2.472
  161    HA   THR  20           HA       THR  20 -26.521  -1.982  -3.150
  162    HB   THR  20           HB       THR  20 -28.886  -2.260  -4.127
  163    HG1  THR  20           HG1      THR  20 -28.598  -4.724  -3.514
  164   HG21  THR  20          HG21      THR  20 -27.993  -2.850  -6.412
  165   HG22  THR  20          HG22      THR  20 -26.440  -3.189  -5.647
  166   HG23  THR  20          HG23      THR  20 -27.118  -1.560  -5.590
  167    H    THR  21           HN       THR  21 -28.062  -0.717  -1.988
  168    HA   THR  21           HA       THR  21 -29.709  -2.124  -0.043
  169    HB   THR  21           HB       THR  21 -27.436  -1.626   1.086
  170    HG1  THR  21           HG1      THR  21 -28.544  -1.259   2.991
  171   HG21  THR  21          HG21      THR  21 -28.624   1.177   1.008
  172   HG22  THR  21          HG22      THR  21 -27.085   0.690   0.294
  173   HG23  THR  21          HG23      THR  21 -27.283   0.691   2.048
  174    H    GLU  22           HN       GLU  22 -31.256  -0.701   1.007
  175    HA   GLU  22           HA       GLU  22 -31.869   1.637  -0.681
  176    HB2  GLU  22           HB2      GLU  22 -34.289   1.143   0.068
  177    HB3  GLU  22           HB1      GLU  22 -33.584   0.043  -1.107
  178    HG2  GLU  22           HG2      GLU  22 -33.093  -1.552   0.684
  179    HG3  GLU  22           HG1      GLU  22 -33.834  -0.422   1.869
  180    H    ALA  23           HN       ALA  23 -32.106   3.573   0.328
  181    HA   ALA  23           HA       ALA  23 -32.711   3.713   3.187
  182    HB1  ALA  23           HB1      ALA  23 -30.054   4.747   2.153
  183    HB2  ALA  23           HB2      ALA  23 -30.263   3.299   3.133
  184    HB3  ALA  23           HB3      ALA  23 -30.656   4.880   3.805
  185    H    VAL  24           HN       VAL  24 -32.968   6.063   3.869
  186    HA   VAL  24           HA       VAL  24 -33.747   7.715   1.588
  187    HB   VAL  24           HB       VAL  24 -34.893   9.129   3.312
  188   HG11  VAL  24          HG11      VAL  24 -36.704   7.517   3.740
  189   HG12  VAL  24          HG12      VAL  24 -35.638   6.210   3.231
  190   HG13  VAL  24          HG13      VAL  24 -36.130   7.446   2.074
  191   HG21  VAL  24          HG21      VAL  24 -33.971   6.919   5.141
  192   HG22  VAL  24          HG22      VAL  24 -35.237   8.071   5.556
  193   HG23  VAL  24          HG23      VAL  24 -33.589   8.634   5.269
  194    H    ASP  25           HN       ASP  25 -31.013   7.386   3.389
  195    HA   ASP  25           HA       ASP  25 -30.313  10.215   3.056
  196    HB2  ASP  25           HB2      ASP  25 -29.300   8.602   5.400
  197    HB3  ASP  25           HB1      ASP  25 -29.127  10.326   5.120
  198    H    ALA  26           HN       ALA  26 -28.022  10.551   2.716
  199    HA   ALA  26           HA       ALA  26 -26.759   8.322   1.395
  200    HB1  ALA  26           HB1      ALA  26 -26.575  10.595   0.475
  201    HB2  ALA  26           HB2      ALA  26 -24.989   9.914   0.836
  202    HB3  ALA  26           HB3      ALA  26 -25.705  11.108   1.920
  203    H    ALA  27           HN       ALA  27 -26.253  10.250   4.307
  204    HA   ALA  27           HA       ALA  27 -23.886   9.045   5.191
  205    HB1  ALA  27           HB1      ALA  27 -24.512   9.920   7.422
  206    HB2  ALA  27           HB2      ALA  27 -26.102  10.337   6.781
  207    HB3  ALA  27           HB3      ALA  27 -24.659  11.123   6.142
  208    H    THR  28           HN       THR  28 -27.269   8.178   5.704
  209    HA   THR  28           HA       THR  28 -26.795   6.079   7.545
  210    HB   THR  28           HB       THR  28 -29.135   6.234   5.627
  211    HG1  THR  28           HG1      THR  28 -30.022   7.736   6.917
  212   HG21  THR  28          HG21      THR  28 -30.333   5.104   7.466
  213   HG22  THR  28          HG22      THR  28 -28.839   5.061   8.403
  214   HG23  THR  28          HG23      THR  28 -28.964   4.144   6.900
  215    H    ALA  29           HN       ALA  29 -26.639   6.262   4.056
  216    HA   ALA  29           HA       ALA  29 -26.828   3.433   3.572
  217    HB1  ALA  29           HB1      ALA  29 -26.031   4.012   1.309
  218    HB2  ALA  29           HB2      ALA  29 -25.774   5.673   1.846
  219    HB3  ALA  29           HB3      ALA  29 -27.403   5.003   1.805
  220    H    GLU  30           HN       GLU  30 -24.368   5.807   4.132
  221    HA   GLU  30           HA       GLU  30 -22.085   4.244   3.636
  222    HB2  GLU  30           HB2      GLU  30 -22.316   6.804   4.035
  223    HB3  GLU  30           HB1      GLU  30 -22.306   6.374   5.736
  224    HG2  GLU  30           HG2      GLU  30 -20.137   5.091   5.160
  225    HG3  GLU  30           HG1      GLU  30 -20.113   6.160   3.758
  226    H    LYS  31           HN       LYS  31 -23.527   5.242   6.708
  227    HA   LYS  31           HA       LYS  31 -22.059   3.744   8.434
  228    HB2  LYS  31           HB2      LYS  31 -24.903   4.653   8.684
  229    HB3  LYS  31           HB1      LYS  31 -23.970   3.981  10.018
  230    HG2  LYS  31           HG2      LYS  31 -23.297   6.467   8.446
  231    HG3  LYS  31           HG1      LYS  31 -23.949   6.407  10.086
  232    HD2  LYS  31           HD2      LYS  31 -21.940   5.296  10.875
  233    HD3  LYS  31           HD1      LYS  31 -21.298   5.242   9.232
  234    HE2  LYS  31           HE2      LYS  31 -21.976   7.789  10.686
  235    HE3  LYS  31           HE1      LYS  31 -20.369   7.070  10.688
  236    HZ1  LYS  31           HZ1      LYS  31 -20.306   7.299   8.265
  237    HZ2  LYS  31           HZ2      LYS  31 -20.551   8.798   9.021
  238    HZ3  LYS  31           HZ3      LYS  31 -21.851   8.005   8.288
  239    H    VAL  32           HN       VAL  32 -25.052   2.673   6.840
  240    HA   VAL  32           HA       VAL  32 -25.225   0.205   8.220
  241    HB   VAL  32           HB       VAL  32 -26.350   1.047   5.545
  242   HG11  VAL  32          HG11      VAL  32 -26.133  -1.394   5.630
  243   HG12  VAL  32          HG12      VAL  32 -27.824  -0.888   5.695
  244   HG13  VAL  32          HG13      VAL  32 -27.003  -1.410   7.164
  245   HG21  VAL  32          HG21      VAL  32 -27.621   0.762   8.265
  246   HG22  VAL  32          HG22      VAL  32 -28.449   1.226   6.777
  247   HG23  VAL  32          HG23      VAL  32 -27.217   2.284   7.468
  248    H    PHE  33           HN       PHE  33 -23.766   1.090   5.119
  249    HA   PHE  33           HA       PHE  33 -22.982  -1.591   4.507
  250    HB2  PHE  33           HB2      PHE  33 -22.487   1.076   3.286
  251    HB3  PHE  33           HB1      PHE  33 -21.387  -0.220   2.890
  252    HD1  PHE  33           HD1      PHE  33 -23.602  -2.405   3.046
  253    HD2  PHE  33           HD2      PHE  33 -23.305   1.350   1.072
  254    HE1  PHE  33           HE1      PHE  33 -25.133  -3.209   1.299
  255    HE2  PHE  33           HE2      PHE  33 -24.831   0.551  -0.688
  256    HZ   PHE  33           HZ       PHE  33 -25.753  -1.731  -0.577
  257    H    LYS  34           HN       LYS  34 -21.564   0.932   6.432
  258    HA   LYS  34           HA       LYS  34 -18.873   0.067   6.228
  259    HB2  LYS  34           HB2      LYS  34 -20.236   1.551   8.490
  260    HB3  LYS  34           HB1      LYS  34 -18.514   1.426   8.295
  261    HG2  LYS  34           HG2      LYS  34 -19.158   2.477   5.936
  262    HG3  LYS  34           HG1      LYS  34 -20.379   3.200   7.000
  263    HD2  LYS  34           HD2      LYS  34 -18.505   4.585   7.148
  264    HD3  LYS  34           HD1      LYS  34 -18.495   3.655   8.621
  265    HE2  LYS  34           HE2      LYS  34 -16.845   2.140   7.643
  266    HE3  LYS  34           HE1      LYS  34 -16.855   3.089   6.153
  267    HZ1  LYS  34           HZ1      LYS  34 -16.140   5.024   7.515
  268    HZ2  LYS  34           HZ2      LYS  34 -14.992   3.780   7.431
  269    HZ3  LYS  34           HZ3      LYS  34 -15.932   3.980   8.831
  270    H    GLN  35           HN       GLN  35 -21.535  -0.656   8.410
  271    HA   GLN  35           HA       GLN  35 -20.126  -2.477  10.068
  272    HB2  GLN  35           HB2      GLN  35 -22.291  -1.360  10.653
  273    HB3  GLN  35           HB1      GLN  35 -23.098  -2.389   9.483
  274    HG2  GLN  35           HG2      GLN  35 -23.446  -3.294  11.658
  275    HG3  GLN  35           HG1      GLN  35 -22.351  -4.364  10.781
  276   HE21  GLN  35          HE21      GLN  35 -20.262  -4.617  11.494
  277   HE22  GLN  35          HE22      GLN  35 -19.685  -3.949  12.983
  278    H    TYR  36           HN       TYR  36 -21.771  -2.691   7.023
  279    HA   TYR  36           HA       TYR  36 -21.926  -5.519   6.832
  280    HB2  TYR  36           HB2      TYR  36 -23.369  -4.222   5.429
  281    HB3  TYR  36           HB1      TYR  36 -22.029  -3.262   4.826
  282    HD1  TYR  36           HD1      TYR  36 -23.635  -6.541   4.691
  283    HD2  TYR  36           HD2      TYR  36 -20.731  -3.985   2.947
  284    HE1  TYR  36           HE1      TYR  36 -23.467  -8.074   2.780
  285    HE2  TYR  36           HE2      TYR  36 -20.562  -5.487   1.003
  286    HH   TYR  36           HH       TYR  36 -20.986  -7.815   0.433
  287    H    ALA  37           HN       ALA  37 -19.676  -3.108   5.503
  288    HA   ALA  37           HA       ALA  37 -17.922  -4.988   4.289
  289    HB1  ALA  37           HB1      ALA  37 -18.079  -2.632   3.599
  290    HB2  ALA  37           HB2      ALA  37 -16.422  -3.080   4.009
  291    HB3  ALA  37           HB3      ALA  37 -17.389  -2.136   5.143
  292    H    ASN  38           HN       ASN  38 -18.079  -3.410   7.416
  293    HA   ASN  38           HA       ASN  38 -15.618  -3.927   8.541
  294    HB2  ASN  38           HB2      ASN  38 -17.250  -2.628   9.780
  295    HB3  ASN  38           HB1      ASN  38 -18.370  -3.987   9.833
  296   HD21  ASN  38          HD21      ASN  38 -18.077  -5.621  11.344
  297   HD22  ASN  38          HD22      ASN  38 -16.902  -5.497  12.673
  298    H    ASP  39           HN       ASP  39 -18.439  -6.091   8.622
  299    HA   ASP  39           HA       ASP  39 -17.067  -8.139  10.039
  300    HB2  ASP  39           HB2      ASP  39 -19.699  -8.033   8.590
  301    HB3  ASP  39           HB1      ASP  39 -19.108  -9.520   9.326
  302    H    ASN  40           HN       ASN  40 -16.768  -7.165   6.885
  303    HA   ASN  40           HA       ASN  40 -15.931  -9.844   6.027
  304    HB2  ASN  40           HB2      ASN  40 -16.806  -7.397   4.506
  305    HB3  ASN  40           HB1      ASN  40 -15.893  -8.677   3.727
  306   HD21  ASN  40          HD21      ASN  40 -18.955  -7.714   5.022
  307   HD22  ASN  40          HD22      ASN  40 -19.842  -9.178   4.551
  308    H    GLY  41           HN       GLY  41 -14.674  -7.295   7.511
  309    HA2  GLY  41           HA2      GLY  41 -12.521  -6.620   7.883
  310    HA3  GLY  41           HA1      GLY  41 -12.002  -7.958   6.869
  311    H    VAL  42           HN       VAL  42 -14.182  -5.577   5.550
  312    HA   VAL  42           HA       VAL  42 -11.950  -4.623   3.919
  313    HB   VAL  42           HB       VAL  42 -14.889  -4.731   3.214
  314   HG11  VAL  42          HG11      VAL  42 -14.109  -4.066   0.961
  315   HG12  VAL  42          HG12      VAL  42 -12.474  -3.879   1.603
  316   HG13  VAL  42          HG13      VAL  42 -13.774  -2.835   2.179
  317   HG21  VAL  42          HG21      VAL  42 -12.534  -6.395   2.322
  318   HG22  VAL  42          HG22      VAL  42 -14.121  -6.416   1.547
  319   HG23  VAL  42          HG23      VAL  42 -13.952  -6.940   3.225
  320    H    ASP  43           HN       ASP  43 -11.315  -2.697   4.325
  321    HA   ASP  43           HA       ASP  43 -13.208  -0.517   4.560
  322    HB2  ASP  43           HB2      ASP  43 -12.561  -1.260   6.942
  323    HB3  ASP  43           HB1      ASP  43 -10.940  -0.685   6.560
  324    H    GLY  44           HN       GLY  44 -12.275   1.436   3.749
  325    HA2  GLY  44           HA2      GLY  44  -9.567   1.609   2.983
  326    HA3  GLY  44           HA1      GLY  44 -10.523   1.016   1.633
  327    H    GLU  45           HN       GLU  45  -9.579   3.146   0.796
  328    HA   GLU  45           HA       GLU  45 -10.619   5.623   1.641
  329    HB2  GLU  45           HB2      GLU  45  -8.694   5.349   0.082
  330    HB3  GLU  45           HB1      GLU  45  -9.806   4.798  -1.162
  331    HG2  GLU  45           HG2      GLU  45 -10.887   6.948  -1.222
  332    HG3  GLU  45           HG1      GLU  45  -9.931   7.505   0.149
  333    H    TRP  46           HN       TRP  46 -12.753   5.878   1.909
  334    HA   TRP  46           HA       TRP  46 -14.680   4.546   0.335
  335    HB2  TRP  46           HB2      TRP  46 -14.561   6.311   2.700
  336    HB3  TRP  46           HB1      TRP  46 -16.046   6.336   1.794
  337    HD1  TRP  46           HD1      TRP  46 -13.728   3.797   3.523
  338    HE1  TRP  46           HE1      TRP  46 -15.131   1.832   4.391
  339    HE3  TRP  46           HE3      TRP  46 -18.337   5.182   1.736
  340    HZ2  TRP  46           HZ2      TRP  46 -17.787   0.979   4.340
  341    HZ3  TRP  46           HZ3      TRP  46 -20.259   3.719   2.215
  342    HH2  TRP  46           HH2      TRP  46 -19.979   1.658   3.488
  343    H    THR  47           HN       THR  47 -14.782   5.171  -1.719
  344    HA   THR  47           HA       THR  47 -14.876   8.026  -2.365
  345    HB   THR  47           HB       THR  47 -14.713   7.119  -4.772
  346    HG1  THR  47           HG1      THR  47 -13.588   4.845  -3.504
  347   HG21  THR  47          HG21      THR  47 -12.868   8.256  -3.694
  348   HG22  THR  47          HG22      THR  47 -12.251   6.860  -4.579
  349   HG23  THR  47          HG23      THR  47 -12.430   6.783  -2.825
  350    H    TYR  48           HN       TYR  48 -16.525   8.750  -3.946
  351    HA   TYR  48           HA       TYR  48 -18.882   7.088  -4.140
  352    HB2  TYR  48           HB2      TYR  48 -19.326   7.983  -1.974
  353    HB3  TYR  48           HB1      TYR  48 -18.924   9.611  -2.460
  354    HD1  TYR  48           HD1      TYR  48 -20.639  11.041  -3.467
  355    HD2  TYR  48           HD2      TYR  48 -21.388   6.885  -2.831
  356    HE1  TYR  48           HE1      TYR  48 -23.005  11.388  -3.963
  357    HE2  TYR  48           HE2      TYR  48 -23.768   7.242  -3.334
  358    HH   TYR  48           HH       TYR  48 -24.937  10.157  -4.696
  359    H    ASP  49           HN       ASP  49 -20.315   7.731  -5.739
  360    HA   ASP  49           HA       ASP  49 -19.530  10.156  -7.260
  361    HB2  ASP  49           HB2      ASP  49 -18.861   7.960  -8.440
  362    HB3  ASP  49           HB1      ASP  49 -20.585   7.647  -8.614
  363    H    ASP  50           HN       ASP  50 -21.278  11.471  -7.822
  364    HA   ASP  50           HA       ASP  50 -23.718  10.849  -6.321
  365    HB2  ASP  50           HB2      ASP  50 -24.283  13.197  -6.614
  366    HB3  ASP  50           HB1      ASP  50 -22.531  13.190  -6.360
  367    H    ALA  51           HN       ALA  51 -22.630  10.529  -9.544
  368    HA   ALA  51           HA       ALA  51 -25.157  10.996 -10.802
  369    HB1  ALA  51           HB1      ALA  51 -24.133  10.130 -12.810
  370    HB2  ALA  51           HB2      ALA  51 -22.774   9.499 -11.882
  371    HB3  ALA  51           HB3      ALA  51 -23.027  11.240 -12.004
  372    H    THR  52           HN       THR  52 -23.494   8.114  -9.592
  373    HA   THR  52           HA       THR  52 -25.838   6.538 -10.422
  374    HB   THR  52           HB       THR  52 -24.217   4.571 -10.170
  375    HG1  THR  52           HG1      THR  52 -22.135   6.362 -10.717
  376   HG21  THR  52          HG21      THR  52 -23.302   4.915 -12.420
  377   HG22  THR  52          HG22      THR  52 -23.711   6.628 -12.333
  378   HG23  THR  52          HG23      THR  52 -24.992   5.413 -12.345
  379    H    LYS  53           HN       LYS  53 -24.536   7.837  -7.652
  380    HA   LYS  53           HA       LYS  53 -24.824   7.444  -5.397
  381    HB2  LYS  53           HB2      LYS  53 -27.060   5.763  -6.528
  382    HB3  LYS  53           HB1      LYS  53 -26.749   5.837  -4.805
  383    HG2  LYS  53           HG2      LYS  53 -28.536   7.341  -5.411
  384    HG3  LYS  53           HG1      LYS  53 -27.149   8.247  -4.818
  385    HD2  LYS  53           HD2      LYS  53 -26.520   8.813  -7.104
  386    HD3  LYS  53           HD1      LYS  53 -27.861   7.848  -7.727
  387    HE2  LYS  53           HE2      LYS  53 -28.160  10.248  -5.925
  388    HE3  LYS  53           HE1      LYS  53 -28.335  10.276  -7.680
  389    HZ1  LYS  53           HZ1      LYS  53 -30.478  10.098  -6.638
  390    HZ2  LYS  53           HZ2      LYS  53 -30.004   8.725  -5.776
  391    HZ3  LYS  53           HZ3      LYS  53 -30.143   8.656  -7.462
  392    H    THR  54           HN       THR  54 -22.836   6.025  -6.712
  393    HA   THR  54           HA       THR  54 -22.945   3.308  -5.627
  394    HB   THR  54           HB       THR  54 -20.896   4.431  -7.556
  395    HG1  THR  54           HG1      THR  54 -22.628   4.512  -8.826
  396   HG21  THR  54          HG21      THR  54 -20.233   2.214  -7.925
  397   HG22  THR  54          HG22      THR  54 -21.772   1.563  -7.377
  398   HG23  THR  54          HG23      THR  54 -20.612   2.182  -6.199
  399    H    TYR  55           HN       TYR  55 -22.080   3.118  -3.634
  400    HA   TYR  55           HA       TYR  55 -19.849   4.828  -2.821
  401    HB2  TYR  55           HB2      TYR  55 -21.599   2.863  -1.348
  402    HB3  TYR  55           HB1      TYR  55 -20.011   3.236  -0.708
  403    HD1  TYR  55           HD1      TYR  55 -23.368   4.588  -1.416
  404    HD2  TYR  55           HD2      TYR  55 -19.537   5.348   0.285
  405    HE1  TYR  55           HE1      TYR  55 -24.275   6.571  -0.275
  406    HE2  TYR  55           HE2      TYR  55 -20.430   7.335   1.425
  407    HH   TYR  55           HH       TYR  55 -23.696   7.926   1.798
  408    H    THR  56           HN       THR  56 -17.778   4.202  -3.002
  409    HA   THR  56           HA       THR  56 -17.287   1.383  -3.719
  410    HB   THR  56           HB       THR  56 -15.714   3.786  -4.691
  411    HG1  THR  56           HG1      THR  56 -18.046   3.240  -5.454
  412   HG21  THR  56          HG21      THR  56 -14.408   1.707  -4.603
  413   HG22  THR  56          HG22      THR  56 -14.730   2.178  -6.272
  414   HG23  THR  56          HG23      THR  56 -15.659   0.878  -5.525
  415    H    VAL  57           HN       VAL  57 -16.081   0.325  -2.303
  416    HA   VAL  57           HA       VAL  57 -14.243   1.883  -0.625
  417    HB   VAL  57           HB       VAL  57 -16.061   0.967   0.791
  418   HG11  VAL  57          HG11      VAL  57 -16.154  -1.487   1.235
  419   HG12  VAL  57          HG12      VAL  57 -15.132  -1.736  -0.175
  420   HG13  VAL  57          HG13      VAL  57 -16.739  -1.031  -0.361
  421   HG21  VAL  57          HG21      VAL  57 -14.647  -0.119   2.464
  422   HG22  VAL  57          HG22      VAL  57 -13.857   1.283   1.740
  423   HG23  VAL  57          HG23      VAL  57 -13.390  -0.344   1.245
  424    H    THR  58           HN       THR  58 -12.299   1.625  -1.387
  425    HA   THR  58           HA       THR  58 -11.594  -0.909  -2.678
  426    HB   THR  58           HB       THR  58  -9.853   1.531  -2.777
  427    HG1  THR  58           HG1      THR  58 -12.439   1.333  -3.679
  428   HG21  THR  58          HG21      THR  58 -10.567  -0.521  -4.880
  429   HG22  THR  58          HG22      THR  58  -9.181  -0.665  -3.798
  430   HG23  THR  58          HG23      THR  58  -9.267   0.671  -4.948
  431    H    GLU  59           HN       GLU  59 -10.248  -2.274  -1.728
  432    HA   GLU  59           HA       GLU  59  -9.235  -1.689   0.900
  433    HB2  GLU  59           HB2      GLU  59 -10.211  -3.910   0.095
  434    HB3  GLU  59           HB1      GLU  59  -8.713  -4.130  -0.795
  435    HG2  GLU  59           HG2      GLU  59  -8.603  -3.689   2.144
  436    HG3  GLU  59           HG1      GLU  59  -9.072  -5.257   1.508
  437    H    GLY  60           HN       GLY  60  -7.637  -0.043   0.537
  438    HA2  GLY  60           HA2      GLY  60  -5.063  -0.429   0.572
  439    HA3  GLY  60           HA1      GLY  60  -5.331  -0.784  -1.133
  440    H    SER  61           HN       SER  61  -3.652   1.198  -0.675
  441    HA   SER  61           HA       SER  61  -5.259   3.613  -1.202
  442    HB2  SER  61           HB2      SER  61  -4.143   3.682   1.029
  443    HB3  SER  61           HB1      SER  61  -2.585   3.524   0.222
  444    HG   SER  61           HG       SER  61  -3.837   5.516  -0.962
  445    H    GLY  62           HN       GLY  62  -2.478   1.655  -1.979
  446    HA2  GLY  62           HA2      GLY  62  -2.392   2.775  -4.626
  447    HA3  GLY  62           HA1      GLY  62  -0.989   3.203  -3.653
  448    H    GLY  63           HN       GLY  63  -0.146   1.928  -5.668
  449    HA2  GLY  63           HA2      GLY  63   0.051  -0.919  -4.883
  450    HA3  GLY  63           HA1      GLY  63  -0.006  -0.402  -6.564
  451    H    ALA  64           HN       ALA  64   1.645   1.987  -5.816
  452    HA   ALA  64           HA       ALA  64   3.803   2.658  -5.750
  453    HB1  ALA  64           HB1      ALA  64   5.451   1.364  -4.505
  454    HB2  ALA  64           HB2      ALA  64   4.353  -0.015  -4.461
  455    HB3  ALA  64           HB3      ALA  64   3.932   1.475  -3.617
  456    H    GLY  65           HN       GLY  65   6.165   1.698  -6.343
  457    HA2  GLY  65           HA2      GLY  65   6.087   1.225  -9.108
  458    HA3  GLY  65           HA1      GLY  65   7.503   1.048  -8.083
  459    H    GLY  66           HN       GLY  66   6.184  -0.550 -10.355
  460    HA2  GLY  66           HA2      GLY  66   5.640  -3.097  -9.068
  461    HA3  GLY  66           HA1      GLY  66   5.578  -2.762 -10.792
  462    H    GLN  67           HN       GLN  67   8.383  -1.506 -10.369
  463    HA   GLN  67           HA       GLN  67   9.951  -3.913  -9.916
  464    HB2  GLN  67           HB2      GLN  67   9.353  -3.971 -12.333
  465    HB3  GLN  67           HB1      GLN  67  10.114  -2.372 -12.535
  466    HG2  GLN  67           HG2      GLN  67  11.542  -4.261 -13.264
  467    HG3  GLN  67           HG1      GLN  67  12.272  -3.276 -11.998
  468   HE21  GLN  67          HE21      GLN  67  10.845  -6.361 -12.773
  469   HE22  GLN  67          HE22      GLN  67  11.381  -7.176 -11.338
  470    H    GLY  68           HN       GLY  68  11.990  -3.499  -9.228
  471    HA2  GLY  68           HA2      GLY  68  13.761  -1.570  -9.430
  472    HA3  GLY  68           HA1      GLY  68  12.543  -0.723  -8.479
  473    H    MET  69           HN       MET  69  13.710  -4.068  -8.395
  474    HA   MET  69           HA       MET  69  13.745  -3.986  -5.500
  475    HB2  MET  69           HB2      MET  69  14.665  -6.317  -7.196
  476    HB3  MET  69           HB1      MET  69  14.115  -6.334  -5.528
  477    HG2  MET  69           HG2      MET  69  12.396  -5.714  -7.917
  478    HG3  MET  69           HG1      MET  69  12.446  -7.248  -7.051
  479    HE1  MET  69           HE1      MET  69   9.750  -5.508  -7.598
  480    HE2  MET  69           HE2      MET  69   8.957  -5.777  -6.047
  481    HE3  MET  69           HE3      MET  69   9.812  -7.099  -6.841
  482    H    ILE  70           HN       ILE  70  15.408  -2.280  -5.571
  483    HA   ILE  70           HA       ILE  70  17.500  -1.512  -5.186
  484    HB   ILE  70           HB       ILE  70  17.927  -4.360  -4.232
  485   HG12  ILE  70          HG12      ILE  70  17.099  -1.869  -2.715
  486   HG13  ILE  70          HG11      ILE  70  16.019  -3.176  -3.188
  487   HG21  ILE  70          HG21      ILE  70  19.728  -3.440  -2.813
  488   HG22  ILE  70          HG22      ILE  70  19.488  -1.846  -3.516
  489   HG23  ILE  70          HG23      ILE  70  20.088  -3.169  -4.521
  490   HD11  ILE  70          HD11      ILE  70  17.283  -4.717  -1.761
  491   HD12  ILE  70          HD12      ILE  70  16.636  -3.354  -0.846
  492   HD13  ILE  70          HD13      ILE  70  18.344  -3.390  -1.287
  493    H    GLN  71           HN       GLN  71  18.017  -1.175  -7.443
  494    HA   GLN  71           HA       GLN  71  20.047  -3.090  -8.408
  495    HB2  GLN  71           HB2      GLN  71  17.761  -3.100  -9.619
  496    HB3  GLN  71           HB1      GLN  71  18.244  -1.546 -10.267
  497    HG2  GLN  71           HG2      GLN  71  18.690  -3.291 -11.850
  498    HG3  GLN  71           HG1      GLN  71  20.207  -2.583 -11.296
  499   HE21  GLN  71          HE21      GLN  71  18.336  -4.813  -9.363
  500   HE22  GLN  71          HE22      GLN  71  19.446  -6.136  -9.456
  501    H    GLU  72           HN       GLU  72  20.038  -0.469  -6.940
  502    HA   GLU  72           HA       GLU  72  21.595   1.121  -8.857
  503    HB2  GLU  72           HB2      GLU  72  20.209   2.074  -6.349
  504    HB3  GLU  72           HB1      GLU  72  21.027   3.075  -7.542
  505    HG2  GLU  72           HG2      GLU  72  19.381   2.205  -9.232
  506    HG3  GLU  72           HG1      GLU  72  18.486   1.513  -7.883
  507    HA   PRO  73           HA       PRO  73  25.191   0.578  -6.341
  508    HB2  PRO  73           HB2      PRO  73  26.508   2.936  -6.661
  509    HB3  PRO  73           HB1      PRO  73  26.331   1.735  -7.997
  510    HG2  PRO  73           HG2      PRO  73  24.739   4.235  -7.466
  511    HG3  PRO  73           HG1      PRO  73  25.394   3.627  -9.003
  512    HD2  PRO  73           HD2      PRO  73  22.796   3.305  -8.270
  513    HD3  PRO  73           HD1      PRO  73  23.681   2.116  -9.282
  514    H    ALA  74           HN       ALA  74  26.652   1.900  -4.786
  515    HA   ALA  74           HA       ALA  74  27.005   2.863  -2.785
  516    HB1  ALA  74           HB1      ALA  74  25.900   4.848  -3.745
  517    HB2  ALA  74           HB2      ALA  74  25.631   4.690  -2.009
  518    HB3  ALA  74           HB3      ALA  74  24.355   4.251  -3.143
  519    H    LEU  75           HN       LEU  75  25.778   3.177  -0.521
  520    HA   LEU  75           HA       LEU  75  24.575   0.567   0.001
  521    HB2  LEU  75           HB2      LEU  75  25.943   2.572   1.741
  522    HB3  LEU  75           HB1      LEU  75  24.929   1.353   2.445
  523    HG   LEU  75           HG       LEU  75  27.150   0.571   2.625
  524   HD11  LEU  75          HD11      LEU  75  25.541  -1.125   1.938
  525   HD12  LEU  75          HD12      LEU  75  27.139  -1.463   1.276
  526   HD13  LEU  75          HD13      LEU  75  25.883  -0.780   0.241
  527   HD21  LEU  75          HD21      LEU  75  27.460   1.177  -0.320
  528   HD22  LEU  75          HD22      LEU  75  28.653   0.370   0.693
  529   HD23  LEU  75          HD23      LEU  75  28.214   2.047   1.016
  530    HA   PRO  76           HA       PRO  76  20.649   2.566   0.595
  531    HB2  PRO  76           HB2      PRO  76  19.286   0.392   1.518
  532    HB3  PRO  76           HB1      PRO  76  19.662   0.634  -0.167
  533    HG2  PRO  76           HG2      PRO  76  20.894  -1.221   1.770
  534    HG3  PRO  76           HG1      PRO  76  20.751  -1.346  -0.018
  535    HD2  PRO  76           HD2      PRO  76  23.049  -0.586   1.454
  536    HD3  PRO  76           HD1      PRO  76  22.828  -0.428  -0.295
  537    HA   PRO  77           HA       PRO  77  20.344   4.028   4.750
  538    HB2  PRO  77           HB2      PRO  77  17.500   3.056   4.487
  539    HB3  PRO  77           HB1      PRO  77  18.078   4.580   5.180
  540    HG2  PRO  77           HG2      PRO  77  17.149   4.636   2.750
  541    HG3  PRO  77           HG1      PRO  77  18.706   5.422   3.083
  542    HD2  PRO  77           HD2      PRO  77  18.183   2.779   1.729
  543    HD3  PRO  77           HD1      PRO  77  19.397   4.054   1.340
  544    H    GLY  78           HN       GLY  78  20.854   3.168   6.663
  545    HA2  GLY  78           HA2      GLY  78  20.926   1.676   8.424
  546    HA3  GLY  78           HA1      GLY  78  19.658   0.753   7.646
  547    H    TRP  79           HN       TRP  79  22.191   1.001   5.414
  548    HA   TRP  79           HA       TRP  79  23.222  -1.626   6.289
  549    HB2  TRP  79           HB2      TRP  79  23.107  -0.291   3.592
  550    HB3  TRP  79           HB1      TRP  79  24.074  -1.724   3.882
  551    HD1  TRP  79           HD1      TRP  79  20.400  -0.568   3.992
  552    HE1  TRP  79           HE1      TRP  79  18.908  -2.571   3.415
  553    HE3  TRP  79           HE3      TRP  79  23.979  -4.198   3.875
  554    HZ2  TRP  79           HZ2      TRP  79  19.204  -5.370   3.054
  555    HZ3  TRP  79           HZ3      TRP  79  23.296  -6.518   3.440
  556    HH2  TRP  79           HH2      TRP  79  20.961  -7.095   3.040
  557    H    GLU  80           HN       GLU  80  25.426  -1.974   6.574
  558    HA   GLU  80           HA       GLU  80  27.215   0.285   5.976
  559    HB2  GLU  80           HB2      GLU  80  27.371  -1.613   8.338
  560    HB3  GLU  80           HB1      GLU  80  28.549  -0.365   7.977
  561    HG2  GLU  80           HG2      GLU  80  26.880   1.350   8.388
  562    HG3  GLU  80           HG1      GLU  80  25.663   0.109   8.687
  563    H    MET  81           HN       MET  81  29.018  -0.243   4.842
  564    HA   MET  81           HA       MET  81  29.540  -3.110   4.416
  565    HB2  MET  81           HB2      MET  81  28.857  -1.966   2.319
  566    HB3  MET  81           HB1      MET  81  30.228  -0.836   2.523
  567    HG2  MET  81           HG2      MET  81  31.782  -2.724   2.392
  568    HG3  MET  81           HG1      MET  81  30.427  -3.829   2.181
  569    HE1  MET  81           HE1      MET  81  32.530  -0.937   0.650
  570    HE2  MET  81           HE2      MET  81  30.921  -0.215   0.572
  571    HE3  MET  81           HE3      MET  81  31.760  -0.672  -0.914
  572    H    LYS  82           HN       LYS  82  31.275  -3.658   5.651
  573    HA   LYS  82           HA       LYS  82  33.497  -1.772   5.738
  574    HB2  LYS  82           HB2      LYS  82  32.478  -3.031   8.306
  575    HB3  LYS  82           HB1      LYS  82  33.742  -1.831   8.136
  576    HG2  LYS  82           HG2      LYS  82  32.067  -0.222   7.281
  577    HG3  LYS  82           HG1      LYS  82  30.809  -1.444   7.600
  578    HD2  LYS  82           HD2      LYS  82  32.662  -0.389   9.730
  579    HD3  LYS  82           HD1      LYS  82  31.090   0.325   9.367
  580    HE2  LYS  82           HE2      LYS  82  30.202  -2.084   9.691
  581    HE3  LYS  82           HE1      LYS  82  31.734  -2.358  10.517
  582    HZ1  LYS  82           HZ1      LYS  82  30.202  -1.744  12.168
  583    HZ2  LYS  82           HZ2      LYS  82  29.577  -0.462  11.244
  584    HZ3  LYS  82           HZ3      LYS  82  31.137  -0.349  11.907
  585    H    TYR  83           HN       TYR  83  35.524  -2.841   6.488
  586    HA   TYR  83           HA       TYR  83  35.458  -5.678   5.664
  587    HB2  TYR  83           HB2      TYR  83  37.538  -3.523   5.168
  588    HB3  TYR  83           HB1      TYR  83  37.904  -5.254   4.974
  589    HD1  TYR  83           HD1      TYR  83  37.952  -5.929   2.796
  590    HD2  TYR  83           HD2      TYR  83  35.141  -2.928   3.887
  591    HE1  TYR  83           HE1      TYR  83  37.166  -5.823   0.466
  592    HE2  TYR  83           HE2      TYR  83  34.347  -2.821   1.574
  593    HH   TYR  83           HH       TYR  83  35.187  -5.140  -0.777
  594    H    THR  84           HN       THR  84  36.885  -7.108   6.730
  595    HA   THR  84           HA       THR  84  37.439  -6.431   9.475
  596    HB   THR  84           HB       THR  84  38.079  -8.744   9.755
  597    HG1  THR  84           HG1      THR  84  38.234 -10.106   7.832
  598   HG21  THR  84          HG21      THR  84  35.798  -8.617   7.769
  599   HG22  THR  84          HG22      THR  84  35.669  -8.384   9.512
  600   HG23  THR  84          HG23      THR  84  36.137  -9.956   8.865
  601    H    SER  85           HN       SER  85  39.802  -7.233  10.255
  602    HA   SER  85           HA       SER  85  41.591  -5.369   9.026
  603    HB2  SER  85           HB2      SER  85  43.205  -6.308  10.783
  604    HB3  SER  85           HB1      SER  85  41.743  -5.516  11.370
  605    HG   SER  85           HG       SER  85  41.912  -7.410  12.488
  606    H    GLU  86           HN       GLU  86  40.745  -8.131   7.774
  607    HA   GLU  86           HA       GLU  86  43.484  -8.806   6.847
  608    HB2  GLU  86           HB2      GLU  86  41.107 -10.679   7.133
  609    HB3  GLU  86           HB1      GLU  86  42.691 -11.132   6.518
  610    HG2  GLU  86           HG2      GLU  86  43.649 -10.501   8.729
  611    HG3  GLU  86           HG1      GLU  86  42.005 -10.236   9.307
  612    H    GLY  87           HN       GLY  87  40.735  -7.274   6.038
  613    HA2  GLY  87           HA2      GLY  87  40.237  -6.397   3.923
  614    HA3  GLY  87           HA1      GLY  87  41.233  -7.649   3.198
  615    H    VAL  88           HN       VAL  88  39.003  -8.877   5.444
  616    HA   VAL  88           HA       VAL  88  37.497 -10.118   3.311
  617    HB   VAL  88           HB       VAL  88  37.211 -10.390   6.312
  618   HG11  VAL  88          HG11      VAL  88  35.121 -10.902   5.147
  619   HG12  VAL  88          HG12      VAL  88  35.845 -12.348   5.846
  620   HG13  VAL  88          HG13      VAL  88  35.979 -12.043   4.114
  621   HG21  VAL  88          HG21      VAL  88  38.304 -12.542   6.011
  622   HG22  VAL  88          HG22      VAL  88  39.341 -11.227   5.457
  623   HG23  VAL  88          HG23      VAL  88  38.479 -12.224   4.285
  624    H    ARG  89           HN       ARG  89  35.409  -9.708   2.775
  625    HA   ARG  89           HA       ARG  89  34.402  -7.091   3.581
  626    HB2  ARG  89           HB2      ARG  89  34.656  -7.773   1.175
  627    HB3  ARG  89           HB1      ARG  89  33.385  -8.953   1.427
  628    HG2  ARG  89           HG2      ARG  89  31.834  -7.127   1.990
  629    HG3  ARG  89           HG1      ARG  89  33.117  -5.963   1.647
  630    HD2  ARG  89           HD2      ARG  89  33.282  -6.913  -0.646
  631    HD3  ARG  89           HD1      ARG  89  31.889  -7.924  -0.287
  632    HE   ARG  89           HE       ARG  89  31.559  -5.048   0.020
  633   HH11  ARG  89          HH11      ARG  89  31.014  -7.934  -1.903
  634   HH12  ARG  89          HH12      ARG  89  29.766  -7.188  -2.857
  635   HH21  ARG  89          HH21      ARG  89  29.919  -4.087  -1.259
  636   HH22  ARG  89          HH22      ARG  89  29.135  -5.031  -2.496
  637    H    TYR  90           HN       TYR  90  32.792  -6.872   5.043
  638    HA   TYR  90           HA       TYR  90  30.764  -8.980   5.137
  639    HB2  TYR  90           HB2      TYR  90  30.693  -9.070   7.534
  640    HB3  TYR  90           HB1      TYR  90  32.348  -9.337   7.045
  641    HD1  TYR  90           HD1      TYR  90  34.037  -7.523   7.363
  642    HD2  TYR  90           HD2      TYR  90  30.106  -7.265   8.960
  643    HE1  TYR  90           HE1      TYR  90  34.773  -5.715   8.856
  644    HE2  TYR  90           HE2      TYR  90  30.828  -5.455  10.465
  645    HH   TYR  90           HH       TYR  90  32.810  -4.555  11.443
  646    H    PHE  91           HN       PHE  91  28.667  -8.208   6.061
  647    HA   PHE  91           HA       PHE  91  28.415  -5.291   5.738
  648    HB2  PHE  91           HB2      PHE  91  26.627  -7.499   4.768
  649    HB3  PHE  91           HB1      PHE  91  25.963  -5.920   5.137
  650    HD1  PHE  91           HD1      PHE  91  25.815  -4.378   3.402
  651    HD2  PHE  91           HD2      PHE  91  28.771  -7.437   3.235
  652    HE1  PHE  91           HE1      PHE  91  26.491  -3.605   1.169
  653    HE2  PHE  91           HE2      PHE  91  29.454  -6.662   1.005
  654    HZ   PHE  91           HZ       PHE  91  28.197  -4.696  -0.047
  655    H    VAL  92           HN       VAL  92  26.687  -4.310   6.985
  656    HA   VAL  92           HA       VAL  92  26.066  -5.832   9.428
  657    HB   VAL  92           HB       VAL  92  26.704  -2.886   9.291
  658   HG11  VAL  92          HG11      VAL  92  26.731  -2.997  11.729
  659   HG12  VAL  92          HG12      VAL  92  26.241  -4.691  11.652
  660   HG13  VAL  92          HG13      VAL  92  25.152  -3.428  11.072
  661   HG21  VAL  92          HG21      VAL  92  28.367  -5.167  10.336
  662   HG22  VAL  92          HG22      VAL  92  28.759  -3.455  10.496
  663   HG23  VAL  92          HG23      VAL  92  28.704  -4.200   8.899
  664    H    ASP  93           HN       ASP  93  23.924  -6.193   9.458
  665    HA   ASP  93           HA       ASP  93  22.038  -4.385   8.172
  666    HB2  ASP  93           HB2      ASP  93  21.797  -6.992   9.686
  667    HB3  ASP  93           HB1      ASP  93  20.411  -5.903   9.694
  668    H    HIS  94           HN       HIS  94  22.373  -2.384   9.253
  669    HA   HIS  94           HA       HIS  94  22.462  -2.198  12.101
  670    HB2  HIS  94           HB2      HIS  94  23.526  -0.589  10.458
  671    HB3  HIS  94           HB1      HIS  94  21.911   0.047  10.150
  672    HD1  HIS  94           HD1      HIS  94  21.587   2.162  11.396
  673    HD2  HIS  94           HD2      HIS  94  23.938  -0.526  13.517
  674    HE1  HIS  94           HE1      HIS  94  22.172   3.326  13.545
  675    HE2  HIS  94           HE2      HIS  94  23.802   1.776  14.684
  676    H    ASN  95           HN       ASN  95  19.963  -2.621   9.938
  677    HA   ASN  95           HA       ASN  95  17.907  -1.137  11.246
  678    HB2  ASN  95           HB2      ASN  95  16.363  -2.505   9.826
  679    HB3  ASN  95           HB1      ASN  95  17.641  -1.740   8.886
  680   HD21  ASN  95          HD21      ASN  95  19.174  -3.011   7.885
  681   HD22  ASN  95          HD22      ASN  95  19.056  -4.741   7.786
  682    H    THR  96           HN       THR  96  19.107  -4.445  11.426
  683    HA   THR  96           HA       THR  96  17.284  -4.933  13.684
  684    HB   THR  96           HB       THR  96  18.088  -7.394  13.210
  685    HG1  THR  96           HG1      THR  96  18.241  -6.454  10.556
  686   HG21  THR  96          HG21      THR  96  15.775  -6.565  12.954
  687   HG22  THR  96          HG22      THR  96  16.209  -7.712  11.689
  688   HG23  THR  96          HG23      THR  96  16.175  -5.983  11.336
  689    H    ARG  97           HN       ARG  97  20.384  -4.175  12.895
  690    HA   ARG  97           HA       ARG  97  22.386  -4.103  13.925
  691    HB2  ARG  97           HB2      ARG  97  20.717  -4.582  16.384
  692    HB3  ARG  97           HB1      ARG  97  22.446  -4.230  16.417
  693    HG2  ARG  97           HG2      ARG  97  21.866  -2.165  15.045
  694    HG3  ARG  97           HG1      ARG  97  20.192  -2.470  15.501
  695    HD2  ARG  97           HD2      ARG  97  20.960  -0.946  17.096
  696    HD3  ARG  97           HD1      ARG  97  21.051  -2.507  17.907
  697    HE   ARG  97           HE       ARG  97  23.533  -2.029  16.715
  698   HH11  ARG  97          HH11      ARG  97  21.521  -0.680  19.248
  699   HH12  ARG  97          HH12      ARG  97  22.862  -0.014  20.131
  700   HH21  ARG  97          HH21      ARG  97  25.312  -1.181  17.908
  701   HH22  ARG  97          HH22      ARG  97  25.005  -0.329  19.394
  702    H    THR  98           HN       THR  98  22.719  -5.941  12.630
  703    HA   THR  98           HA       THR  98  23.932  -8.061  14.205
  704    HB   THR  98           HB       THR  98  21.535  -8.808  13.718
  705    HG1  THR  98           HG1      THR  98  22.256 -10.897  12.949
  706   HG21  THR  98          HG21      THR  98  22.599  -8.927  10.890
  707   HG22  THR  98          HG22      THR  98  21.347  -7.827  11.467
  708   HG23  THR  98          HG23      THR  98  21.048  -9.568  11.429
  709    H    THR  99           HN       THR  99  25.233  -9.518  12.704
  710    HA   THR  99           HA       THR  99  26.304  -7.884  10.491
  711    HB   THR  99           HB       THR  99  28.271  -9.601  10.676
  712    HG1  THR  99           HG1      THR  99  27.209 -11.082  12.043
  713   HG21  THR  99          HG21      THR  99  29.284  -8.331  12.623
  714   HG22  THR  99          HG22      THR  99  27.711  -7.579  12.889
  715   HG23  THR  99          HG23      THR  99  28.590  -7.271  11.390
  716    H    THR 100           HN       THR 100  26.513  -8.795   8.391
  717    HA   THR 100           HA       THR 100  25.631 -11.542   7.997
  718    HB   THR 100           HB       THR 100  23.557 -10.117   7.956
  719    HG1  THR 100           HG1      THR 100  22.840 -10.984   5.873
  720   HG21  THR 100          HG21      THR 100  24.776  -8.985   5.430
  721   HG22  THR 100          HG22      THR 100  24.530  -8.102   6.936
  722   HG23  THR 100          HG23      THR 100  23.141  -8.684   6.017
  723    H    PHE 101           HN       PHE 101  26.552 -12.469   6.194
  724    HA   PHE 101           HA       PHE 101  28.459 -10.794   4.745
  725    HB2  PHE 101           HB2      PHE 101  28.160 -13.782   5.095
  726    HB3  PHE 101           HB1      PHE 101  29.204 -13.082   3.792
  727    HD1  PHE 101           HD1      PHE 101  31.355 -12.283   4.297
  728    HD2  PHE 101           HD2      PHE 101  28.686 -13.236   7.474
  729    HE1  PHE 101           HE1      PHE 101  33.204 -12.064   5.914
  730    HE2  PHE 101           HE2      PHE 101  30.529 -13.014   9.096
  731    HZ   PHE 101           HZ       PHE 101  32.790 -12.427   8.312
  732    H    LYS 102           HN       LYS 102  27.325  -9.737   3.178
  733    HA   LYS 102           HA       LYS 102  25.805 -11.393   1.295
  734    HB2  LYS 102           HB2      LYS 102  25.388  -8.574   2.248
  735    HB3  LYS 102           HB1      LYS 102  24.683  -9.148   0.748
  736    HG2  LYS 102           HG2      LYS 102  24.196 -10.304   3.485
  737    HG3  LYS 102           HG1      LYS 102  23.086  -9.274   2.575
  738    HD2  LYS 102           HD2      LYS 102  24.071 -11.992   1.704
  739    HD3  LYS 102           HD1      LYS 102  22.491 -11.659   2.414
  740    HE2  LYS 102           HE2      LYS 102  21.926 -10.227   0.528
  741    HE3  LYS 102           HE1      LYS 102  23.529 -10.481  -0.160
  742    HZ1  LYS 102           HZ1      LYS 102  21.525 -12.621   0.301
  743    HZ2  LYS 102           HZ2      LYS 102  23.036 -12.802  -0.446
  744    HZ3  LYS 102           HZ3      LYS 102  21.826 -11.885  -1.193
  745    H    ASP 103           HN       ASP 103  27.430 -11.845  -0.136
  746    HA   ASP 103           HA       ASP 103  28.565  -9.534  -1.562
  747    HB2  ASP 103           HB2      ASP 103  30.239 -10.907  -0.220
  748    HB3  ASP 103           HB1      ASP 103  29.894 -12.241  -1.320
  749    HA   PRO 104           HA       PRO 104  26.424 -11.139  -5.083
  750    HB2  PRO 104           HB2      PRO 104  28.604 -10.125  -6.792
  751    HB3  PRO 104           HB1      PRO 104  26.920  -9.608  -6.741
  752    HG2  PRO 104           HG2      PRO 104  28.980  -8.105  -5.811
  753    HG3  PRO 104           HG1      PRO 104  27.337  -7.998  -5.158
  754    HD2  PRO 104           HD2      PRO 104  29.759  -9.293  -4.031
  755    HD3  PRO 104           HD1      PRO 104  28.394  -8.530  -3.194
  756    H    ARG 105           HN       ARG 105  29.628 -12.097  -4.269
  757    HA   ARG 105           HA       ARG 105  29.615 -14.145  -6.378
  758    HB2  ARG 105           HB2      ARG 105  31.887 -13.435  -4.506
  759    HB3  ARG 105           HB1      ARG 105  31.971 -14.499  -5.902
  760    HG2  ARG 105           HG2      ARG 105  31.382 -11.541  -6.015
  761    HG3  ARG 105           HG1      ARG 105  32.956 -12.283  -6.330
  762    HD2  ARG 105           HD2      ARG 105  30.595 -13.249  -7.866
  763    HD3  ARG 105           HD1      ARG 105  31.279 -11.679  -8.279
  764    HE   ARG 105           HE       ARG 105  33.355 -13.582  -8.122
  765   HH11  ARG 105          HH11      ARG 105  30.593 -12.782 -10.159
  766   HH12  ARG 105          HH12      ARG 105  31.367 -13.325 -11.612
  767   HH21  ARG 105          HH21      ARG 105  34.354 -14.284 -10.013
  768   HH22  ARG 105          HH22      ARG 105  33.515 -14.184 -11.538
  769    HA   PRO 106           HA       PRO 106  28.262 -16.664  -2.857
  770    HB2  PRO 106           HB2      PRO 106  27.416 -18.834  -4.263
  771    HB3  PRO 106           HB1      PRO 106  26.436 -17.324  -4.129
  772    HG2  PRO 106           HG2      PRO 106  28.122 -18.335  -6.386
  773    HG3  PRO 106           HG1      PRO 106  26.592 -17.445  -6.426
  774    HD2  PRO 106           HD2      PRO 106  29.106 -16.347  -6.843
  775    HD3  PRO 106           HD1      PRO 106  27.635 -15.426  -6.379
  776    H    GLY 107           HN       GLY 107  29.488 -18.005  -1.632
  777    HA2  GLY 107           HA2      GLY 107  31.174 -19.461  -1.051
  778    HA3  GLY 107           HA1      GLY 107  31.158 -20.050  -2.729
  779    H    PHE 108           HN       PHE 108  31.652 -16.892  -3.191
  780    HA   PHE 108           HA       PHE 108  33.454 -15.504  -3.575
  781    HB2  PHE 108           HB2      PHE 108  33.949 -16.411  -1.074
  782    HB3  PHE 108           HB1      PHE 108  35.359 -17.110  -1.942
  783    HD1  PHE 108           HD1      PHE 108  37.145 -15.735  -2.680
  784    HD2  PHE 108           HD2      PHE 108  33.628 -13.970  -1.045
  785    HE1  PHE 108           HE1      PHE 108  38.291 -13.574  -2.552
  786    HE2  PHE 108           HE2      PHE 108  34.779 -11.799  -0.921
  787    HZ   PHE 108           HZ       PHE 108  37.124 -11.607  -1.631
  788    H    GLU 109           HN       GLU 109  32.786 -17.863  -5.035
  789    HA   GLU 109           HA       GLU 109  33.483 -19.303  -6.631
  790    HB2  GLU 109           HB2      GLU 109  34.925 -18.175  -8.398
  791    HB3  GLU 109           HB1      GLU 109  33.488 -17.281  -7.920
  792    HG2  GLU 109           HG2      GLU 109  34.879 -15.859  -6.483
  793    HG3  GLU 109           HG1      GLU 109  36.306 -16.748  -7.005
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1 -44.532   6.266  -0.407
    2    H2   GLY   1           HT2      GLY   1 -44.838   5.459   1.051
    3    H3   GLY   1           HT3      GLY   1 -44.133   4.626  -0.249
    4    HA2  GLY   1           HA1      GLY   1 -42.905   6.829   1.311
    5    HA3  GLY   1           HA2      GLY   1 -42.453   5.131   1.381
    6    H    SER   2           HN       SER   2 -40.448   6.828   0.864
    7    HA   SER   2           HA       SER   2 -39.819   6.212  -1.917
    8    HB2  SER   2           HB2      SER   2 -38.983   8.540  -2.295
    9    HB3  SER   2           HB1      SER   2 -40.732   8.449  -2.080
   10    HG   SER   2           HG       SER   2 -38.963   8.980   0.068
   11    H    HIS   3           HN       HIS   3 -38.165   4.870  -1.439
   12    HA   HIS   3           HA       HIS   3 -36.064   5.864   0.346
   13    HB2  HIS   3           HB2      HIS   3 -35.165   3.561   0.335
   14    HB3  HIS   3           HB1      HIS   3 -36.858   3.548   0.799
   15    HD1  HIS   3           HD1      HIS   3 -36.937   1.017   0.159
   16    HD2  HIS   3           HD2      HIS   3 -36.105   3.563  -3.031
   17    HE1  HIS   3           HE1      HIS   3 -37.261  -0.356  -1.921
   18    HE2  HIS   3           HE2      HIS   3 -36.509   1.135  -3.803
   19    H    MET   4           HN       MET   4 -33.784   5.450  -0.444
   20    HA   MET   4           HA       MET   4 -33.626   5.760  -3.362
   21    HB2  MET   4           HB2      MET   4 -31.543   7.093  -2.969
   22    HB3  MET   4           HB1      MET   4 -33.022   7.882  -2.437
   23    HG2  MET   4           HG2      MET   4 -32.507   7.072  -0.127
   24    HG3  MET   4           HG1      MET   4 -30.940   6.541  -0.735
   25    HE1  MET   4           HE1      MET   4 -33.303   9.565  -0.049
   26    HE2  MET   4           HE2      MET   4 -32.970   9.799  -1.765
   27    HE3  MET   4           HE3      MET   4 -32.337  10.942  -0.583
   28    H    GLN   5           HN       GLN   5 -32.275   4.394  -4.393
   29    HA   GLN   5           HA       GLN   5 -31.168   2.259  -2.764
   30    HB2  GLN   5           HB2      GLN   5 -32.686   1.761  -4.675
   31    HB3  GLN   5           HB1      GLN   5 -31.483   2.426  -5.768
   32    HG2  GLN   5           HG2      GLN   5 -29.905   0.677  -5.078
   33    HG3  GLN   5           HG1      GLN   5 -31.137   0.001  -4.015
   34   HE21  GLN   5          HE21      GLN   5 -30.122   0.459  -7.299
   35   HE22  GLN   5          HE22      GLN   5 -31.243  -0.681  -8.015
   36    H    TYR   6           HN       TYR   6 -29.087   1.813  -2.551
   37    HA   TYR   6           HA       TYR   6 -27.145   3.352  -4.158
   38    HB2  TYR   6           HB2      TYR   6 -27.089   2.724  -1.175
   39    HB3  TYR   6           HB1      TYR   6 -25.629   3.174  -2.044
   40    HD1  TYR   6           HD1      TYR   6 -25.221   5.471  -2.627
   41    HD2  TYR   6           HD2      TYR   6 -28.940   4.334  -0.901
   42    HE1  TYR   6           HE1      TYR   6 -25.747   7.839  -2.224
   43    HE2  TYR   6           HE2      TYR   6 -29.475   6.696  -0.496
   44    HH   TYR   6           HH       TYR   6 -28.416   8.806  -0.253
   45    H    LYS   7           HN       LYS   7 -25.206   2.233  -4.641
   46    HA   LYS   7           HA       LYS   7 -25.208  -0.609  -3.946
   47    HB2  LYS   7           HB2      LYS   7 -23.997  -1.018  -6.152
   48    HB3  LYS   7           HB1      LYS   7 -25.732  -0.669  -6.255
   49    HG2  LYS   7           HG2      LYS   7 -25.311   1.538  -7.004
   50    HG3  LYS   7           HG1      LYS   7 -23.587   1.389  -6.683
   51    HD2  LYS   7           HD2      LYS   7 -25.185  -0.138  -8.739
   52    HD3  LYS   7           HD1      LYS   7 -23.974   1.105  -9.055
   53    HE2  LYS   7           HE2      LYS   7 -22.223  -0.291  -8.182
   54    HE3  LYS   7           HE1      LYS   7 -23.391  -1.495  -7.640
   55    HZ1  LYS   7           HZ1      LYS   7 -22.394  -2.267  -9.635
   56    HZ2  LYS   7           HZ2      LYS   7 -22.703  -0.810 -10.451
   57    HZ3  LYS   7           HZ3      LYS   7 -23.987  -1.828 -10.016
   58    H    LEU   8           HN       LEU   8 -23.246  -1.597  -3.653
   59    HA   LEU   8           HA       LEU   8 -20.954   0.222  -3.236
   60    HB2  LEU   8           HB2      LEU   8 -22.078  -0.236  -1.046
   61    HB3  LEU   8           HB1      LEU   8 -21.930  -1.939  -1.363
   62    HG   LEU   8           HG       LEU   8 -19.376  -1.465  -1.459
   63   HD11  LEU   8          HD11      LEU   8 -20.345   0.872   0.181
   64   HD12  LEU   8          HD12      LEU   8 -19.523   0.966  -1.381
   65   HD13  LEU   8          HD13      LEU   8 -18.673   0.333   0.029
   66   HD21  LEU   8          HD21      LEU   8 -21.113  -1.618   0.958
   67   HD22  LEU   8          HD22      LEU   8 -19.354  -1.630   1.079
   68   HD23  LEU   8          HD23      LEU   8 -20.186  -2.894   0.171
   69    H    ILE   9           HN       ILE   9 -19.089  -0.531  -4.032
   70    HA   ILE   9           HA       ILE   9 -18.978  -3.360  -4.846
   71    HB   ILE   9           HB       ILE   9 -17.294  -1.071  -5.907
   72   HG12  ILE   9          HG12      ILE   9 -19.542  -2.486  -7.404
   73   HG13  ILE   9          HG11      ILE   9 -19.727  -0.913  -6.557
   74   HG21  ILE   9          HG21      ILE   9 -16.167  -3.152  -6.077
   75   HG22  ILE   9          HG22      ILE   9 -16.749  -2.686  -7.681
   76   HG23  ILE   9          HG23      ILE   9 -17.610  -3.919  -6.760
   77   HD11  ILE   9          HD11      ILE   9 -17.822  -1.487  -8.830
   78   HD12  ILE   9          HD12      ILE   9 -18.043   0.066  -8.024
   79   HD13  ILE   9          HD13      ILE   9 -19.363  -0.635  -8.961
   80    H    LEU  10           HN       LEU  10 -17.551  -4.639  -3.865
   81    HA   LEU  10           HA       LEU  10 -15.736  -3.358  -1.956
   82    HB2  LEU  10           HB2      LEU  10 -16.437  -6.281  -2.155
   83    HB3  LEU  10           HB1      LEU  10 -15.417  -5.548  -0.948
   84    HG   LEU  10           HG       LEU  10 -17.399  -5.962   0.162
   85   HD11  LEU  10          HD11      LEU  10 -17.683  -3.117  -0.689
   86   HD12  LEU  10          HD12      LEU  10 -16.588  -3.723   0.560
   87   HD13  LEU  10          HD13      LEU  10 -18.332  -3.869   0.766
   88   HD21  LEU  10          HD21      LEU  10 -19.615  -5.556  -0.615
   89   HD22  LEU  10          HD22      LEU  10 -18.757  -6.458  -1.864
   90   HD23  LEU  10          HD23      LEU  10 -19.019  -4.720  -2.046
   91    H    ASN  11           HN       ASN  11 -13.991  -2.797  -3.047
   92    HA   ASN  11           HA       ASN  11 -12.747  -4.773  -4.818
   93    HB2  ASN  11           HB2      ASN  11 -12.191  -1.841  -4.308
   94    HB3  ASN  11           HB1      ASN  11 -11.077  -2.861  -5.183
   95   HD21  ASN  11          HD21      ASN  11 -12.473  -0.503  -6.031
   96   HD22  ASN  11          HD22      ASN  11 -13.401  -0.959  -7.413
   97    H    GLY  12           HN       GLY  12 -12.182  -6.218  -3.175
   98    HA2  GLY  12           HA2      GLY  12  -9.693  -5.473  -1.824
   99    HA3  GLY  12           HA1      GLY  12 -11.046  -6.017  -0.804
  100    H    LYS  13           HN       LYS  13  -8.303  -7.113  -1.752
  101    HA   LYS  13           HA       LYS  13  -8.653  -9.434  -3.221
  102    HB2  LYS  13           HB2      LYS  13  -6.669  -8.903  -0.994
  103    HB3  LYS  13           HB1      LYS  13  -6.536 -10.191  -2.191
  104    HG2  LYS  13           HG2      LYS  13  -6.309  -8.605  -3.968
  105    HG3  LYS  13           HG1      LYS  13  -6.648  -7.257  -2.880
  106    HD2  LYS  13           HD2      LYS  13  -4.231  -7.541  -3.448
  107    HD3  LYS  13           HD1      LYS  13  -4.576  -7.601  -1.721
  108    HE2  LYS  13           HE2      LYS  13  -4.624 -10.196  -3.102
  109    HE3  LYS  13           HE1      LYS  13  -3.048  -9.412  -3.040
  110    HZ1  LYS  13           HZ1      LYS  13  -4.759  -9.841  -0.648
  111    HZ2  LYS  13           HZ2      LYS  13  -3.142  -9.336  -0.682
  112    HZ3  LYS  13           HZ3      LYS  13  -3.544 -10.917  -1.140
  113    H    THR  14           HN       THR  14  -9.643  -8.822   0.028
  114    HA   THR  14           HA       THR  14  -9.897 -11.670   0.641
  115    HB   THR  14           HB       THR  14 -10.862 -10.678   2.822
  116    HG1  THR  14           HG1      THR  14 -10.873  -8.559   2.989
  117   HG21  THR  14          HG21      THR  14  -8.625 -10.213   3.713
  118   HG22  THR  14          HG22      THR  14  -7.990 -10.106   2.072
  119   HG23  THR  14          HG23      THR  14  -8.611 -11.641   2.675
  120    H    LEU  15           HN       LEU  15 -11.742  -9.205  -0.763
  121    HA   LEU  15           HA       LEU  15 -14.134 -10.740  -0.816
  122    HB2  LEU  15           HB2      LEU  15 -13.872  -9.144   1.409
  123    HB3  LEU  15           HB1      LEU  15 -14.738  -8.099   0.313
  124    HG   LEU  15           HG       LEU  15 -16.351  -9.160   1.657
  125   HD11  LEU  15          HD11      LEU  15 -16.225 -10.611  -0.969
  126   HD12  LEU  15          HD12      LEU  15 -16.952  -9.032  -0.680
  127   HD13  LEU  15          HD13      LEU  15 -17.646 -10.474   0.063
  128   HD21  LEU  15          HD21      LEU  15 -16.493 -11.604   1.900
  129   HD22  LEU  15          HD22      LEU  15 -15.001 -10.938   2.563
  130   HD23  LEU  15          HD23      LEU  15 -14.977 -11.765   1.010
  131    H    LYS  16           HN       LYS  16 -14.210 -10.538  -2.981
  132    HA   LYS  16           HA       LYS  16 -14.396  -7.824  -4.096
  133    HB2  LYS  16           HB2      LYS  16 -13.487 -10.430  -5.304
  134    HB3  LYS  16           HB1      LYS  16 -13.929  -9.057  -6.298
  135    HG2  LYS  16           HG2      LYS  16 -12.041  -7.985  -5.860
  136    HG3  LYS  16           HG1      LYS  16 -11.935  -8.522  -4.182
  137    HD2  LYS  16           HD2      LYS  16 -11.134 -10.664  -4.947
  138    HD3  LYS  16           HD1      LYS  16 -11.444 -10.169  -6.612
  139    HE2  LYS  16           HE2      LYS  16  -9.593  -8.556  -4.943
  140    HE3  LYS  16           HE1      LYS  16  -9.023 -10.062  -5.667
  141    HZ1  LYS  16           HZ1      LYS  16 -10.347  -7.926  -7.237
  142    HZ2  LYS  16           HZ2      LYS  16  -9.491  -9.262  -7.817
  143    HZ3  LYS  16           HZ3      LYS  16  -8.665  -8.006  -7.034
  144    H    GLY  17           HN       GLY  17 -16.337  -7.210  -4.680
  145    HA2  GLY  17           HA2      GLY  17 -18.176  -8.607  -6.190
  146    HA3  GLY  17           HA1      GLY  17 -18.609  -8.911  -4.510
  147    H    GLU  18           HN       GLU  18 -20.605  -7.760  -5.288
  148    HA   GLU  18           HA       GLU  18 -20.515  -5.140  -4.196
  149    HB2  GLU  18           HB2      GLU  18 -21.456  -3.939  -6.174
  150    HB3  GLU  18           HB1      GLU  18 -19.782  -4.428  -6.361
  151    HG2  GLU  18           HG2      GLU  18 -20.534  -6.358  -7.701
  152    HG3  GLU  18           HG1      GLU  18 -22.179  -5.758  -7.572
  153    H    THR  19           HN       THR  19 -22.581  -4.247  -3.810
  154    HA   THR  19           HA       THR  19 -24.867  -5.975  -4.267
  155    HB   THR  19           HB       THR  19 -23.750  -6.901  -2.227
  156    HG1  THR  19           HG1      THR  19 -25.668  -7.293  -1.331
  157   HG21  THR  19          HG21      THR  19 -24.459  -4.188  -1.062
  158   HG22  THR  19          HG22      THR  19 -22.848  -4.890  -1.200
  159   HG23  THR  19          HG23      THR  19 -24.026  -5.597  -0.092
  160    H    THR  20           HN       THR  20 -26.792  -4.946  -2.832
  161    HA   THR  20           HA       THR  20 -26.632  -2.030  -3.081
  162    HB   THR  20           HB       THR  20 -28.946  -2.031  -4.054
  163    HG1  THR  20           HG1      THR  20 -28.773  -4.626  -3.545
  164   HG21  THR  20          HG21      THR  20 -26.755  -3.353  -5.679
  165   HG22  THR  20          HG22      THR  20 -27.084  -1.625  -5.558
  166   HG23  THR  20          HG23      THR  20 -28.234  -2.686  -6.370
  167    H    THR  21           HN       THR  21 -28.271  -0.872  -1.905
  168    HA   THR  21           HA       THR  21 -29.908  -2.365  -0.041
  169    HB   THR  21           HB       THR  21 -27.653  -2.053   1.146
  170    HG1  THR  21           HG1      THR  21 -29.514  -0.695   2.699
  171   HG21  THR  21          HG21      THR  21 -28.633   0.834   1.163
  172   HG22  THR  21          HG22      THR  21 -27.123   0.253   0.458
  173   HG23  THR  21          HG23      THR  21 -27.355   0.216   2.209
  174    H    GLU  22           HN       GLU  22 -31.478  -1.000   1.025
  175    HA   GLU  22           HA       GLU  22 -31.998   1.446  -0.521
  176    HB2  GLU  22           HB2      GLU  22 -34.333   1.166   0.130
  177    HB3  GLU  22           HB1      GLU  22 -33.770  -0.346  -0.566
  178    HG2  GLU  22           HG2      GLU  22 -33.504  -1.304   1.639
  179    HG3  GLU  22           HG1      GLU  22 -34.027   0.253   2.383
  180    H    ALA  23           HN       ALA  23 -32.077   3.393   0.486
  181    HA   ALA  23           HA       ALA  23 -32.270   3.485   3.421
  182    HB1  ALA  23           HB1      ALA  23 -30.293   4.894   3.637
  183    HB2  ALA  23           HB2      ALA  23 -30.009   4.815   1.899
  184    HB3  ALA  23           HB3      ALA  23 -29.848   3.362   2.884
  185    H    VAL  24           HN       VAL  24 -32.732   5.752   4.169
  186    HA   VAL  24           HA       VAL  24 -34.063   7.282   2.046
  187    HB   VAL  24           HB       VAL  24 -35.244   8.442   3.941
  188   HG11  VAL  24          HG11      VAL  24 -36.343   6.674   2.706
  189   HG12  VAL  24          HG12      VAL  24 -36.752   6.546   4.417
  190   HG13  VAL  24          HG13      VAL  24 -35.564   5.450   3.709
  191   HG21  VAL  24          HG21      VAL  24 -33.632   7.970   5.708
  192   HG22  VAL  24          HG22      VAL  24 -33.982   6.245   5.574
  193   HG23  VAL  24          HG23      VAL  24 -35.232   7.357   6.130
  194    H    ASP  25           HN       ASP  25 -31.133   7.283   3.149
  195    HA   ASP  25           HA       ASP  25 -30.759  10.116   2.928
  196    HB2  ASP  25           HB2      ASP  25 -31.185  10.125   5.282
  197    HB3  ASP  25           HB1      ASP  25 -30.178   8.709   5.537
  198    H    ALA  26           HN       ALA  26 -28.450  10.677   2.857
  199    HA   ALA  26           HA       ALA  26 -27.057   8.678   1.303
  200    HB1  ALA  26           HB1      ALA  26 -27.074  11.027   0.591
  201    HB2  ALA  26           HB2      ALA  26 -25.431  10.443   0.858
  202    HB3  ALA  26           HB3      ALA  26 -26.204  11.475   2.059
  203    H    ALA  27           HN       ALA  27 -26.611  10.276   4.439
  204    HA   ALA  27           HA       ALA  27 -23.987   9.143   4.868
  205    HB1  ALA  27           HB1      ALA  27 -24.157  10.127   7.093
  206    HB2  ALA  27           HB2      ALA  27 -25.861  10.489   6.814
  207    HB3  ALA  27           HB3      ALA  27 -24.620  11.296   5.856
  208    H    THR  28           HN       THR  28 -27.281   8.457   5.729
  209    HA   THR  28           HA       THR  28 -26.820   6.382   7.579
  210    HB   THR  28           HB       THR  28 -29.187   6.539   5.676
  211    HG1  THR  28           HG1      THR  28 -28.738   8.562   6.849
  212   HG21  THR  28          HG21      THR  28 -30.398   5.483   7.529
  213   HG22  THR  28          HG22      THR  28 -28.928   5.469   8.500
  214   HG23  THR  28          HG23      THR  28 -29.026   4.483   7.040
  215    H    ALA  29           HN       ALA  29 -26.547   6.474   4.117
  216    HA   ALA  29           HA       ALA  29 -26.835   3.638   3.693
  217    HB1  ALA  29           HB1      ALA  29 -26.084   4.106   1.423
  218    HB2  ALA  29           HB2      ALA  29 -25.618   5.740   1.898
  219    HB3  ALA  29           HB3      ALA  29 -27.316   5.272   1.913
  220    H    GLU  30           HN       GLU  30 -24.283   5.950   4.242
  221    HA   GLU  30           HA       GLU  30 -22.043   4.324   3.825
  222    HB2  GLU  30           HB2      GLU  30 -22.190   6.881   4.246
  223    HB3  GLU  30           HB1      GLU  30 -22.251   6.444   5.943
  224    HG2  GLU  30           HG2      GLU  30 -20.106   5.101   5.455
  225    HG3  GLU  30           HG1      GLU  30 -20.015   6.119   4.021
  226    H    LYS  31           HN       LYS  31 -23.627   5.253   6.842
  227    HA   LYS  31           HA       LYS  31 -22.251   3.761   8.632
  228    HB2  LYS  31           HB2      LYS  31 -25.191   4.403   8.766
  229    HB3  LYS  31           HB1      LYS  31 -24.163   3.962  10.125
  230    HG2  LYS  31           HG2      LYS  31 -24.085   6.462   8.463
  231    HG3  LYS  31           HG1      LYS  31 -24.341   6.300  10.205
  232    HD2  LYS  31           HD2      LYS  31 -22.063   5.587  10.524
  233    HD3  LYS  31           HD1      LYS  31 -21.788   5.559   8.780
  234    HE2  LYS  31           HE2      LYS  31 -22.292   8.018   8.768
  235    HE3  LYS  31           HE1      LYS  31 -22.279   7.961  10.532
  236    HZ1  LYS  31           HZ1      LYS  31 -20.133   8.635   9.790
  237    HZ2  LYS  31           HZ2      LYS  31 -20.026   7.345   8.692
  238    HZ3  LYS  31           HZ3      LYS  31 -19.986   7.043  10.365
  239    H    VAL  32           HN       VAL  32 -25.056   2.628   6.753
  240    HA   VAL  32           HA       VAL  32 -25.220   0.130   8.134
  241    HB   VAL  32           HB       VAL  32 -26.297   0.882   5.407
  242   HG11  VAL  32          HG11      VAL  32 -27.823  -1.005   5.685
  243   HG12  VAL  32          HG12      VAL  32 -27.022  -1.433   7.197
  244   HG13  VAL  32          HG13      VAL  32 -26.140  -1.533   5.675
  245   HG21  VAL  32          HG21      VAL  32 -28.431   1.220   6.587
  246   HG22  VAL  32          HG22      VAL  32 -27.174   2.313   7.166
  247   HG23  VAL  32          HG23      VAL  32 -27.619   0.900   8.122
  248    H    PHE  33           HN       PHE  33 -23.769   1.109   5.036
  249    HA   PHE  33           HA       PHE  33 -22.909  -1.533   4.393
  250    HB2  PHE  33           HB2      PHE  33 -22.380   1.171   3.254
  251    HB3  PHE  33           HB1      PHE  33 -21.286  -0.128   2.844
  252    HD1  PHE  33           HD1      PHE  33 -23.266  -2.381   2.720
  253    HD2  PHE  33           HD2      PHE  33 -23.406   1.591   1.193
  254    HE1  PHE  33           HE1      PHE  33 -24.783  -3.128   0.934
  255    HE2  PHE  33           HE2      PHE  33 -24.928   0.851  -0.598
  256    HZ   PHE  33           HZ       PHE  33 -25.624  -1.513  -0.727
  257    H    LYS  34           HN       LYS  34 -21.600   0.946   6.414
  258    HA   LYS  34           HA       LYS  34 -18.899   0.115   6.260
  259    HB2  LYS  34           HB2      LYS  34 -20.418   1.662   8.355
  260    HB3  LYS  34           HB1      LYS  34 -18.712   1.350   8.488
  261    HG2  LYS  34           HG2      LYS  34 -18.651   2.417   6.089
  262    HG3  LYS  34           HG1      LYS  34 -20.168   3.151   6.623
  263    HD2  LYS  34           HD2      LYS  34 -18.354   4.673   7.156
  264    HD3  LYS  34           HD1      LYS  34 -19.011   3.996   8.648
  265    HE2  LYS  34           HE2      LYS  34 -17.188   2.355   8.706
  266    HE3  LYS  34           HE1      LYS  34 -16.539   3.027   7.212
  267    HZ1  LYS  34           HZ1      LYS  34 -16.676   4.313   9.876
  268    HZ2  LYS  34           HZ2      LYS  34 -16.347   5.183   8.460
  269    HZ3  LYS  34           HZ3      LYS  34 -15.291   3.951   8.959
  270    H    GLN  35           HN       GLN  35 -21.575  -0.652   8.444
  271    HA   GLN  35           HA       GLN  35 -20.106  -2.442  10.078
  272    HB2  GLN  35           HB2      GLN  35 -22.288  -1.364  10.715
  273    HB3  GLN  35           HB1      GLN  35 -23.088  -2.413   9.557
  274    HG2  GLN  35           HG2      GLN  35 -23.277  -3.228  11.868
  275    HG3  GLN  35           HG1      GLN  35 -22.459  -4.373  10.806
  276   HE21  GLN  35          HE21      GLN  35 -22.120  -2.185  13.470
  277   HE22  GLN  35          HE22      GLN  35 -20.550  -2.708  13.968
  278    H    TYR  36           HN       TYR  36 -21.734  -2.622   7.059
  279    HA   TYR  36           HA       TYR  36 -21.897  -5.442   6.785
  280    HB2  TYR  36           HB2      TYR  36 -23.314  -4.124   5.409
  281    HB3  TYR  36           HB1      TYR  36 -21.985  -3.101   4.894
  282    HD1  TYR  36           HD1      TYR  36 -23.090  -6.675   4.646
  283    HD2  TYR  36           HD2      TYR  36 -21.091  -3.390   2.873
  284    HE1  TYR  36           HE1      TYR  36 -22.826  -7.973   2.569
  285    HE2  TYR  36           HE2      TYR  36 -20.817  -4.641   0.783
  286    HH   TYR  36           HH       TYR  36 -22.460  -7.593   0.184
  287    H    ALA  37           HN       ALA  37 -19.645  -3.020   5.466
  288    HA   ALA  37           HA       ALA  37 -17.865  -4.917   4.335
  289    HB1  ALA  37           HB1      ALA  37 -17.993  -2.593   3.564
  290    HB2  ALA  37           HB2      ALA  37 -16.349  -3.023   4.037
  291    HB3  ALA  37           HB3      ALA  37 -17.350  -2.043   5.110
  292    H    ASN  38           HN       ASN  38 -18.091  -3.366   7.450
  293    HA   ASN  38           HA       ASN  38 -15.538  -4.111   8.436
  294    HB2  ASN  38           HB2      ASN  38 -17.087  -2.337   9.444
  295    HB3  ASN  38           HB1      ASN  38 -18.059  -3.659  10.084
  296   HD21  ASN  38          HD21      ASN  38 -15.302  -1.657  10.583
  297   HD22  ASN  38          HD22      ASN  38 -14.708  -2.468  12.050
  298    H    ASP  39           HN       ASP  39 -18.551  -5.756   8.092
  299    HA   ASP  39           HA       ASP  39 -18.106  -7.841   9.963
  300    HB2  ASP  39           HB2      ASP  39 -20.317  -7.109   8.869
  301    HB3  ASP  39           HB1      ASP  39 -19.812  -8.080   7.491
  302    H    ASN  40           HN       ASN  40 -17.175  -7.337   6.622
  303    HA   ASN  40           HA       ASN  40 -16.049 -10.044   6.541
  304    HB2  ASN  40           HB2      ASN  40 -15.643  -9.469   4.066
  305    HB3  ASN  40           HB1      ASN  40 -17.295  -9.777   4.577
  306   HD21  ASN  40          HD21      ASN  40 -18.813  -8.199   4.395
  307   HD22  ASN  40          HD22      ASN  40 -18.469  -6.610   3.701
  308    H    GLY  41           HN       GLY  41 -15.168  -7.122   7.546
  309    HA2  GLY  41           HA2      GLY  41 -13.101  -6.449   8.300
  310    HA3  GLY  41           HA1      GLY  41 -12.405  -7.861   7.531
  311    H    VAL  42           HN       VAL  42 -14.294  -5.575   5.637
  312    HA   VAL  42           HA       VAL  42 -11.792  -4.820   4.337
  313    HB   VAL  42           HB       VAL  42 -14.632  -4.675   3.294
  314   HG11  VAL  42          HG11      VAL  42 -12.027  -3.975   1.925
  315   HG12  VAL  42          HG12      VAL  42 -13.238  -2.815   2.470
  316   HG13  VAL  42          HG13      VAL  42 -13.626  -3.960   1.183
  317   HG21  VAL  42          HG21      VAL  42 -13.799  -6.928   3.351
  318   HG22  VAL  42          HG22      VAL  42 -12.268  -6.428   2.624
  319   HG23  VAL  42          HG23      VAL  42 -13.755  -6.359   1.677
  320    H    ASP  43           HN       ASP  43 -10.964  -2.995   4.928
  321    HA   ASP  43           HA       ASP  43 -12.717  -0.683   5.345
  322    HB2  ASP  43           HB2      ASP  43 -11.959  -1.638   7.573
  323    HB3  ASP  43           HB1      ASP  43 -10.310  -1.232   7.110
  324    H    GLY  44           HN       GLY  44 -12.150   0.716   3.738
  325    HA2  GLY  44           HA2      GLY  44  -9.352   1.249   3.200
  326    HA3  GLY  44           HA1      GLY  44 -10.238   0.494   1.882
  327    H    GLU  45           HN       GLU  45  -9.542   2.563   0.836
  328    HA   GLU  45           HA       GLU  45 -10.504   5.097   1.533
  329    HB2  GLU  45           HB2      GLU  45 -10.222   4.046  -1.290
  330    HB3  GLU  45           HB1      GLU  45 -10.162   5.720  -0.773
  331    HG2  GLU  45           HG2      GLU  45  -8.170   3.685   0.143
  332    HG3  GLU  45           HG1      GLU  45  -7.972   4.615  -1.338
  333    H    TRP  46           HN       TRP  46 -12.387   6.184   1.130
  334    HA   TRP  46           HA       TRP  46 -14.618   4.548   0.119
  335    HB2  TRP  46           HB2      TRP  46 -14.493   6.416   2.457
  336    HB3  TRP  46           HB1      TRP  46 -15.992   6.342   1.556
  337    HD1  TRP  46           HD1      TRP  46 -13.560   3.895   3.313
  338    HE1  TRP  46           HE1      TRP  46 -14.926   1.991   4.379
  339    HE3  TRP  46           HE3      TRP  46 -18.268   5.236   1.715
  340    HZ2  TRP  46           HZ2      TRP  46 -17.606   1.183   4.534
  341    HZ3  TRP  46           HZ3      TRP  46 -20.166   3.834   2.393
  342    HH2  TRP  46           HH2      TRP  46 -19.840   1.846   3.766
  343    H    THR  47           HN       THR  47 -14.721   5.167  -1.943
  344    HA   THR  47           HA       THR  47 -14.879   8.035  -2.563
  345    HB   THR  47           HB       THR  47 -14.677   7.071  -4.987
  346    HG1  THR  47           HG1      THR  47 -14.891   4.900  -4.565
  347   HG21  THR  47          HG21      THR  47 -12.386   7.023  -3.022
  348   HG22  THR  47          HG22      THR  47 -12.931   8.403  -3.977
  349   HG23  THR  47          HG23      THR  47 -12.204   7.007  -4.774
  350    H    TYR  48           HN       TYR  48 -16.543   8.582  -4.340
  351    HA   TYR  48           HA       TYR  48 -18.830   6.834  -4.414
  352    HB2  TYR  48           HB2      TYR  48 -19.300   7.781  -2.283
  353    HB3  TYR  48           HB1      TYR  48 -18.907   9.398  -2.804
  354    HD1  TYR  48           HD1      TYR  48 -20.730  10.864  -3.394
  355    HD2  TYR  48           HD2      TYR  48 -21.320   6.624  -3.482
  356    HE1  TYR  48           HE1      TYR  48 -23.108  11.201  -3.825
  357    HE2  TYR  48           HE2      TYR  48 -23.712   6.986  -3.930
  358    HH   TYR  48           HH       TYR  48 -25.005  10.114  -4.691
  359    H    ASP  49           HN       ASP  49 -20.458   7.492  -5.853
  360    HA   ASP  49           HA       ASP  49 -19.891   9.841  -7.546
  361    HB2  ASP  49           HB2      ASP  49 -18.860   8.041  -8.866
  362    HB3  ASP  49           HB1      ASP  49 -20.299   7.053  -8.743
  363    H    ASP  50           HN       ASP  50 -21.821  10.834  -8.271
  364    HA   ASP  50           HA       ASP  50 -24.082   9.887  -6.637
  365    HB2  ASP  50           HB2      ASP  50 -23.270  12.300  -6.450
  366    HB3  ASP  50           HB1      ASP  50 -23.913  12.540  -8.073
  367    H    ALA  51           HN       ALA  51 -23.108  10.215  -9.931
  368    HA   ALA  51           HA       ALA  51 -25.712  10.199 -11.063
  369    HB1  ALA  51           HB1      ALA  51 -24.581   9.646 -13.159
  370    HB2  ALA  51           HB2      ALA  51 -23.086   9.346 -12.273
  371    HB3  ALA  51           HB3      ALA  51 -23.775  10.968 -12.315
  372    H    THR  52           HN       THR  52 -23.604   7.720  -9.843
  373    HA   THR  52           HA       THR  52 -25.477   5.673 -10.817
  374    HB   THR  52           HB       THR  52 -23.556   4.071 -10.423
  375    HG1  THR  52           HG1      THR  52 -22.009   6.480 -10.405
  376   HG21  THR  52          HG21      THR  52 -23.157   6.267 -12.462
  377   HG22  THR  52          HG22      THR  52 -24.174   4.842 -12.668
  378   HG23  THR  52          HG23      THR  52 -22.424   4.662 -12.523
  379    H    LYS  53           HN       LYS  53 -24.886   7.320  -8.050
  380    HA   LYS  53           HA       LYS  53 -25.019   6.937  -5.776
  381    HB2  LYS  53           HB2      LYS  53 -27.204   5.508  -7.092
  382    HB3  LYS  53           HB1      LYS  53 -26.803   4.844  -5.520
  383    HG2  LYS  53           HG2      LYS  53 -28.564   6.542  -5.385
  384    HG3  LYS  53           HG1      LYS  53 -27.127   6.984  -4.465
  385    HD2  LYS  53           HD2      LYS  53 -26.415   8.450  -6.295
  386    HD3  LYS  53           HD1      LYS  53 -27.877   8.031  -7.192
  387    HE2  LYS  53           HE2      LYS  53 -29.251   8.977  -5.428
  388    HE3  LYS  53           HE1      LYS  53 -27.811   9.337  -4.481
  389    HZ1  LYS  53           HZ1      LYS  53 -28.737  11.249  -5.729
  390    HZ2  LYS  53           HZ2      LYS  53 -28.326  10.466  -7.173
  391    HZ3  LYS  53           HZ3      LYS  53 -27.113  10.927  -6.075
  392    H    THR  54           HN       THR  54 -22.859   5.579  -6.950
  393    HA   THR  54           HA       THR  54 -22.867   2.980  -5.606
  394    HB   THR  54           HB       THR  54 -20.815   3.942  -7.603
  395    HG1  THR  54           HG1      THR  54 -23.332   3.503  -8.110
  396   HG21  THR  54          HG21      THR  54 -20.314   1.562  -7.830
  397   HG22  THR  54          HG22      THR  54 -21.619   1.151  -6.712
  398   HG23  THR  54          HG23      THR  54 -20.201   2.023  -6.127
  399    H    TYR  55           HN       TYR  55 -21.987   2.940  -3.669
  400    HA   TYR  55           HA       TYR  55 -19.827   4.756  -2.940
  401    HB2  TYR  55           HB2      TYR  55 -21.430   2.718  -1.368
  402    HB3  TYR  55           HB1      TYR  55 -19.864   3.259  -0.781
  403    HD1  TYR  55           HD1      TYR  55 -23.311   4.409  -1.565
  404    HD2  TYR  55           HD2      TYR  55 -19.567   5.370   0.226
  405    HE1  TYR  55           HE1      TYR  55 -24.323   6.382  -0.501
  406    HE2  TYR  55           HE2      TYR  55 -20.573   7.346   1.285
  407    HH   TYR  55           HH       TYR  55 -23.867   7.849   1.523
  408    H    THR  56           HN       THR  56 -17.686   4.146  -2.860
  409    HA   THR  56           HA       THR  56 -17.147   1.369  -3.708
  410    HB   THR  56           HB       THR  56 -14.960   2.892  -4.567
  411    HG1  THR  56           HG1      THR  56 -17.382   4.321  -4.771
  412   HG21  THR  56          HG21      THR  56 -17.365   1.928  -6.139
  413   HG22  THR  56          HG22      THR  56 -15.876   1.026  -5.828
  414   HG23  THR  56          HG23      THR  56 -15.844   2.459  -6.853
  415    H    VAL  57           HN       VAL  57 -16.027   0.269  -2.247
  416    HA   VAL  57           HA       VAL  57 -14.153   1.789  -0.562
  417    HB   VAL  57           HB       VAL  57 -15.951   0.789   0.849
  418   HG11  VAL  57          HG11      VAL  57 -15.955  -1.665   1.225
  419   HG12  VAL  57          HG12      VAL  57 -14.912  -1.844  -0.180
  420   HG13  VAL  57          HG13      VAL  57 -16.542  -1.196  -0.366
  421   HG21  VAL  57          HG21      VAL  57 -14.470  -0.307   2.478
  422   HG22  VAL  57          HG22      VAL  57 -13.764   1.170   1.817
  423   HG23  VAL  57          HG23      VAL  57 -13.210  -0.404   1.247
  424    H    THR  58           HN       THR  58 -12.193   1.531  -1.253
  425    HA   THR  58           HA       THR  58 -11.509  -0.976  -2.636
  426    HB   THR  58           HB       THR  58 -10.012   1.593  -3.077
  427    HG1  THR  58           HG1      THR  58 -12.408   1.788  -3.386
  428   HG21  THR  58          HG21      THR  58 -10.662  -0.697  -4.947
  429   HG22  THR  58          HG22      THR  58  -9.177  -0.583  -4.000
  430   HG23  THR  58          HG23      THR  58  -9.532   0.624  -5.238
  431    H    GLU  59           HN       GLU  59  -9.925  -2.167  -1.858
  432    HA   GLU  59           HA       GLU  59  -8.584  -1.361   0.571
  433    HB2  GLU  59           HB2      GLU  59  -9.524  -3.689   0.002
  434    HB3  GLU  59           HB1      GLU  59  -8.102  -3.888  -1.005
  435    HG2  GLU  59           HG2      GLU  59  -8.166  -3.510   1.978
  436    HG3  GLU  59           HG1      GLU  59  -7.805  -4.988   1.104
  437    H    GLY  60           HN       GLY  60  -7.049   0.275   0.011
  438    HA2  GLY  60           HA2      GLY  60  -5.095  -0.469  -2.066
  439    HA3  GLY  60           HA1      GLY  60  -5.365   1.162  -1.459
  440    H    SER  61           HN       SER  61  -3.570  -1.687  -1.147
  441    HA   SER  61           HA       SER  61  -2.140  -0.540   1.157
  442    HB2  SER  61           HB2      SER  61  -1.609  -2.968   1.735
  443    HB3  SER  61           HB1      SER  61  -3.298  -2.498   1.945
  444    HG   SER  61           HG       SER  61  -3.880  -3.788   0.369
  445    H    GLY  62           HN       GLY  62  -1.875  -0.758  -1.979
  446    HA2  GLY  62           HA2      GLY  62   0.205  -0.273  -3.071
  447    HA3  GLY  62           HA1      GLY  62   1.018  -1.284  -1.884
  448    H    GLY  63           HN       GLY  63  -1.485  -3.128  -2.451
  449    HA2  GLY  63           HA2      GLY  63  -0.073  -4.884  -4.202
  450    HA3  GLY  63           HA1      GLY  63  -1.682  -5.141  -3.550
  451    H    ALA  64           HN       ALA  64  -2.102  -2.278  -4.839
  452    HA   ALA  64           HA       ALA  64  -2.479  -3.191  -7.598
  453    HB1  ALA  64           HB1      ALA  64  -4.736  -2.200  -7.643
  454    HB2  ALA  64           HB2      ALA  64  -4.609  -1.873  -5.915
  455    HB3  ALA  64           HB3      ALA  64  -4.622  -3.537  -6.499
  456    H    GLY  65           HN       GLY  65  -2.803  -1.364  -9.107
  457    HA2  GLY  65           HA2      GLY  65  -2.776   1.261  -8.783
  458    HA3  GLY  65           HA1      GLY  65  -1.137   0.882  -8.270
  459    H    GLY  66           HN       GLY  66   0.258  -0.223  -9.823
  460    HA2  GLY  66           HA2      GLY  66   0.156   1.022 -12.361
  461    HA3  GLY  66           HA1      GLY  66   1.275  -0.243 -11.882
  462    H    GLN  67           HN       GLN  67  -0.962  -2.070 -11.232
  463    HA   GLN  67           HA       GLN  67  -2.351  -3.612 -12.148
  464    HB2  GLN  67           HB2      GLN  67  -3.583  -1.815 -13.219
  465    HB3  GLN  67           HB1      GLN  67  -2.382  -1.727 -14.532
  466    HG2  GLN  67           HG2      GLN  67  -3.014  -4.015 -15.194
  467    HG3  GLN  67           HG1      GLN  67  -4.258  -4.019 -13.943
  468   HE21  GLN  67          HE21      GLN  67  -4.462  -4.237 -16.875
  469   HE22  GLN  67          HE22      GLN  67  -5.537  -2.966 -17.353
  470    H    GLY  68           HN       GLY  68  -0.527  -2.524 -15.014
  471    HA2  GLY  68           HA2      GLY  68   1.304  -4.645 -15.029
  472    HA3  GLY  68           HA1      GLY  68  -0.082  -5.115 -16.007
  473    H    MET  69           HN       MET  69   1.666  -5.138 -17.712
  474    HA   MET  69           HA       MET  69   2.609  -4.263 -19.595
  475    HB2  MET  69           HB2      MET  69   0.755  -1.923 -19.088
  476    HB3  MET  69           HB1      MET  69   1.592  -2.258 -20.594
  477    HG2  MET  69           HG2      MET  69   0.303  -4.276 -20.906
  478    HG3  MET  69           HG1      MET  69  -0.477  -4.046 -19.341
  479    HE1  MET  69           HE1      MET  69  -0.824  -0.854 -19.362
  480    HE2  MET  69           HE2      MET  69  -2.096  -1.941 -18.802
  481    HE3  MET  69           HE3      MET  69  -2.463  -0.691 -19.991
  482    H    ILE  70           HN       ILE  70   3.356  -1.715 -20.315
  483    HA   ILE  70           HA       ILE  70   4.408   0.279 -19.731
  484    HB   ILE  70           HB       ILE  70   3.645  -0.472 -17.150
  485   HG12  ILE  70          HG12      ILE  70   4.624   1.803 -16.544
  486   HG13  ILE  70          HG11      ILE  70   5.244   1.873 -18.191
  487   HG21  ILE  70          HG21      ILE  70   6.670  -0.188 -17.197
  488   HG22  ILE  70          HG22      ILE  70   5.762  -1.613 -16.687
  489   HG23  ILE  70          HG23      ILE  70   5.671  -0.123 -15.743
  490   HD11  ILE  70          HD11      ILE  70   3.117   3.087 -17.891
  491   HD12  ILE  70          HD12      ILE  70   2.331   1.565 -17.470
  492   HD13  ILE  70          HD13      ILE  70   3.007   1.794 -19.083
  493    H    GLN  71           HN       GLN  71   5.302  -2.683 -20.239
  494    HA   GLN  71           HA       GLN  71   8.182  -2.297 -19.832
  495    HB2  GLN  71           HB2      GLN  71   8.381  -4.692 -20.329
  496    HB3  GLN  71           HB1      GLN  71   7.276  -4.404 -18.996
  497    HG2  GLN  71           HG2      GLN  71   5.374  -4.759 -20.433
  498    HG3  GLN  71           HG1      GLN  71   6.430  -4.914 -21.837
  499   HE21  GLN  71          HE21      GLN  71   8.433  -6.416 -20.365
  500   HE22  GLN  71          HE22      GLN  71   7.795  -8.011 -20.156
  501    H    GLU  72           HN       GLU  72   6.169  -1.268 -21.922
  502    HA   GLU  72           HA       GLU  72   7.468  -2.233 -24.365
  503    HB2  GLU  72           HB2      GLU  72   5.091  -0.373 -24.145
  504    HB3  GLU  72           HB1      GLU  72   5.652  -1.219 -25.578
  505    HG2  GLU  72           HG2      GLU  72   3.903  -2.550 -25.004
  506    HG3  GLU  72           HG1      GLU  72   5.191  -3.350 -24.102
  507    HA   PRO  73           HA       PRO  73   9.750   1.558 -24.631
  508    HB2  PRO  73           HB2      PRO  73  10.426   1.616 -27.232
  509    HB3  PRO  73           HB1      PRO  73  10.986   0.242 -26.195
  510    HG2  PRO  73           HG2      PRO  73   8.598   0.402 -28.029
  511    HG3  PRO  73           HG1      PRO  73   9.862  -0.849 -27.963
  512    HD2  PRO  73           HD2      PRO  73   7.452  -1.123 -26.715
  513    HD3  PRO  73           HD1      PRO  73   8.966  -1.830 -26.059
  514    H    ALA  74           HN       ALA  74   9.634   3.717 -25.432
  515    HA   ALA  74           HA       ALA  74   7.275   4.480 -26.952
  516    HB1  ALA  74           HB1      ALA  74   6.516   4.493 -24.617
  517    HB2  ALA  74           HB2      ALA  74   6.551   6.121 -25.297
  518    HB3  ALA  74           HB3      ALA  74   7.829   5.594 -24.201
  519    H    LEU  75           HN       LEU  75   7.330   7.030 -27.093
  520    HA   LEU  75           HA       LEU  75   9.836   7.680 -28.301
  521    HB2  LEU  75           HB2      LEU  75   7.343   9.335 -27.875
  522    HB3  LEU  75           HB1      LEU  75   8.753   9.916 -28.721
  523    HG   LEU  75           HG       LEU  75   7.185   9.321 -30.363
  524   HD11  LEU  75          HD11      LEU  75   9.431   8.644 -30.918
  525   HD12  LEU  75          HD12      LEU  75   8.286   7.467 -31.563
  526   HD13  LEU  75          HD13      LEU  75   9.205   7.098 -30.104
  527   HD21  LEU  75          HD21      LEU  75   6.886   6.634 -29.021
  528   HD22  LEU  75          HD22      LEU  75   6.075   7.159 -30.498
  529   HD23  LEU  75          HD23      LEU  75   5.715   7.951 -28.965
  530    HA   PRO  76           HA       PRO  76  11.580   9.721 -24.727
  531    HB2  PRO  76           HB2      PRO  76  13.022  11.549 -26.557
  532    HB3  PRO  76           HB1      PRO  76  13.707  10.342 -25.466
  533    HG2  PRO  76           HG2      PRO  76  13.780  10.004 -28.119
  534    HG3  PRO  76           HG1      PRO  76  13.469   8.615 -27.005
  535    HD2  PRO  76           HD2      PRO  76  11.436  10.253 -28.583
  536    HD3  PRO  76           HD1      PRO  76  11.602   8.490 -28.448
  537    HA   PRO  77           HA       PRO  77   9.184  13.381 -24.036
  538    HB2  PRO  77           HB2      PRO  77  10.837  14.984 -22.580
  539    HB3  PRO  77           HB1      PRO  77  10.078  13.534 -21.906
  540    HG2  PRO  77           HG2      PRO  77  12.807  13.866 -23.093
  541    HG3  PRO  77           HG1      PRO  77  12.368  13.133 -21.531
  542    HD2  PRO  77           HD2      PRO  77  12.847  11.540 -23.633
  543    HD3  PRO  77           HD1      PRO  77  11.451  11.208 -22.541
  544    H    GLY  78           HN       GLY  78   8.695  15.054 -25.313
  545    HA2  GLY  78           HA2      GLY  78   9.083  16.952 -26.631
  546    HA3  GLY  78           HA1      GLY  78  10.807  16.659 -26.506
  547    H    TRP  79           HN       TRP  79  10.066  13.743 -27.460
  548    HA   TRP  79           HA       TRP  79  10.253  14.452 -30.305
  549    HB2  TRP  79           HB2      TRP  79  10.772  11.870 -28.815
  550    HB3  TRP  79           HB1      TRP  79  10.739  11.962 -30.572
  551    HD1  TRP  79           HD1      TRP  79  12.798  13.252 -27.569
  552    HE1  TRP  79           HE1      TRP  79  15.146  13.873 -28.418
  553    HE3  TRP  79           HE3      TRP  79  12.070  12.547 -32.585
  554    HZ2  TRP  79           HZ2      TRP  79  16.509  14.035 -30.874
  555    HZ3  TRP  79           HZ3      TRP  79  13.951  12.962 -34.115
  556    HH2  TRP  79           HH2      TRP  79  16.119  13.691 -33.281
  557    H    GLU  80           HN       GLU  80   8.521  14.260 -31.663
  558    HA   GLU  80           HA       GLU  80   6.301  12.533 -30.806
  559    HB2  GLU  80           HB2      GLU  80   6.263  14.864 -32.743
  560    HB3  GLU  80           HB1      GLU  80   4.870  13.899 -32.308
  561    HG2  GLU  80           HG2      GLU  80   4.981  14.706 -30.034
  562    HG3  GLU  80           HG1      GLU  80   6.450  15.608 -30.398
  563    H    MET  81           HN       MET  81   5.320  11.190 -32.385
  564    HA   MET  81           HA       MET  81   6.952  10.711 -34.786
  565    HB2  MET  81           HB2      MET  81   7.336   9.051 -32.913
  566    HB3  MET  81           HB1      MET  81   5.638   8.555 -33.106
  567    HG2  MET  81           HG2      MET  81   7.687   8.454 -35.311
  568    HG3  MET  81           HG1      MET  81   7.355   7.108 -34.230
  569    HE1  MET  81           HE1      MET  81   3.622   6.282 -35.134
  570    HE2  MET  81           HE2      MET  81   4.207   7.343 -33.851
  571    HE3  MET  81           HE3      MET  81   5.017   5.810 -34.166
  572    H    LYS  82           HN       LYS  82   5.700  10.951 -36.615
  573    HA   LYS  82           HA       LYS  82   2.891  10.173 -36.513
  574    HB2  LYS  82           HB2      LYS  82   3.570  12.923 -37.560
  575    HB3  LYS  82           HB1      LYS  82   1.990  12.270 -37.182
  576    HG2  LYS  82           HG2      LYS  82   2.515  12.317 -34.806
  577    HG3  LYS  82           HG1      LYS  82   4.143  12.943 -35.182
  578    HD2  LYS  82           HD2      LYS  82   3.006  14.901 -36.289
  579    HD3  LYS  82           HD1      LYS  82   1.483  14.311 -35.620
  580    HE2  LYS  82           HE2      LYS  82   2.562  14.411 -33.348
  581    HE3  LYS  82           HE1      LYS  82   3.934  15.209 -34.105
  582    HZ1  LYS  82           HZ1      LYS  82   2.496  17.015 -34.773
  583    HZ2  LYS  82           HZ2      LYS  82   2.389  16.779 -33.097
  584    HZ3  LYS  82           HZ3      LYS  82   1.141  16.235 -34.112
  585    H    TYR  83           HN       TYR  83   1.930  10.027 -38.684
  586    HA   TYR  83           HA       TYR  83   4.020   9.594 -40.742
  587    HB2  TYR  83           HB2      TYR  83   1.369   8.193 -40.264
  588    HB3  TYR  83           HB1      TYR  83   2.239   8.063 -41.811
  589    HD1  TYR  83           HD1      TYR  83   4.191   6.697 -42.003
  590    HD2  TYR  83           HD2      TYR  83   2.295   7.176 -38.226
  591    HE1  TYR  83           HE1      TYR  83   5.460   4.783 -41.127
  592    HE2  TYR  83           HE2      TYR  83   3.556   5.258 -37.341
  593    HH   TYR  83           HH       TYR  83   6.191   3.843 -39.044
  594    H    THR  84           HN       THR  84   3.444  10.005 -42.972
  595    HA   THR  84           HA       THR  84   1.630  12.260 -43.304
  596    HB   THR  84           HB       THR  84   2.558  12.521 -45.507
  597    HG1  THR  84           HG1      THR  84   3.942  10.952 -46.417
  598   HG21  THR  84          HG21      THR  84   4.965  12.689 -45.082
  599   HG22  THR  84          HG22      THR  84   4.771  11.715 -43.626
  600   HG23  THR  84          HG23      THR  84   4.018  13.306 -43.729
  601    H    SER  85           HN       SER  85   0.684  11.802 -45.938
  602    HA   SER  85           HA       SER  85  -1.316   9.768 -45.320
  603    HB2  SER  85           HB2      SER  85  -2.431  10.747 -47.417
  604    HB3  SER  85           HB1      SER  85  -2.348  11.767 -45.982
  605    HG   SER  85           HG       SER  85  -1.494  13.127 -47.345
  606    H    GLU  86           HN       GLU  86   1.559   9.453 -46.519
  607    HA   GLU  86           HA       GLU  86   0.739   7.562 -48.668
  608    HB2  GLU  86           HB2      GLU  86   2.060   9.542 -49.476
  609    HB3  GLU  86           HB1      GLU  86   3.368   9.064 -48.402
  610    HG2  GLU  86           HG2      GLU  86   3.622   6.969 -49.613
  611    HG3  GLU  86           HG1      GLU  86   2.294   7.420 -50.684
  612    H    GLY  87           HN       GLY  87   1.629   7.727 -45.564
  613    HA2  GLY  87           HA2      GLY  87   2.277   5.934 -44.197
  614    HA3  GLY  87           HA1      GLY  87   2.890   5.099 -45.616
  615    H    VAL  88           HN       VAL  88   4.018   8.201 -45.767
  616    HA   VAL  88           HA       VAL  88   6.681   7.406 -45.089
  617    HB   VAL  88           HB       VAL  88   5.553  10.122 -45.799
  618   HG11  VAL  88          HG11      VAL  88   7.880  10.816 -46.152
  619   HG12  VAL  88          HG12      VAL  88   8.434   9.271 -45.508
  620   HG13  VAL  88          HG13      VAL  88   7.569  10.402 -44.466
  621   HG21  VAL  88          HG21      VAL  88   5.418   8.542 -47.624
  622   HG22  VAL  88          HG22      VAL  88   7.105   8.085 -47.395
  623   HG23  VAL  88          HG23      VAL  88   6.698   9.707 -47.956
  624    H    ARG  89           HN       ARG  89   7.766   7.712 -43.250
  625    HA   ARG  89           HA       ARG  89   6.238   8.732 -40.975
  626    HB2  ARG  89           HB2      ARG  89   7.332   6.405 -41.083
  627    HB3  ARG  89           HB1      ARG  89   8.850   7.254 -40.891
  628    HG2  ARG  89           HG2      ARG  89   8.181   8.077 -38.736
  629    HG3  ARG  89           HG1      ARG  89   6.566   7.383 -38.939
  630    HD2  ARG  89           HD2      ARG  89   7.611   5.148 -39.159
  631    HD3  ARG  89           HD1      ARG  89   9.170   5.882 -38.818
  632    HE   ARG  89           HE       ARG  89   7.653   6.589 -36.683
  633   HH11  ARG  89          HH11      ARG  89   8.288   3.529 -38.260
  634   HH12  ARG  89          HH12      ARG  89   8.183   2.597 -36.793
  635   HH21  ARG  89          HH21      ARG  89   7.492   5.359 -34.746
  636   HH22  ARG  89          HH22      ARG  89   7.748   3.638 -34.789
  637    H    TYR  90           HN       TYR  90   6.704  10.689 -40.158
  638    HA   TYR  90           HA       TYR  90   9.418  11.715 -40.603
  639    HB2  TYR  90           HB2      TYR  90   8.582  13.994 -40.828
  640    HB3  TYR  90           HB1      TYR  90   7.853  12.966 -42.041
  641    HD1  TYR  90           HD1      TYR  90   5.466  12.249 -41.752
  642    HD2  TYR  90           HD2      TYR  90   7.262  15.222 -39.302
  643    HE1  TYR  90           HE1      TYR  90   3.238  13.074 -41.141
  644    HE2  TYR  90           HE2      TYR  90   5.038  16.061 -38.674
  645    HH   TYR  90           HH       TYR  90   2.167  14.313 -39.384
  646    H    PHE  91           HN       PHE  91  10.138  13.250 -38.839
  647    HA   PHE  91           HA       PHE  91   8.790  12.480 -36.344
  648    HB2  PHE  91           HB2      PHE  91  11.759  12.547 -36.909
  649    HB3  PHE  91           HB1      PHE  91  11.109  12.597 -35.285
  650    HD1  PHE  91           HD1      PHE  91  10.862  10.636 -34.141
  651    HD2  PHE  91           HD2      PHE  91  10.823  10.507 -38.403
  652    HE1  PHE  91           HE1      PHE  91  10.745   8.185 -34.079
  653    HE2  PHE  91           HE2      PHE  91  10.689   8.063 -38.328
  654    HZ   PHE  91           HZ       PHE  91  10.658   6.895 -36.166
  655    H    VAL  92           HN       VAL  92   8.778  14.048 -34.714
  656    HA   VAL  92           HA       VAL  92   9.217  16.752 -35.791
  657    HB   VAL  92           HB       VAL  92   7.239  15.940 -33.664
  658   HG11  VAL  92          HG11      VAL  92   6.288  18.153 -33.982
  659   HG12  VAL  92          HG12      VAL  92   7.543  18.535 -35.161
  660   HG13  VAL  92          HG13      VAL  92   7.973  18.256 -33.474
  661   HG21  VAL  92          HG21      VAL  92   6.761  16.531 -36.580
  662   HG22  VAL  92          HG22      VAL  92   5.504  16.284 -35.366
  663   HG23  VAL  92          HG23      VAL  92   6.594  14.964 -35.789
  664    H    ASP  93           HN       ASP  93  11.148  17.389 -34.999
  665    HA   ASP  93           HA       ASP  93  12.006  16.865 -32.268
  666    HB2  ASP  93           HB2      ASP  93  13.077  18.519 -34.568
  667    HB3  ASP  93           HB1      ASP  93  13.534  18.979 -32.929
  668    H    HIS  94           HN       HIS  94  10.179  17.610 -31.027
  669    HA   HIS  94           HA       HIS  94   9.038  20.188 -31.504
  670    HB2  HIS  94           HB2      HIS  94   7.901  18.111 -30.462
  671    HB3  HIS  94           HB1      HIS  94   8.654  18.633 -28.957
  672    HD1  HIS  94           HD1      HIS  94   7.202  20.116 -27.582
  673    HD2  HIS  94           HD2      HIS  94   6.312  20.352 -31.641
  674    HE1  HIS  94           HE1      HIS  94   5.275  21.728 -27.766
  675    HE2  HIS  94           HE2      HIS  94   4.676  21.758 -30.211
  676    H    ASN  95           HN       ASN  95  11.901  19.343 -30.109
  677    HA   ASN  95           HA       ASN  95  11.994  21.327 -28.048
  678    HB2  ASN  95           HB2      ASN  95  14.427  20.900 -27.998
  679    HB3  ASN  95           HB1      ASN  95  13.531  19.383 -28.012
  680   HD21  ASN  95          HD21      ASN  95  13.681  18.034 -29.792
  681   HD22  ASN  95          HD22      ASN  95  14.849  18.273 -31.047
  682    H    THR  96           HN       THR  96  12.591  21.261 -31.486
  683    HA   THR  96           HA       THR  96  13.119  24.155 -31.385
  684    HB   THR  96           HB       THR  96  14.085  23.781 -33.732
  685    HG1  THR  96           HG1      THR  96  13.755  21.775 -34.398
  686   HG21  THR  96          HG21      THR  96  16.265  22.999 -32.846
  687   HG22  THR  96          HG22      THR  96  15.466  22.577 -31.330
  688   HG23  THR  96          HG23      THR  96  15.528  24.259 -31.859
  689    H    ARG  97           HN       ARG  97  10.916  21.797 -32.126
  690    HA   ARG  97           HA       ARG  97   8.807  21.814 -32.994
  691    HB2  ARG  97           HB2      ARG  97   9.182  24.774 -33.440
  692    HB3  ARG  97           HB1      ARG  97   7.659  23.888 -33.357
  693    HG2  ARG  97           HG2      ARG  97   8.158  23.313 -31.020
  694    HG3  ARG  97           HG1      ARG  97   9.629  24.284 -31.136
  695    HD2  ARG  97           HD2      ARG  97   7.815  25.554 -30.083
  696    HD3  ARG  97           HD1      ARG  97   8.268  26.270 -31.633
  697    HE   ARG  97           HE       ARG  97   6.230  24.594 -32.268
  698   HH11  ARG  97          HH11      ARG  97   6.586  27.253 -30.005
  699   HH12  ARG  97          HH12      ARG  97   4.885  27.623 -30.003
  700   HH21  ARG  97          HH21      ARG  97   4.022  25.104 -32.277
  701   HH22  ARG  97          HH22      ARG  97   3.435  26.410 -31.292
  702    H    THR  98           HN       THR  98  11.099  21.343 -34.533
  703    HA   THR  98           HA       THR  98  10.282  22.312 -37.196
  704    HB   THR  98           HB       THR  98  12.595  21.410 -37.882
  705    HG1  THR  98           HG1      THR  98  13.308  20.227 -36.213
  706   HG21  THR  98          HG21      THR  98  12.130  23.821 -37.646
  707   HG22  THR  98          HG22      THR  98  13.752  23.437 -37.066
  708   HG23  THR  98          HG23      THR  98  12.446  23.713 -35.913
  709    H    THR  99           HN       THR  99  10.245  20.739 -38.979
  710    HA   THR  99           HA       THR  99   9.463  18.057 -38.018
  711    HB   THR  99           HB       THR  99   8.694  17.778 -40.490
  712    HG1  THR  99           HG1      THR  99   9.270  20.567 -40.392
  713   HG21  THR  99          HG21      THR  99   7.033  18.090 -38.683
  714   HG22  THR  99          HG22      THR  99   6.551  19.046 -40.090
  715   HG23  THR  99          HG23      THR  99   7.307  19.832 -38.708
  716    H    THR 100           HN       THR 100  10.916  16.378 -38.313
  717    HA   THR 100           HA       THR 100  13.121  16.884 -40.183
  718    HB   THR 100           HB       THR 100  13.738  17.231 -37.718
  719    HG1  THR 100           HG1      THR 100  15.656  16.831 -38.494
  720   HG21  THR 100          HG21      THR 100  14.289  15.106 -36.501
  721   HG22  THR 100          HG22      THR 100  13.366  14.231 -37.725
  722   HG23  THR 100          HG23      THR 100  12.562  15.406 -36.684
  723    H    PHE 101           HN       PHE 101  14.178  14.970 -40.945
  724    HA   PHE 101           HA       PHE 101  12.466  12.579 -40.818
  725    HB2  PHE 101           HB2      PHE 101  14.074  13.746 -43.102
  726    HB3  PHE 101           HB1      PHE 101  13.621  11.993 -43.061
  727    HD1  PHE 101           HD1      PHE 101  11.483  11.315 -43.655
  728    HD2  PHE 101           HD2      PHE 101  12.263  15.454 -43.087
  729    HE1  PHE 101           HE1      PHE 101   9.297  11.852 -44.640
  730    HE2  PHE 101           HE2      PHE 101  10.075  16.007 -44.074
  731    HZ   PHE 101           HZ       PHE 101   8.588  14.200 -44.859
  732    H    LYS 102           HN       LYS 102  13.452  11.488 -39.207
  733    HA   LYS 102           HA       LYS 102  16.220  10.661 -39.668
  734    HB2  LYS 102           HB2      LYS 102  15.083  11.785 -37.119
  735    HB3  LYS 102           HB1      LYS 102  16.470  10.709 -37.100
  736    HG2  LYS 102           HG2      LYS 102  17.589  12.343 -38.683
  737    HG3  LYS 102           HG1      LYS 102  16.260  13.447 -38.318
  738    HD2  LYS 102           HD2      LYS 102  17.961  12.186 -36.175
  739    HD3  LYS 102           HD1      LYS 102  18.369  13.725 -36.931
  740    HE2  LYS 102           HE2      LYS 102  15.654  13.311 -35.755
  741    HE3  LYS 102           HE1      LYS 102  17.018  13.670 -34.701
  742    HZ1  LYS 102           HZ1      LYS 102  15.768  15.660 -35.404
  743    HZ2  LYS 102           HZ2      LYS 102  16.213  15.347 -37.013
  744    HZ3  LYS 102           HZ3      LYS 102  17.404  15.703 -35.863
  745    H    ASP 103           HN       ASP 103  15.927   8.581 -40.142
  746    HA   ASP 103           HA       ASP 103  13.912   7.002 -38.817
  747    HB2  ASP 103           HB2      ASP 103  14.843   5.177 -40.266
  748    HB3  ASP 103           HB1      ASP 103  14.257   6.575 -41.154
  749    HA   PRO 104           HA       PRO 104  16.700   5.713 -35.598
  750    HB2  PRO 104           HB2      PRO 104  14.653   3.726 -34.906
  751    HB3  PRO 104           HB1      PRO 104  15.165   5.133 -33.967
  752    HG2  PRO 104           HG2      PRO 104  12.726   4.941 -35.161
  753    HG3  PRO 104           HG1      PRO 104  13.544   6.485 -34.869
  754    HD2  PRO 104           HD2      PRO 104  13.281   4.919 -37.396
  755    HD3  PRO 104           HD1      PRO 104  13.276   6.680 -37.150
  756    H    ARG 105           HN       ARG 105  15.064   3.679 -37.890
  757    HA   ARG 105           HA       ARG 105  17.114   1.607 -37.558
  758    HB2  ARG 105           HB2      ARG 105  14.375   1.399 -38.819
  759    HB3  ARG 105           HB1      ARG 105  15.543   0.090 -38.726
  760    HG2  ARG 105           HG2      ARG 105  13.979   1.379 -36.511
  761    HG3  ARG 105           HG1      ARG 105  14.017  -0.322 -36.999
  762    HD2  ARG 105           HD2      ARG 105  16.479  -0.274 -36.322
  763    HD3  ARG 105           HD1      ARG 105  16.124   1.263 -35.545
  764    HE   ARG 105           HE       ARG 105  14.449  -1.013 -34.809
  765   HH11  ARG 105          HH11      ARG 105  17.102   1.150 -33.935
  766   HH12  ARG 105          HH12      ARG 105  17.143   0.606 -32.285
  767   HH21  ARG 105          HH21      ARG 105  14.547  -1.716 -32.657
  768   HH22  ARG 105          HH22      ARG 105  15.692  -1.003 -31.560
  769    HA   PRO 106           HA       PRO 106  18.683   3.548 -41.212
  770    HB2  PRO 106           HB2      PRO 106  20.536   1.683 -41.974
  771    HB3  PRO 106           HB1      PRO 106  20.788   2.836 -40.610
  772    HG2  PRO 106           HG2      PRO 106  19.963  -0.050 -40.559
  773    HG3  PRO 106           HG1      PRO 106  21.071   0.831 -39.492
  774    HD2  PRO 106           HD2      PRO 106  18.512   0.228 -38.812
  775    HD3  PRO 106           HD1      PRO 106  19.381   1.680 -38.203
  776    H    GLY 107           HN       GLY 107  17.455   3.656 -42.961
  777    HA2  GLY 107           HA2      GLY 107  16.906   3.073 -45.150
  778    HA3  GLY 107           HA1      GLY 107  17.511   1.429 -44.844
  779    H    PHE 108           HN       PHE 108  15.832   1.123 -42.406
  780    HA   PHE 108           HA       PHE 108  13.816   0.085 -41.912
  781    HB2  PHE 108           HB2      PHE 108  13.256   2.639 -43.161
  782    HB3  PHE 108           HB1      PHE 108  11.927   1.466 -43.439
  783    HD1  PHE 108           HD1      PHE 108  13.796   3.395 -40.913
  784    HD2  PHE 108           HD2      PHE 108  10.617   0.634 -41.595
  785    HE1  PHE 108           HE1      PHE 108  12.945   3.813 -38.651
  786    HE2  PHE 108           HE2      PHE 108   9.765   1.060 -39.324
  787    HZ   PHE 108           HZ       PHE 108  10.932   2.652 -37.849
  788    H    GLU 109           HN       GLU 109  15.291  -0.649 -44.492
  789    HA   GLU 109           HA       GLU 109  15.143  -2.254 -46.080
  790    HB2  GLU 109           HB2      GLU 109  14.057  -3.578 -44.302
  791    HB3  GLU 109           HB1      GLU 109  12.497  -2.929 -44.777
  792    HG2  GLU 109           HG2      GLU 109  12.742  -5.149 -45.654
  793    HG3  GLU 109           HG1      GLU 109  12.758  -3.995 -46.983
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1 -35.488   9.832   4.525
    2    H2   GLY   1           HT2      GLY   1 -37.035  10.023   5.192
    3    H3   GLY   1           HT3      GLY   1 -35.998  11.358   5.056
    4    HA2  GLY   1           HA1      GLY   1 -37.680  11.433   3.347
    5    HA3  GLY   1           HA2      GLY   1 -36.080  11.221   2.650
    6    H    SER   2           HN       SER   2 -37.222  10.386   0.777
    7    HA   SER   2           HA       SER   2 -38.721   7.961   0.985
    8    HB2  SER   2           HB2      SER   2 -37.477   9.247  -1.455
    9    HB3  SER   2           HB1      SER   2 -38.757   8.032  -1.454
   10    HG   SER   2           HG       SER   2 -39.880   9.874  -1.592
   11    H    HIS   3           HN       HIS   3 -38.145   5.901   0.193
   12    HA   HIS   3           HA       HIS   3 -35.535   5.040   0.836
   13    HB2  HIS   3           HB2      HIS   3 -37.936   3.763  -0.393
   14    HB3  HIS   3           HB1      HIS   3 -36.396   2.924  -0.492
   15    HD1  HIS   3           HD1      HIS   3 -39.202   2.536   1.323
   16    HD2  HIS   3           HD2      HIS   3 -35.285   3.300   2.509
   17    HE1  HIS   3           HE1      HIS   3 -39.040   1.743   3.709
   18    HE2  HIS   3           HE2      HIS   3 -36.712   2.353   4.449
   19    H    MET   4           HN       MET   4 -33.869   5.931  -0.448
   20    HA   MET   4           HA       MET   4 -34.109   5.519  -3.342
   21    HB2  MET   4           HB2      MET   4 -32.184   7.081  -3.522
   22    HB3  MET   4           HB1      MET   4 -33.580   7.806  -2.745
   23    HG2  MET   4           HG2      MET   4 -32.510   7.388  -0.549
   24    HG3  MET   4           HG1      MET   4 -31.085   6.800  -1.402
   25    HE1  MET   4           HE1      MET   4 -31.139   8.826  -3.942
   26    HE2  MET   4           HE2      MET   4 -29.663   8.344  -3.106
   27    HE3  MET   4           HE3      MET   4 -30.007  10.052  -3.375
   28    H    GLN   5           HN       GLN   5 -32.711   4.158  -4.409
   29    HA   GLN   5           HA       GLN   5 -31.356   2.255  -2.726
   30    HB2  GLN   5           HB2      GLN   5 -32.753   1.551  -4.651
   31    HB3  GLN   5           HB1      GLN   5 -31.601   2.315  -5.733
   32    HG2  GLN   5           HG2      GLN   5 -29.867   0.766  -5.005
   33    HG3  GLN   5           HG1      GLN   5 -31.001   0.000  -3.893
   34   HE21  GLN   5          HE21      GLN   5 -32.682  -1.245  -4.706
   35   HE22  GLN   5          HE22      GLN   5 -32.623  -1.906  -6.328
   36    H    TYR   6           HN       TYR   6 -29.226   1.820  -2.600
   37    HA   TYR   6           HA       TYR   6 -27.412   3.598  -4.081
   38    HB2  TYR   6           HB2      TYR   6 -27.380   2.870  -1.155
   39    HB3  TYR   6           HB1      TYR   6 -25.862   3.254  -1.960
   40    HD1  TYR   6           HD1      TYR   6 -25.497   5.526  -2.878
   41    HD2  TYR   6           HD2      TYR   6 -28.982   4.555  -0.631
   42    HE1  TYR   6           HE1      TYR   6 -25.932   7.917  -2.534
   43    HE2  TYR   6           HE2      TYR   6 -29.428   6.946  -0.279
   44    HH   TYR   6           HH       TYR   6 -28.323   9.057  -0.314
   45    H    LYS   7           HN       LYS   7 -25.172   2.724  -4.203
   46    HA   LYS   7           HA       LYS   7 -25.274  -0.197  -4.636
   47    HB2  LYS   7           HB2      LYS   7 -25.578   1.292  -6.715
   48    HB3  LYS   7           HB1      LYS   7 -23.886   1.746  -6.511
   49    HG2  LYS   7           HG2      LYS   7 -24.876  -1.070  -6.949
   50    HG3  LYS   7           HG1      LYS   7 -24.279   0.003  -8.204
   51    HD2  LYS   7           HD2      LYS   7 -22.126   0.148  -6.953
   52    HD3  LYS   7           HD1      LYS   7 -22.740  -1.116  -5.886
   53    HE2  LYS   7           HE2      LYS   7 -22.367  -1.343  -8.868
   54    HE3  LYS   7           HE1      LYS   7 -21.316  -2.042  -7.637
   55    HZ1  LYS   7           HZ1      LYS   7 -22.812  -3.703  -8.476
   56    HZ2  LYS   7           HZ2      LYS   7 -24.163  -2.739  -8.133
   57    HZ3  LYS   7           HZ3      LYS   7 -23.223  -3.360  -6.870
   58    H    LEU   8           HN       LEU   8 -23.425  -1.344  -4.093
   59    HA   LEU   8           HA       LEU   8 -21.035   0.208  -3.330
   60    HB2  LEU   8           HB2      LEU   8 -22.292  -0.377  -1.250
   61    HB3  LEU   8           HB1      LEU   8 -22.257  -2.045  -1.738
   62    HG   LEU   8           HG       LEU   8 -19.699  -1.866  -1.625
   63   HD11  LEU   8          HD11      LEU   8 -18.872  -0.181  -0.035
   64   HD12  LEU   8          HD12      LEU   8 -20.463   0.577  -0.022
   65   HD13  LEU   8          HD13      LEU   8 -19.506   0.555  -1.504
   66   HD21  LEU   8          HD21      LEU   8 -19.729  -2.257   0.800
   67   HD22  LEU   8          HD22      LEU   8 -20.999  -3.144  -0.048
   68   HD23  LEU   8          HD23      LEU   8 -21.393  -1.677   0.850
   69    H    ILE   9           HN       ILE   9 -19.090  -0.718  -3.655
   70    HA   ILE   9           HA       ILE   9 -19.016  -3.416  -4.816
   71    HB   ILE   9           HB       ILE   9 -17.447  -1.013  -5.809
   72   HG12  ILE   9          HG12      ILE   9 -19.439  -2.800  -7.268
   73   HG13  ILE   9          HG11      ILE   9 -19.835  -1.162  -6.626
   74   HG21  ILE   9          HG21      ILE   9 -17.266  -3.934  -6.532
   75   HG22  ILE   9          HG22      ILE   9 -16.001  -2.911  -5.842
   76   HG23  ILE   9          HG23      ILE   9 -16.558  -2.638  -7.495
   77   HD11  ILE   9          HD11      ILE   9 -19.378  -1.046  -9.003
   78   HD12  ILE   9          HD12      ILE   9 -17.827  -1.858  -8.789
   79   HD13  ILE   9          HD13      ILE   9 -18.074  -0.241  -8.125
   80    H    LEU  10           HN       LEU  10 -17.543  -4.714  -3.826
   81    HA   LEU  10           HA       LEU  10 -15.775  -3.410  -1.897
   82    HB2  LEU  10           HB2      LEU  10 -16.426  -6.348  -2.073
   83    HB3  LEU  10           HB1      LEU  10 -15.422  -5.603  -0.867
   84    HG   LEU  10           HG       LEU  10 -17.349  -5.940   0.298
   85   HD11  LEU  10          HD11      LEU  10 -16.751  -3.571   0.385
   86   HD12  LEU  10          HD12      LEU  10 -18.450  -3.908   0.719
   87   HD13  LEU  10          HD13      LEU  10 -17.979  -3.265  -0.857
   88   HD21  LEU  10          HD21      LEU  10 -19.601  -5.788  -0.539
   89   HD22  LEU  10          HD22      LEU  10 -18.640  -6.815  -1.603
   90   HD23  LEU  10          HD23      LEU  10 -19.017  -5.159  -2.076
   91    H    ASN  11           HN       ASN  11 -13.998  -2.809  -2.885
   92    HA   ASN  11           HA       ASN  11 -12.652  -4.649  -4.734
   93    HB2  ASN  11           HB2      ASN  11 -12.102  -1.751  -3.984
   94    HB3  ASN  11           HB1      ASN  11 -11.106  -2.691  -5.068
   95   HD21  ASN  11          HD21      ASN  11 -11.538  -2.517  -7.139
   96   HD22  ASN  11          HD22      ASN  11 -13.008  -1.944  -7.822
   97    H    GLY  12           HN       GLY  12 -12.065  -6.141  -3.136
   98    HA2  GLY  12           HA2      GLY  12  -9.548  -5.439  -1.846
   99    HA3  GLY  12           HA1      GLY  12 -10.851  -6.002  -0.787
  100    H    LYS  13           HN       LYS  13  -8.151  -7.112  -1.882
  101    HA   LYS  13           HA       LYS  13  -8.600  -9.388  -3.398
  102    HB2  LYS  13           HB2      LYS  13  -6.550  -8.924  -1.234
  103    HB3  LYS  13           HB1      LYS  13  -6.581 -10.366  -2.235
  104    HG2  LYS  13           HG2      LYS  13  -6.420  -8.837  -4.230
  105    HG3  LYS  13           HG1      LYS  13  -6.071  -7.535  -3.086
  106    HD2  LYS  13           HD2      LYS  13  -4.163  -8.798  -2.231
  107    HD3  LYS  13           HD1      LYS  13  -4.526 -10.113  -3.349
  108    HE2  LYS  13           HE2      LYS  13  -4.186  -8.544  -5.231
  109    HE3  LYS  13           HE1      LYS  13  -3.704  -7.309  -4.070
  110    HZ1  LYS  13           HZ1      LYS  13  -1.789  -8.419  -5.027
  111    HZ2  LYS  13           HZ2      LYS  13  -2.349  -9.920  -4.469
  112    HZ3  LYS  13           HZ3      LYS  13  -1.881  -8.725  -3.358
  113    H    THR  14           HN       THR  14  -9.542  -8.831  -0.137
  114    HA   THR  14           HA       THR  14  -9.656 -11.643   0.574
  115    HB   THR  14           HB       THR  14 -10.953 -10.760   2.565
  116    HG1  THR  14           HG1      THR  14 -10.058  -8.188   1.735
  117   HG21  THR  14          HG21      THR  14  -8.210  -9.617   2.039
  118   HG22  THR  14          HG22      THR  14  -8.570 -11.209   2.705
  119   HG23  THR  14          HG23      THR  14  -8.966  -9.757   3.624
  120    H    LEU  15           HN       LEU  15 -12.039  -9.069  -0.090
  121    HA   LEU  15           HA       LEU  15 -13.903 -11.129  -1.024
  122    HB2  LEU  15           HB2      LEU  15 -14.282  -9.268   1.204
  123    HB3  LEU  15           HB1      LEU  15 -15.577  -9.235   0.041
  124    HG   LEU  15           HG       LEU  15 -16.203 -10.735   1.770
  125   HD11  LEU  15          HD11      LEU  15 -16.822 -11.444  -0.426
  126   HD12  LEU  15          HD12      LEU  15 -16.395 -12.863   0.536
  127   HD13  LEU  15          HD13      LEU  15 -15.262 -12.224  -0.657
  128   HD21  LEU  15          HD21      LEU  15 -13.606 -12.197   1.319
  129   HD22  LEU  15          HD22      LEU  15 -14.874 -12.640   2.462
  130   HD23  LEU  15          HD23      LEU  15 -13.960 -11.149   2.691
  131    H    LYS  16           HN       LYS  16 -13.922 -10.675  -3.164
  132    HA   LYS  16           HA       LYS  16 -14.429  -7.881  -3.948
  133    HB2  LYS  16           HB2      LYS  16 -13.584 -10.177  -5.731
  134    HB3  LYS  16           HB1      LYS  16 -13.757  -8.498  -6.212
  135    HG2  LYS  16           HG2      LYS  16 -11.554  -8.361  -5.857
  136    HG3  LYS  16           HG1      LYS  16 -11.961  -8.345  -4.144
  137    HD2  LYS  16           HD2      LYS  16 -10.219  -9.975  -4.852
  138    HD3  LYS  16           HD1      LYS  16 -11.560 -10.657  -3.932
  139    HE2  LYS  16           HE2      LYS  16 -12.579 -11.412  -6.041
  140    HE3  LYS  16           HE1      LYS  16 -11.208 -10.748  -6.930
  141    HZ1  LYS  16           HZ1      LYS  16  -9.754 -12.294  -5.789
  142    HZ2  LYS  16           HZ2      LYS  16 -10.998 -13.135  -6.575
  143    HZ3  LYS  16           HZ3      LYS  16 -11.055 -12.911  -4.898
  144    H    GLY  17           HN       GLY  17 -16.405  -7.358  -4.579
  145    HA2  GLY  17           HA2      GLY  17 -18.175  -8.900  -6.057
  146    HA3  GLY  17           HA1      GLY  17 -18.549  -9.191  -4.362
  147    H    GLU  18           HN       GLU  18 -20.626  -8.183  -5.311
  148    HA   GLU  18           HA       GLU  18 -20.539  -5.318  -4.672
  149    HB2  GLU  18           HB2      GLU  18 -21.926  -6.471  -7.104
  150    HB3  GLU  18           HB1      GLU  18 -22.018  -4.799  -6.576
  151    HG2  GLU  18           HG2      GLU  18 -19.695  -4.461  -7.041
  152    HG3  GLU  18           HG1      GLU  18 -19.471  -6.176  -7.388
  153    H    THR  19           HN       THR  19 -22.724  -4.406  -4.293
  154    HA   THR  19           HA       THR  19 -24.938  -6.175  -3.866
  155    HB   THR  19           HB       THR  19 -23.482  -6.648  -1.872
  156    HG1  THR  19           HG1      THR  19 -25.289  -6.981  -0.819
  157   HG21  THR  19          HG21      THR  19 -22.554  -4.385  -1.543
  158   HG22  THR  19          HG22      THR  19 -23.389  -4.931  -0.083
  159   HG23  THR  19          HG23      THR  19 -24.165  -3.776  -1.163
  160    H    THR  20           HN       THR  20 -26.722  -4.898  -2.591
  161    HA   THR  20           HA       THR  20 -26.597  -2.019  -3.102
  162    HB   THR  20           HB       THR  20 -28.883  -2.070  -4.125
  163    HG1  THR  20           HG1      THR  20 -28.408  -4.861  -4.467
  164   HG21  THR  20          HG21      THR  20 -28.185  -2.949  -6.369
  165   HG22  THR  20          HG22      THR  20 -26.710  -3.555  -5.614
  166   HG23  THR  20          HG23      THR  20 -27.033  -1.823  -5.653
  167    H    THR  21           HN       THR  21 -28.236  -0.829  -1.904
  168    HA   THR  21           HA       THR  21 -29.933  -2.317  -0.084
  169    HB   THR  21           HB       THR  21 -27.660  -2.082   1.108
  170    HG1  THR  21           HG1      THR  21 -29.314  -0.841   2.842
  171   HG21  THR  21          HG21      THR  21 -27.356   0.134   2.264
  172   HG22  THR  21          HG22      THR  21 -28.635   0.798   1.244
  173   HG23  THR  21          HG23      THR  21 -27.127   0.247   0.514
  174    H    GLU  22           HN       GLU  22 -31.442  -0.937   1.055
  175    HA   GLU  22           HA       GLU  22 -32.023   1.492  -0.489
  176    HB2  GLU  22           HB2      GLU  22 -34.240   1.358   0.837
  177    HB3  GLU  22           HB1      GLU  22 -33.968   0.121  -0.383
  178    HG2  GLU  22           HG2      GLU  22 -33.384  -1.494   1.285
  179    HG3  GLU  22           HG1      GLU  22 -33.422  -0.226   2.561
  180    H    ALA  23           HN       ALA  23 -32.127   3.519   0.451
  181    HA   ALA  23           HA       ALA  23 -31.716   3.679   3.370
  182    HB1  ALA  23           HB1      ALA  23 -29.996   5.171   1.370
  183    HB2  ALA  23           HB2      ALA  23 -29.481   3.772   2.310
  184    HB3  ALA  23           HB3      ALA  23 -29.894   5.278   3.127
  185    H    VAL  24           HN       VAL  24 -32.574   5.614   4.304
  186    HA   VAL  24           HA       VAL  24 -34.250   7.185   2.494
  187    HB   VAL  24           HB       VAL  24 -35.350   7.999   4.579
  188   HG11  VAL  24          HG11      VAL  24 -35.256   5.015   4.165
  189   HG12  VAL  24          HG12      VAL  24 -36.324   6.164   3.358
  190   HG13  VAL  24          HG13      VAL  24 -36.494   5.867   5.087
  191   HG21  VAL  24          HG21      VAL  24 -33.464   7.673   6.113
  192   HG22  VAL  24          HG22      VAL  24 -33.614   5.925   5.923
  193   HG23  VAL  24          HG23      VAL  24 -34.911   6.844   6.687
  194    H    ASP  25           HN       ASP  25 -31.233   7.399   3.403
  195    HA   ASP  25           HA       ASP  25 -31.025  10.212   3.114
  196    HB2  ASP  25           HB2      ASP  25 -31.605   9.992   5.576
  197    HB3  ASP  25           HB1      ASP  25 -30.101   9.100   5.779
  198    H    ALA  26           HN       ALA  26 -28.702  10.830   3.044
  199    HA   ALA  26           HA       ALA  26 -27.206   8.792   1.690
  200    HB1  ALA  26           HB1      ALA  26 -27.159  11.157   0.986
  201    HB2  ALA  26           HB2      ALA  26 -25.546  10.529   1.323
  202    HB3  ALA  26           HB3      ALA  26 -26.345  11.576   2.495
  203    H    ALA  27           HN       ALA  27 -27.091  10.318   4.863
  204    HA   ALA  27           HA       ALA  27 -24.499   9.345   5.568
  205    HB1  ALA  27           HB1      ALA  27 -26.753  10.206   7.376
  206    HB2  ALA  27           HB2      ALA  27 -25.540  11.273   6.673
  207    HB3  ALA  27           HB3      ALA  27 -25.056  10.032   7.829
  208    H    THR  28           HN       THR  28 -27.746   8.103   5.839
  209    HA   THR  28           HA       THR  28 -27.194   5.988   7.641
  210    HB   THR  28           HB       THR  28 -29.386   5.900   5.579
  211    HG1  THR  28           HG1      THR  28 -30.293   7.146   7.734
  212   HG21  THR  28          HG21      THR  28 -29.256   5.090   8.496
  213   HG22  THR  28          HG22      THR  28 -29.156   3.990   7.122
  214   HG23  THR  28          HG23      THR  28 -30.649   4.879   7.432
  215    H    ALA  29           HN       ALA  29 -26.759   6.357   4.213
  216    HA   ALA  29           HA       ALA  29 -26.811   3.575   3.540
  217    HB1  ALA  29           HB1      ALA  29 -25.944   4.282   1.378
  218    HB2  ALA  29           HB2      ALA  29 -25.635   5.898   2.014
  219    HB3  ALA  29           HB3      ALA  29 -27.291   5.304   1.878
  220    H    GLU  30           HN       GLU  30 -24.307   5.962   4.211
  221    HA   GLU  30           HA       GLU  30 -22.097   4.262   3.746
  222    HB2  GLU  30           HB2      GLU  30 -22.347   6.913   4.207
  223    HB3  GLU  30           HB1      GLU  30 -21.882   6.376   5.807
  224    HG2  GLU  30           HG2      GLU  30 -19.898   5.253   4.775
  225    HG3  GLU  30           HG1      GLU  30 -20.321   6.069   3.269
  226    H    LYS  31           HN       LYS  31 -23.639   5.307   6.782
  227    HA   LYS  31           HA       LYS  31 -22.143   3.871   8.560
  228    HB2  LYS  31           HB2      LYS  31 -25.036   4.663   8.693
  229    HB3  LYS  31           HB1      LYS  31 -24.198   3.912  10.043
  230    HG2  LYS  31           HG2      LYS  31 -23.577   6.562   8.754
  231    HG3  LYS  31           HG1      LYS  31 -24.193   6.272  10.380
  232    HD2  LYS  31           HD2      LYS  31 -21.466   5.522   9.320
  233    HD3  LYS  31           HD1      LYS  31 -21.832   6.796  10.483
  234    HE2  LYS  31           HE2      LYS  31 -22.366   3.861  10.936
  235    HE3  LYS  31           HE1      LYS  31 -20.933   4.712  11.509
  236    HZ1  LYS  31           HZ1      LYS  31 -22.911   4.409  13.096
  237    HZ2  LYS  31           HZ2      LYS  31 -23.623   5.680  12.224
  238    HZ3  LYS  31           HZ3      LYS  31 -22.153   5.926  13.026
  239    H    VAL  32           HN       VAL  32 -25.007   2.679   6.813
  240    HA   VAL  32           HA       VAL  32 -25.112   0.196   8.198
  241    HB   VAL  32           HB       VAL  32 -26.262   0.988   5.514
  242   HG11  VAL  32          HG11      VAL  32 -26.864  -1.444   7.192
  243   HG12  VAL  32          HG12      VAL  32 -25.971  -1.444   5.673
  244   HG13  VAL  32          HG13      VAL  32 -27.674  -0.985   5.695
  245   HG21  VAL  32          HG21      VAL  32 -27.173   2.244   7.396
  246   HG22  VAL  32          HG22      VAL  32 -27.529   0.735   8.240
  247   HG23  VAL  32          HG23      VAL  32 -28.373   1.128   6.742
  248    H    PHE  33           HN       PHE  33 -23.873   1.081   4.977
  249    HA   PHE  33           HA       PHE  33 -22.956  -1.538   4.375
  250    HB2  PHE  33           HB2      PHE  33 -22.564   1.147   3.156
  251    HB3  PHE  33           HB1      PHE  33 -21.414  -0.105   2.744
  252    HD1  PHE  33           HD1      PHE  33 -23.560  -2.351   2.973
  253    HD2  PHE  33           HD2      PHE  33 -23.391   1.369   0.917
  254    HE1  PHE  33           HE1      PHE  33 -25.162  -3.201   1.308
  255    HE2  PHE  33           HE2      PHE  33 -24.988   0.528  -0.751
  256    HZ   PHE  33           HZ       PHE  33 -25.764  -1.777  -0.651
  257    H    LYS  34           HN       LYS  34 -21.552   1.013   6.292
  258    HA   LYS  34           HA       LYS  34 -18.867   0.118   6.030
  259    HB2  LYS  34           HB2      LYS  34 -20.242   1.882   8.035
  260    HB3  LYS  34           HB1      LYS  34 -18.545   1.528   8.143
  261    HG2  LYS  34           HG2      LYS  34 -18.459   2.408   5.696
  262    HG3  LYS  34           HG1      LYS  34 -20.003   3.150   6.105
  263    HD2  LYS  34           HD2      LYS  34 -18.354   4.792   6.563
  264    HD3  LYS  34           HD1      LYS  34 -18.897   4.148   8.114
  265    HE2  LYS  34           HE2      LYS  34 -16.495   4.346   8.119
  266    HE3  LYS  34           HE1      LYS  34 -16.946   2.640   8.150
  267    HZ1  LYS  34           HZ1      LYS  34 -16.436   2.505   5.813
  268    HZ2  LYS  34           HZ2      LYS  34 -15.103   3.150   6.629
  269    HZ3  LYS  34           HZ3      LYS  34 -16.123   4.168   5.736
  270    H    GLN  35           HN       GLN  35 -21.448  -0.453   8.351
  271    HA   GLN  35           HA       GLN  35 -19.953  -2.227   9.995
  272    HB2  GLN  35           HB2      GLN  35 -22.063  -1.080  10.702
  273    HB3  GLN  35           HB1      GLN  35 -22.960  -2.113   9.602
  274    HG2  GLN  35           HG2      GLN  35 -23.210  -3.041  11.743
  275    HG3  GLN  35           HG1      GLN  35 -22.076  -4.077  10.881
  276   HE21  GLN  35          HE21      GLN  35 -22.523  -3.652  13.741
  277   HE22  GLN  35          HE22      GLN  35 -20.982  -3.209  14.395
  278    H    TYR  36           HN       TYR  36 -21.829  -2.507   7.096
  279    HA   TYR  36           HA       TYR  36 -22.058  -5.320   6.929
  280    HB2  TYR  36           HB2      TYR  36 -23.500  -4.051   5.546
  281    HB3  TYR  36           HB1      TYR  36 -22.191  -3.033   4.980
  282    HD1  TYR  36           HD1      TYR  36 -23.287  -6.611   4.834
  283    HD2  TYR  36           HD2      TYR  36 -21.349  -3.361   2.924
  284    HE1  TYR  36           HE1      TYR  36 -23.063  -7.957   2.791
  285    HE2  TYR  36           HE2      TYR  36 -21.118  -4.673   0.859
  286    HH   TYR  36           HH       TYR  36 -21.050  -7.073   0.216
  287    H    ALA  37           HN       ALA  37 -19.820  -3.014   5.429
  288    HA   ALA  37           HA       ALA  37 -18.119  -4.948   4.256
  289    HB1  ALA  37           HB1      ALA  37 -17.477  -2.096   5.032
  290    HB2  ALA  37           HB2      ALA  37 -18.262  -2.584   3.531
  291    HB3  ALA  37           HB3      ALA  37 -16.604  -3.091   3.866
  292    H    ASN  38           HN       ASN  38 -18.316  -3.464   7.397
  293    HA   ASN  38           HA       ASN  38 -15.735  -4.036   8.381
  294    HB2  ASN  38           HB2      ASN  38 -17.359  -2.477   9.496
  295    HB3  ASN  38           HB1      ASN  38 -18.331  -3.867   9.965
  296   HD21  ASN  38          HD21      ASN  38 -15.720  -1.832  10.825
  297   HD22  ASN  38          HD22      ASN  38 -15.178  -2.746  12.252
  298    H    ASP  39           HN       ASP  39 -18.722  -5.935   8.378
  299    HA   ASP  39           HA       ASP  39 -17.849  -8.073   9.959
  300    HB2  ASP  39           HB2      ASP  39 -19.916  -7.808   7.812
  301    HB3  ASP  39           HB1      ASP  39 -19.522  -9.403   8.441
  302    H    ASN  40           HN       ASN  40 -17.048  -7.235   6.707
  303    HA   ASN  40           HA       ASN  40 -15.897  -9.892   6.264
  304    HB2  ASN  40           HB2      ASN  40 -16.706  -7.695   4.364
  305    HB3  ASN  40           HB1      ASN  40 -15.689  -9.038   3.871
  306   HD21  ASN  40          HD21      ASN  40 -18.889  -7.999   4.638
  307   HD22  ASN  40          HD22      ASN  40 -19.694  -9.528   4.273
  308    H    GLY  41           HN       GLY  41 -15.025  -7.182   7.645
  309    HA2  GLY  41           HA2      GLY  41 -13.005  -6.225   8.158
  310    HA3  GLY  41           HA1      GLY  41 -12.255  -7.620   7.400
  311    H    VAL  42           HN       VAL  42 -14.399  -5.707   5.461
  312    HA   VAL  42           HA       VAL  42 -12.077  -4.780   3.963
  313    HB   VAL  42           HB       VAL  42 -14.954  -5.075   3.059
  314   HG11  VAL  42          HG11      VAL  42 -12.462  -4.202   1.587
  315   HG12  VAL  42          HG12      VAL  42 -13.882  -3.219   1.932
  316   HG13  VAL  42          HG13      VAL  42 -14.001  -4.580   0.812
  317   HG21  VAL  42          HG21      VAL  42 -14.000  -6.868   1.635
  318   HG22  VAL  42          HG22      VAL  42 -13.859  -7.213   3.361
  319   HG23  VAL  42          HG23      VAL  42 -12.450  -6.654   2.455
  320    H    ASP  43           HN       ASP  43 -11.509  -2.863   4.612
  321    HA   ASP  43           HA       ASP  43 -13.445  -0.720   4.319
  322    HB2  ASP  43           HB2      ASP  43 -13.302  -1.350   6.805
  323    HB3  ASP  43           HB1      ASP  43 -11.653  -0.734   6.751
  324    H    GLY  44           HN       GLY  44 -12.477   1.206   3.613
  325    HA2  GLY  44           HA2      GLY  44  -9.676   1.527   3.353
  326    HA3  GLY  44           HA1      GLY  44 -10.354   0.860   1.874
  327    H    GLU  45           HN       GLU  45  -9.452   3.006   1.112
  328    HA   GLU  45           HA       GLU  45 -10.634   5.462   1.747
  329    HB2  GLU  45           HB2      GLU  45  -9.349   4.388  -0.754
  330    HB3  GLU  45           HB1      GLU  45 -10.016   6.014  -0.706
  331    HG2  GLU  45           HG2      GLU  45  -8.528   6.551   1.170
  332    HG3  GLU  45           HG1      GLU  45  -7.847   4.928   1.082
  333    H    TRP  46           HN       TRP  46 -12.699   5.925   1.752
  334    HA   TRP  46           HA       TRP  46 -14.565   4.478   0.069
  335    HB2  TRP  46           HB2      TRP  46 -14.933   6.400   2.362
  336    HB3  TRP  46           HB1      TRP  46 -16.256   6.154   1.244
  337    HD1  TRP  46           HD1      TRP  46 -13.835   3.828   3.216
  338    HE1  TRP  46           HE1      TRP  46 -15.167   1.840   4.128
  339    HE3  TRP  46           HE3      TRP  46 -18.521   5.080   1.458
  340    HZ2  TRP  46           HZ2      TRP  46 -17.817   0.954   4.144
  341    HZ3  TRP  46           HZ3      TRP  46 -20.396   3.607   2.039
  342    HH2  TRP  46           HH2      TRP  46 -20.045   1.575   3.340
  343    H    THR  47           HN       THR  47 -14.703   5.035  -1.962
  344    HA   THR  47           HA       THR  47 -14.699   7.890  -2.684
  345    HB   THR  47           HB       THR  47 -14.566   6.309  -5.027
  346    HG1  THR  47           HG1      THR  47 -13.176   5.219  -2.863
  347   HG21  THR  47          HG21      THR  47 -12.426   7.869  -3.565
  348   HG22  THR  47          HG22      THR  47 -13.557   8.508  -4.758
  349   HG23  THR  47          HG23      THR  47 -12.333   7.337  -5.244
  350    H    TYR  48           HN       TYR  48 -16.289   8.531  -4.373
  351    HA   TYR  48           HA       TYR  48 -18.588   6.769  -4.623
  352    HB2  TYR  48           HB2      TYR  48 -19.078   7.897  -2.574
  353    HB3  TYR  48           HB1      TYR  48 -18.651   9.428  -3.214
  354    HD1  TYR  48           HD1      TYR  48 -20.220  10.800  -4.330
  355    HD2  TYR  48           HD2      TYR  48 -21.239   6.758  -3.412
  356    HE1  TYR  48           HE1      TYR  48 -22.561  11.258  -4.905
  357    HE2  TYR  48           HE2      TYR  48 -23.578   7.222  -3.990
  358    HH   TYR  48           HH       TYR  48 -25.091   9.233  -4.096
  359    H    ASP  49           HN       ASP  49 -19.964   7.287  -6.348
  360    HA   ASP  49           HA       ASP  49 -19.054   9.529  -8.074
  361    HB2  ASP  49           HB2      ASP  49 -18.521   7.327  -9.177
  362    HB3  ASP  49           HB1      ASP  49 -20.216   6.902  -9.102
  363    H    ASP  50           HN       ASP  50 -20.702  10.734  -9.087
  364    HA   ASP  50           HA       ASP  50 -23.117  10.826  -7.449
  365    HB2  ASP  50           HB2      ASP  50 -22.029  12.960  -8.005
  366    HB3  ASP  50           HB1      ASP  50 -22.150  12.595  -9.722
  367    H    ALA  51           HN       ALA  51 -22.243   9.973 -10.750
  368    HA   ALA  51           HA       ALA  51 -24.950   9.996 -11.694
  369    HB1  ALA  51           HB1      ALA  51 -23.022  10.405 -13.170
  370    HB2  ALA  51           HB2      ALA  51 -24.069   9.107 -13.748
  371    HB3  ALA  51           HB3      ALA  51 -22.539   8.720 -12.964
  372    H    THR  52           HN       THR  52 -22.889   7.584 -10.237
  373    HA   THR  52           HA       THR  52 -24.856   5.525 -10.917
  374    HB   THR  52           HB       THR  52 -23.016   3.944 -10.184
  375    HG1  THR  52           HG1      THR  52 -21.281   6.156 -10.511
  376   HG21  THR  52          HG21      THR  52 -22.338   5.819 -12.461
  377   HG22  THR  52          HG22      THR  52 -23.493   4.489 -12.567
  378   HG23  THR  52          HG23      THR  52 -21.786   4.158 -12.267
  379    H    LYS  53           HN       LYS  53 -23.829   7.360  -8.203
  380    HA   LYS  53           HA       LYS  53 -24.256   7.226  -5.930
  381    HB2  LYS  53           HB2      LYS  53 -26.471   5.493  -7.015
  382    HB3  LYS  53           HB1      LYS  53 -26.235   5.679  -5.285
  383    HG2  LYS  53           HG2      LYS  53 -27.915   7.227  -5.999
  384    HG3  LYS  53           HG1      LYS  53 -26.467   8.129  -5.550
  385    HD2  LYS  53           HD2      LYS  53 -25.864   8.254  -7.951
  386    HD3  LYS  53           HD1      LYS  53 -27.394   7.469  -8.345
  387    HE2  LYS  53           HE2      LYS  53 -28.608   9.301  -7.273
  388    HE3  LYS  53           HE1      LYS  53 -27.079  10.095  -6.905
  389    HZ1  LYS  53           HZ1      LYS  53 -28.159  10.991  -8.899
  390    HZ2  LYS  53           HZ2      LYS  53 -28.052   9.465  -9.638
  391    HZ3  LYS  53           HZ3      LYS  53 -26.638  10.320  -9.247
  392    H    THR  54           HN       THR  54 -22.464   5.378  -7.329
  393    HA   THR  54           HA       THR  54 -22.508   2.948  -5.780
  394    HB   THR  54           HB       THR  54 -20.475   3.850  -7.851
  395    HG1  THR  54           HG1      THR  54 -22.962   3.282  -8.251
  396   HG21  THR  54          HG21      THR  54 -19.810   1.522  -7.944
  397   HG22  THR  54          HG22      THR  54 -21.092   1.057  -6.828
  398   HG23  THR  54          HG23      THR  54 -19.734   2.034  -6.256
  399    H    TYR  55           HN       TYR  55 -21.733   3.022  -3.773
  400    HA   TYR  55           HA       TYR  55 -19.441   4.624  -3.054
  401    HB2  TYR  55           HB2      TYR  55 -20.941   2.473  -1.484
  402    HB3  TYR  55           HB1      TYR  55 -19.611   3.419  -0.834
  403    HD1  TYR  55           HD1      TYR  55 -23.144   3.234  -1.267
  404    HD2  TYR  55           HD2      TYR  55 -19.935   5.994  -0.768
  405    HE1  TYR  55           HE1      TYR  55 -24.737   4.957  -0.544
  406    HE2  TYR  55           HE2      TYR  55 -21.522   7.711  -0.032
  407    HH   TYR  55           HH       TYR  55 -24.754   7.018   0.770
  408    H    THR  56           HN       THR  56 -17.396   3.989  -3.415
  409    HA   THR  56           HA       THR  56 -16.932   1.125  -3.876
  410    HB   THR  56           HB       THR  56 -15.220   3.403  -4.909
  411    HG1  THR  56           HG1      THR  56 -16.280   3.061  -6.891
  412   HG21  THR  56          HG21      THR  56 -15.334   0.480  -5.686
  413   HG22  THR  56          HG22      THR  56 -14.092   1.209  -4.669
  414   HG23  THR  56          HG23      THR  56 -14.246   1.696  -6.358
  415    H    VAL  57           HN       VAL  57 -15.833   0.111  -2.348
  416    HA   VAL  57           HA       VAL  57 -14.031   1.712  -0.647
  417    HB   VAL  57           HB       VAL  57 -15.916   0.793   0.707
  418   HG11  VAL  57          HG11      VAL  57 -16.478  -1.248  -0.413
  419   HG12  VAL  57          HG12      VAL  57 -15.950  -1.645   1.217
  420   HG13  VAL  57          HG13      VAL  57 -14.861  -1.896  -0.142
  421   HG21  VAL  57          HG21      VAL  57 -13.767   1.206   1.741
  422   HG22  VAL  57          HG22      VAL  57 -13.229  -0.417   1.315
  423   HG23  VAL  57          HG23      VAL  57 -14.545  -0.200   2.468
  424    H    THR  58           HN       THR  58 -12.029   1.399  -1.150
  425    HA   THR  58           HA       THR  58 -11.248  -1.161  -2.367
  426    HB   THR  58           HB       THR  58  -9.750   1.453  -2.586
  427    HG1  THR  58           HG1      THR  58 -12.119   0.669  -3.750
  428   HG21  THR  58          HG21      THR  58  -8.811   0.434  -4.587
  429   HG22  THR  58          HG22      THR  58  -9.833  -0.988  -4.372
  430   HG23  THR  58          HG23      THR  58  -8.557  -0.632  -3.205
  431    H    GLU  59           HN       GLU  59  -9.789  -2.408  -1.393
  432    HA   GLU  59           HA       GLU  59  -8.709  -1.668   1.159
  433    HB2  GLU  59           HB2      GLU  59  -8.119  -4.090  -0.576
  434    HB3  GLU  59           HB1      GLU  59  -7.431  -3.855   1.000
  435    HG2  GLU  59           HG2      GLU  59  -9.871  -3.757   1.842
  436    HG3  GLU  59           HG1      GLU  59 -10.268  -4.471   0.280
  437    H    GLY  60           HN       GLY  60  -6.401  -1.540   1.697
  438    HA2  GLY  60           HA2      GLY  60  -4.600  -1.013  -0.540
  439    HA3  GLY  60           HA1      GLY  60  -4.972   0.364   0.491
  440    H    SER  61           HN       SER  61  -2.613   0.292   0.830
  441    HA   SER  61           HA       SER  61  -0.822  -0.038   2.176
  442    HB2  SER  61           HB2      SER  61  -2.790  -1.426   4.019
  443    HB3  SER  61           HB1      SER  61  -1.204  -0.797   4.464
  444    HG   SER  61           HG       SER  61  -2.873   0.655   5.014
  445    H    GLY  62           HN       GLY  62  -0.077  -2.212   3.816
  446    HA2  GLY  62           HA2      GLY  62  -0.213  -4.726   3.459
  447    HA3  GLY  62           HA1      GLY  62   0.140  -4.331   1.780
  448    H    GLY  63           HN       GLY  63   2.115  -5.473   1.739
  449    HA2  GLY  63           HA2      GLY  63   4.153  -5.126   3.664
  450    HA3  GLY  63           HA1      GLY  63   4.360  -5.796   2.052
  451    H    ALA  64           HN       ALA  64   3.045  -3.064   1.259
  452    HA   ALA  64           HA       ALA  64   3.623  -0.974   0.627
  453    HB1  ALA  64           HB1      ALA  64   6.013  -1.239   2.445
  454    HB2  ALA  64           HB2      ALA  64   4.433  -0.613   2.913
  455    HB3  ALA  64           HB3      ALA  64   5.406   0.252   1.722
  456    H    GLY  65           HN       GLY  65   6.605  -2.912   0.875
  457    HA2  GLY  65           HA2      GLY  65   7.911  -3.676  -0.911
  458    HA3  GLY  65           HA1      GLY  65   6.963  -2.677  -2.005
  459    H    GLY  66           HN       GLY  66   9.647  -2.755   0.227
  460    HA2  GLY  66           HA2      GLY  66  10.300   0.040  -0.313
  461    HA3  GLY  66           HA1      GLY  66  11.143  -1.026   0.803
  462    H    GLN  67           HN       GLN  67  10.674  -2.668  -2.027
  463    HA   GLN  67           HA       GLN  67  13.075  -1.660  -3.345
  464    HB2  GLN  67           HB2      GLN  67  12.731  -4.463  -2.252
  465    HB3  GLN  67           HB1      GLN  67  13.822  -4.110  -3.616
  466    HG2  GLN  67           HG2      GLN  67  13.998  -2.772  -0.925
  467    HG3  GLN  67           HG1      GLN  67  14.910  -4.212  -1.373
  468   HE21  GLN  67          HE21      GLN  67  16.866  -3.175  -1.121
  469   HE22  GLN  67          HE22      GLN  67  17.456  -2.009  -2.269
  470    H    GLY  68           HN       GLY  68  12.720  -1.521  -5.453
  471    HA2  GLY  68           HA2      GLY  68  10.444  -2.924  -6.626
  472    HA3  GLY  68           HA1      GLY  68  11.387  -1.649  -7.389
  473    H    MET  69           HN       MET  69  13.733  -2.274  -7.789
  474    HA   MET  69           HA       MET  69  15.271  -3.505  -8.888
  475    HB2  MET  69           HB2      MET  69  13.952  -5.759  -7.383
  476    HB3  MET  69           HB1      MET  69  15.466  -5.907  -8.264
  477    HG2  MET  69           HG2      MET  69  14.951  -4.097  -5.917
  478    HG3  MET  69           HG1      MET  69  15.855  -5.609  -5.890
  479    HE1  MET  69           HE1      MET  69  17.893  -4.391  -4.733
  480    HE2  MET  69           HE2      MET  69  17.022  -2.858  -4.747
  481    HE3  MET  69           HE3      MET  69  18.669  -2.943  -5.374
  482    H    ILE  70           HN       ILE  70  12.372  -3.329  -9.942
  483    HA   ILE  70           HA       ILE  70  12.796  -5.223 -12.140
  484    HB   ILE  70           HB       ILE  70  10.086  -4.724 -10.841
  485   HG12  ILE  70          HG12      ILE  70  11.516  -6.282  -9.571
  486   HG13  ILE  70          HG11      ILE  70  10.123  -7.097 -10.268
  487   HG21  ILE  70          HG21      ILE  70  10.728  -6.543 -13.185
  488   HG22  ILE  70          HG22      ILE  70   9.996  -4.946 -13.337
  489   HG23  ILE  70          HG23      ILE  70   9.140  -6.233 -12.483
  490   HD11  ILE  70          HD11      ILE  70  12.929  -7.159 -11.354
  491   HD12  ILE  70          HD12      ILE  70  11.535  -7.979 -12.059
  492   HD13  ILE  70          HD13      ILE  70  12.125  -8.454 -10.466
  493    H    GLN  71           HN       GLN  71  13.661  -3.357 -13.211
  494    HA   GLN  71           HA       GLN  71  11.625  -1.372 -13.942
  495    HB2  GLN  71           HB2      GLN  71  13.538   0.124 -14.488
  496    HB3  GLN  71           HB1      GLN  71  13.427  -0.304 -12.791
  497    HG2  GLN  71           HG2      GLN  71  15.189  -2.027 -13.182
  498    HG3  GLN  71           HG1      GLN  71  15.361  -1.399 -14.821
  499   HE21  GLN  71          HE21      GLN  71  17.285  -1.478 -12.604
  500   HE22  GLN  71          HE22      GLN  71  17.777   0.160 -12.330
  501    H    GLU  72           HN       GLU  72  12.345  -4.070 -15.090
  502    HA   GLU  72           HA       GLU  72  13.422  -3.660 -17.660
  503    HB2  GLU  72           HB2      GLU  72  12.684  -5.881 -18.193
  504    HB3  GLU  72           HB1      GLU  72  13.286  -5.880 -16.545
  505    HG2  GLU  72           HG2      GLU  72  10.975  -5.827 -15.716
  506    HG3  GLU  72           HG1      GLU  72  10.404  -5.839 -17.384
  507    HA   PRO  73           HA       PRO  73  10.181  -1.647 -19.728
  508    HB2  PRO  73           HB2      PRO  73  10.648  -2.304 -22.305
  509    HB3  PRO  73           HB1      PRO  73  11.801  -1.290 -21.353
  510    HG2  PRO  73           HG2      PRO  73  11.909  -4.248 -21.944
  511    HG3  PRO  73           HG1      PRO  73  13.199  -3.034 -22.060
  512    HD2  PRO  73           HD2      PRO  73  12.929  -4.692 -19.925
  513    HD3  PRO  73           HD1      PRO  73  13.579  -3.024 -19.788
  514    H    ALA  74           HN       ALA  74   8.535  -1.865 -21.453
  515    HA   ALA  74           HA       ALA  74   6.812  -2.795 -22.550
  516    HB1  ALA  74           HB1      ALA  74   8.352  -4.635 -23.117
  517    HB2  ALA  74           HB2      ALA  74   6.661  -5.117 -23.002
  518    HB3  ALA  74           HB3      ALA  74   7.779  -5.502 -21.693
  519    H    LEU  75           HN       LEU  75   5.170  -2.008 -21.478
  520    HA   LEU  75           HA       LEU  75   4.069  -3.504 -19.196
  521    HB2  LEU  75           HB2      LEU  75   3.409  -0.758 -20.287
  522    HB3  LEU  75           HB1      LEU  75   2.460  -1.545 -19.075
  523    HG   LEU  75           HG       LEU  75   3.804   0.055 -17.972
  524   HD11  LEU  75          HD11      LEU  75   5.149  -1.345 -16.459
  525   HD12  LEU  75          HD12      LEU  75   4.980  -2.700 -17.575
  526   HD13  LEU  75          HD13      LEU  75   3.556  -2.035 -16.774
  527   HD21  LEU  75          HD21      LEU  75   5.505   0.365 -19.697
  528   HD22  LEU  75          HD22      LEU  75   6.202  -1.208 -19.308
  529   HD23  LEU  75          HD23      LEU  75   6.245   0.093 -18.118
  530    HA   PRO  76           HA       PRO  76   1.070  -5.101 -22.074
  531    HB2  PRO  76           HB2      PRO  76  -0.917  -5.860 -20.417
  532    HB3  PRO  76           HB1      PRO  76   0.595  -6.719 -20.486
  533    HG2  PRO  76           HG2      PRO  76  -0.342  -4.750 -18.458
  534    HG3  PRO  76           HG1      PRO  76   0.622  -6.254 -18.237
  535    HD2  PRO  76           HD2      PRO  76   1.677  -3.680 -18.295
  536    HD3  PRO  76           HD1      PRO  76   2.599  -5.145 -18.649
  537    HA   PRO  77           HA       PRO  77  -1.359  -1.683 -23.444
  538    HB2  PRO  77           HB2      PRO  77  -3.380  -3.897 -23.800
  539    HB3  PRO  77           HB1      PRO  77  -3.018  -2.552 -24.895
  540    HG2  PRO  77           HG2      PRO  77  -1.946  -4.876 -25.418
  541    HG3  PRO  77           HG1      PRO  77  -0.921  -3.427 -25.459
  542    HD2  PRO  77           HD2      PRO  77  -1.049  -5.580 -23.358
  543    HD3  PRO  77           HD1      PRO  77   0.365  -4.645 -23.972
  544    H    GLY  78           HN       GLY  78  -2.496  -0.193 -22.383
  545    HA2  GLY  78           HA2      GLY  78  -4.258   0.649 -21.097
  546    HA3  GLY  78           HA1      GLY  78  -4.690  -0.987 -20.647
  547    H    TRP  79           HN       TRP  79  -1.615  -1.200 -19.854
  548    HA   TRP  79           HA       TRP  79  -2.178  -0.381 -17.085
  549    HB2  TRP  79           HB2      TRP  79  -0.046  -2.147 -18.298
  550    HB3  TRP  79           HB1      TRP  79  -0.080  -1.737 -16.597
  551    HD1  TRP  79           HD1      TRP  79  -2.130  -3.631 -19.235
  552    HE1  TRP  79           HE1      TRP  79  -3.448  -5.485 -18.067
  553    HE3  TRP  79           HE3      TRP  79  -1.075  -2.392 -14.418
  554    HZ2  TRP  79           HZ2      TRP  79  -4.050  -6.270 -15.396
  555    HZ3  TRP  79           HZ3      TRP  79  -2.074  -3.716 -12.600
  556    HH2  TRP  79           HH2      TRP  79  -3.529  -5.610 -13.077
  557    H    GLU  80           HN       GLU  80  -0.847   1.021 -15.892
  558    HA   GLU  80           HA       GLU  80   1.389   2.325 -17.310
  559    HB2  GLU  80           HB2      GLU  80  -0.552   3.847 -17.263
  560    HB3  GLU  80           HB1      GLU  80  -0.768   3.557 -15.550
  561    HG2  GLU  80           HG2      GLU  80   0.219   5.629 -15.594
  562    HG3  GLU  80           HG1      GLU  80   1.585   4.556 -15.302
  563    H    MET  81           HN       MET  81   3.148   2.915 -15.989
  564    HA   MET  81           HA       MET  81   3.077   1.753 -13.293
  565    HB2  MET  81           HB2      MET  81   4.256   0.274 -14.911
  566    HB3  MET  81           HB1      MET  81   5.396   1.602 -15.230
  567    HG2  MET  81           HG2      MET  81   5.002   0.497 -12.467
  568    HG3  MET  81           HG1      MET  81   6.087  -0.276 -13.619
  569    HE1  MET  81           HE1      MET  81   8.726   2.555 -14.278
  570    HE2  MET  81           HE2      MET  81   7.255   2.278 -15.213
  571    HE3  MET  81           HE3      MET  81   8.227   0.912 -14.665
  572    H    LYS  82           HN       LYS  82   3.835   3.087 -11.701
  573    HA   LYS  82           HA       LYS  82   5.713   5.194 -12.311
  574    HB2  LYS  82           HB2      LYS  82   2.995   5.942 -11.175
  575    HB3  LYS  82           HB1      LYS  82   4.347   7.029 -11.404
  576    HG2  LYS  82           HG2      LYS  82   4.184   6.706 -13.842
  577    HG3  LYS  82           HG1      LYS  82   2.761   5.653 -13.570
  578    HD2  LYS  82           HD2      LYS  82   1.661   7.578 -12.421
  579    HD3  LYS  82           HD1      LYS  82   3.034   8.588 -12.881
  580    HE2  LYS  82           HE2      LYS  82   1.134   7.167 -14.743
  581    HE3  LYS  82           HE1      LYS  82   1.199   8.901 -14.435
  582    HZ1  LYS  82           HZ1      LYS  82   3.643   8.625 -15.244
  583    HZ2  LYS  82           HZ2      LYS  82   2.384   8.730 -16.370
  584    HZ3  LYS  82           HZ3      LYS  82   3.045   7.215 -15.987
  585    H    TYR  83           HN       TYR  83   6.615   6.151 -10.348
  586    HA   TYR  83           HA       TYR  83   6.318   4.327  -8.040
  587    HB2  TYR  83           HB2      TYR  83   8.673   6.077  -8.877
  588    HB3  TYR  83           HB1      TYR  83   8.627   5.117  -7.376
  589    HD1  TYR  83           HD1      TYR  83   8.925   5.002 -11.046
  590    HD2  TYR  83           HD2      TYR  83   8.962   2.723  -7.450
  591    HE1  TYR  83           HE1      TYR  83   9.917   3.111 -12.257
  592    HE2  TYR  83           HE2      TYR  83   9.952   0.822  -8.661
  593    HH   TYR  83           HH       TYR  83  11.233   1.133 -11.800
  594    H    THR  84           HN       THR  84   6.486   5.320  -5.882
  595    HA   THR  84           HA       THR  84   5.394   8.042  -5.881
  596    HB   THR  84           HB       THR  84   4.577   7.674  -3.701
  597    HG1  THR  84           HG1      THR  84   5.393   6.103  -2.320
  598   HG21  THR  84          HG21      THR  84   3.334   6.331  -5.286
  599   HG22  THR  84          HG22      THR  84   3.438   5.485  -3.743
  600   HG23  THR  84          HG23      THR  84   4.468   4.996  -5.091
  601    H    SER  85           HN       SER  85   6.253   9.332  -3.836
  602    HA   SER  85           HA       SER  85   9.054   9.714  -4.295
  603    HB2  SER  85           HB2      SER  85   8.589  11.456  -2.372
  604    HB3  SER  85           HB1      SER  85   7.945  11.714  -3.994
  605    HG   SER  85           HG       SER  85   6.350  12.008  -2.363
  606    H    GLU  86           HN       GLU  86   7.754   7.339  -2.642
  607    HA   GLU  86           HA       GLU  86   9.636   7.516  -0.346
  608    HB2  GLU  86           HB2      GLU  86   6.952   6.097  -0.498
  609    HB3  GLU  86           HB1      GLU  86   8.030   6.072   0.891
  610    HG2  GLU  86           HG2      GLU  86   6.728   8.527  -0.261
  611    HG3  GLU  86           HG1      GLU  86   6.152   7.631   1.145
  612    H    GLY  87           HN       GLY  87   9.329   6.169  -3.255
  613    HA2  GLY  87           HA2      GLY  87  10.649   4.445  -4.127
  614    HA3  GLY  87           HA1      GLY  87  10.892   3.841  -2.495
  615    H    VAL  88           HN       VAL  88   7.689   4.395  -2.729
  616    HA   VAL  88           HA       VAL  88   7.088   1.587  -3.002
  617    HB   VAL  88           HB       VAL  88   5.269   3.965  -2.535
  618   HG11  VAL  88          HG11      VAL  88   4.653   1.015  -2.380
  619   HG12  VAL  88          HG12      VAL  88   4.019   2.153  -3.570
  620   HG13  VAL  88          HG13      VAL  88   3.573   2.313  -1.873
  621   HG21  VAL  88          HG21      VAL  88   6.823   3.557  -0.702
  622   HG22  VAL  88          HG22      VAL  88   6.309   1.873  -0.631
  623   HG23  VAL  88          HG23      VAL  88   5.171   3.159  -0.229
  624    H    ARG  89           HN       ARG  89   5.758   0.685  -4.601
  625    HA   ARG  89           HA       ARG  89   5.693   2.228  -7.114
  626    HB2  ARG  89           HB2      ARG  89   7.200   0.286  -7.097
  627    HB3  ARG  89           HB1      ARG  89   5.860  -0.755  -6.661
  628    HG2  ARG  89           HG2      ARG  89   4.797  -0.337  -8.796
  629    HG3  ARG  89           HG1      ARG  89   6.088   0.788  -9.237
  630    HD2  ARG  89           HD2      ARG  89   7.724  -0.996  -9.104
  631    HD3  ARG  89           HD1      ARG  89   6.484  -2.125  -8.569
  632    HE   ARG  89           HE       ARG  89   5.456  -1.641 -10.855
  633   HH11  ARG  89          HH11      ARG  89   8.871  -1.486 -10.223
  634   HH12  ARG  89          HH12      ARG  89   9.344  -2.005 -11.807
  635   HH21  ARG  89          HH21      ARG  89   6.046  -2.351 -12.975
  636   HH22  ARG  89          HH22      ARG  89   7.724  -2.523 -13.376
  637    H    TYR  90           HN       TYR  90   3.743   2.596  -8.026
  638    HA   TYR  90           HA       TYR  90   1.529   0.868  -7.199
  639    HB2  TYR  90           HB2      TYR  90  -0.015   2.685  -6.965
  640    HB3  TYR  90           HB1      TYR  90   1.385   3.056  -5.987
  641    HD1  TYR  90           HD1      TYR  90   3.049   4.756  -6.844
  642    HD2  TYR  90           HD2      TYR  90  -0.766   4.179  -8.639
  643    HE1  TYR  90           HE1      TYR  90   3.261   6.923  -7.981
  644    HE2  TYR  90           HE2      TYR  90  -0.569   6.352  -9.776
  645    HH   TYR  90           HH       TYR  90   2.405   8.081  -9.902
  646    H    PHE  91           HN       PHE  91  -0.269   0.828  -8.818
  647    HA   PHE  91           HA       PHE  91   0.819   1.350 -11.495
  648    HB2  PHE  91           HB2      PHE  91  -0.845  -0.997 -10.562
  649    HB3  PHE  91           HB1      PHE  91  -0.517  -0.628 -12.243
  650    HD1  PHE  91           HD1      PHE  91   1.008  -1.865  -9.095
  651    HD2  PHE  91           HD2      PHE  91   1.616  -0.994 -13.229
  652    HE1  PHE  91           HE1      PHE  91   3.110  -3.121  -9.052
  653    HE2  PHE  91           HE2      PHE  91   3.723  -2.260 -13.175
  654    HZ   PHE  91           HZ       PHE  91   4.469  -3.322 -11.091
  655    H    VAL  92           HN       VAL  92  -0.719   1.813 -13.140
  656    HA   VAL  92           HA       VAL  92  -3.278   2.841 -12.106
  657    HB   VAL  92           HB       VAL  92  -1.571   4.223 -14.179
  658   HG11  VAL  92          HG11      VAL  92  -4.130   5.071 -12.837
  659   HG12  VAL  92          HG12      VAL  92  -3.935   4.606 -14.527
  660   HG13  VAL  92          HG13      VAL  92  -3.163   6.071 -13.920
  661   HG21  VAL  92          HG21      VAL  92  -1.216   5.961 -12.478
  662   HG22  VAL  92          HG22      VAL  92  -0.517   4.411 -12.009
  663   HG23  VAL  92          HG23      VAL  92  -2.039   4.946 -11.294
  664    H    ASP  93           HN       ASP  93  -4.858   1.697 -13.035
  665    HA   ASP  93           HA       ASP  93  -4.490   0.423 -15.635
  666    HB2  ASP  93           HB2      ASP  93  -6.701   0.453 -13.568
  667    HB3  ASP  93           HB1      ASP  93  -7.090   0.035 -15.235
  668    H    HIS  94           HN       HIS  94  -4.298   2.114 -17.181
  669    HA   HIS  94           HA       HIS  94  -6.124   4.335 -17.151
  670    HB2  HIS  94           HB2      HIS  94  -3.965   3.483 -19.061
  671    HB3  HIS  94           HB1      HIS  94  -5.128   4.710 -19.534
  672    HD1  HIS  94           HD1      HIS  94  -1.897   4.878 -18.700
  673    HD2  HIS  94           HD2      HIS  94  -5.231   6.434 -16.761
  674    HE1  HIS  94           HE1      HIS  94  -1.041   6.782 -17.302
  675    HE2  HIS  94           HE2      HIS  94  -3.080   7.760 -16.189
  676    H    ASN  95           HN       ASN  95  -6.509   1.199 -18.041
  677    HA   ASN  95           HA       ASN  95  -8.287   1.596 -20.258
  678    HB2  ASN  95           HB2      ASN  95  -8.866  -0.801 -19.953
  679    HB3  ASN  95           HB1      ASN  95  -7.121  -0.562 -19.999
  680   HD21  ASN  95          HD21      ASN  95  -5.917  -0.938 -18.158
  681   HD22  ASN  95          HD22      ASN  95  -6.560  -1.737 -16.760
  682    H    THR  96           HN       THR  96  -8.589   1.376 -16.773
  683    HA   THR  96           HA       THR  96 -11.458   1.956 -17.025
  684    HB   THR  96           HB       THR  96 -11.379   1.301 -14.490
  685    HG1  THR  96           HG1      THR  96  -9.661  -0.525 -14.508
  686   HG21  THR  96          HG21      THR  96 -11.103  -0.778 -16.673
  687   HG22  THR  96          HG22      THR  96 -12.598   0.025 -16.190
  688   HG23  THR  96          HG23      THR  96 -11.774  -1.057 -15.068
  689    H    ARG  97           HN       ARG  97  -8.459   3.226 -16.223
  690    HA   ARG  97           HA       ARG  97  -7.761   5.302 -15.588
  691    HB2  ARG  97           HB2      ARG  97 -10.696   6.035 -15.616
  692    HB3  ARG  97           HB1      ARG  97  -9.339   7.165 -15.572
  693    HG2  ARG  97           HG2      ARG  97  -8.572   6.361 -17.728
  694    HG3  ARG  97           HG1      ARG  97  -9.878   5.183 -17.748
  695    HD2  ARG  97           HD2      ARG  97 -11.515   6.990 -17.770
  696    HD3  ARG  97           HD1      ARG  97 -10.206   8.172 -17.739
  697    HE   ARG  97           HE       ARG  97 -10.004   6.320 -19.930
  698   HH11  ARG  97          HH11      ARG  97 -11.434   9.338 -18.874
  699   HH12  ARG  97          HH12      ARG  97 -11.678   9.928 -20.492
  700   HH21  ARG  97          HH21      ARG  97 -10.318   7.103 -22.049
  701   HH22  ARG  97          HH22      ARG  97 -11.072   8.655 -22.285
  702    H    THR  98           HN       THR  98  -7.978   3.344 -13.865
  703    HA   THR  98           HA       THR  98  -8.739   4.641 -11.311
  704    HB   THR  98           HB       THR  98 -10.196   2.637 -11.917
  705    HG1  THR  98           HG1      THR  98  -9.703   3.340  -9.691
  706   HG21  THR  98          HG21      THR  98  -9.192   0.393 -11.615
  707   HG22  THR  98          HG22      THR  98  -7.602   1.139 -11.467
  708   HG23  THR  98          HG23      THR  98  -8.484   1.246 -12.991
  709    H    THR  99           HN       THR  99  -7.468   3.654  -9.437
  710    HA   THR  99           HA       THR  99  -4.655   3.214 -10.285
  711    HB   THR  99           HB       THR  99  -4.101   4.094  -7.922
  712    HG1  THR  99           HG1      THR  99  -6.354   3.842  -7.226
  713   HG21  THR  99          HG21      THR  99  -4.393   6.503  -8.563
  714   HG22  THR  99          HG22      THR  99  -5.469   6.004  -9.868
  715   HG23  THR  99          HG23      THR  99  -3.767   5.543  -9.909
  716    H    THR 100           HN       THR 100  -3.586   1.392  -9.376
  717    HA   THR 100           HA       THR 100  -4.994  -0.062  -7.278
  718    HB   THR 100           HB       THR 100  -5.818  -0.944  -9.490
  719    HG1  THR 100           HG1      THR 100  -5.858  -2.961  -8.694
  720   HG21  THR 100          HG21      THR 100  -3.766  -0.771 -10.800
  721   HG22  THR 100          HG22      THR 100  -4.313  -2.449 -10.752
  722   HG23  THR 100          HG23      THR 100  -2.969  -1.929  -9.735
  723    H    PHE 101           HN       PHE 101  -3.708  -1.491  -6.109
  724    HA   PHE 101           HA       PHE 101  -0.811  -1.149  -6.489
  725    HB2  PHE 101           HB2      PHE 101  -2.547  -1.585  -4.072
  726    HB3  PHE 101           HB1      PHE 101  -0.851  -2.226  -4.060
  727    HD1  PHE 101           HD1      PHE 101   0.991  -0.760  -3.903
  728    HD2  PHE 101           HD2      PHE 101  -2.943   0.832  -4.242
  729    HE1  PHE 101           HE1      PHE 101   1.844   1.457  -3.273
  730    HE2  PHE 101           HE2      PHE 101  -2.096   3.058  -3.613
  731    HZ   PHE 101           HZ       PHE 101   0.302   3.370  -3.132
  732    H    LYS 102           HN       LYS 102  -0.209  -2.744  -7.836
  733    HA   LYS 102           HA       LYS 102  -1.051  -5.477  -7.146
  734    HB2  LYS 102           HB2      LYS 102  -1.692  -4.435  -9.461
  735    HB3  LYS 102           HB1      LYS 102  -0.006  -4.733  -9.862
  736    HG2  LYS 102           HG2      LYS 102  -0.411  -7.129  -9.144
  737    HG3  LYS 102           HG1      LYS 102  -2.128  -6.729  -9.157
  738    HD2  LYS 102           HD2      LYS 102  -1.882  -7.534 -11.288
  739    HD3  LYS 102           HD1      LYS 102  -1.558  -5.821 -11.562
  740    HE2  LYS 102           HE2      LYS 102   0.121  -7.121 -12.708
  741    HE3  LYS 102           HE1      LYS 102   0.873  -6.298 -11.343
  742    HZ1  LYS 102           HZ1      LYS 102   0.001  -9.142 -11.371
  743    HZ2  LYS 102           HZ2      LYS 102   0.748  -8.347 -10.070
  744    HZ3  LYS 102           HZ3      LYS 102   1.605  -8.601 -11.507
  745    H    ASP 103           HN       ASP 103   0.527  -7.062  -7.050
  746    HA   ASP 103           HA       ASP 103   3.171  -6.203  -6.508
  747    HB2  ASP 103           HB2      ASP 103   3.478  -8.587  -6.013
  748    HB3  ASP 103           HB1      ASP 103   2.067  -7.947  -5.211
  749    HA   PRO 104           HA       PRO 104   4.606  -6.970 -10.677
  750    HB2  PRO 104           HB2      PRO 104   7.321  -6.536  -9.741
  751    HB3  PRO 104           HB1      PRO 104   6.330  -5.439 -10.703
  752    HG2  PRO 104           HG2      PRO 104   7.077  -4.978  -8.099
  753    HG3  PRO 104           HG1      PRO 104   5.663  -4.250  -8.878
  754    HD2  PRO 104           HD2      PRO 104   5.813  -6.541  -6.969
  755    HD3  PRO 104           HD1      PRO 104   4.573  -5.281  -7.130
  756    H    ARG 105           HN       ARG 105   6.097  -8.344  -7.804
  757    HA   ARG 105           HA       ARG 105   6.799 -10.736  -9.349
  758    HB2  ARG 105           HB2      ARG 105   8.083  -9.660  -6.833
  759    HB3  ARG 105           HB1      ARG 105   8.433 -11.237  -7.520
  760    HG2  ARG 105           HG2      ARG 105   8.963  -8.561  -8.785
  761    HG3  ARG 105           HG1      ARG 105  10.160  -9.698  -8.144
  762    HD2  ARG 105           HD2      ARG 105   8.361 -10.074 -10.542
  763    HD3  ARG 105           HD1      ARG 105  10.122  -9.940 -10.548
  764    HE   ARG 105           HE       ARG 105   9.882 -12.104  -9.074
  765   HH11  ARG 105          HH11      ARG 105   8.013 -11.220 -11.903
  766   HH12  ARG 105          HH12      ARG 105   7.708 -12.863 -12.385
  767   HH21  ARG 105          HH21      ARG 105   9.455 -14.265  -9.666
  768   HH22  ARG 105          HH22      ARG 105   8.542 -14.605 -11.106
  769    HA   PRO 106           HA       PRO 106   3.234 -12.297  -6.961
  770    HB2  PRO 106           HB2      PRO 106   4.466 -14.805  -8.075
  771    HB3  PRO 106           HB1      PRO 106   2.730 -14.325  -7.977
  772    HG2  PRO 106           HG2      PRO 106   4.053 -14.137 -10.278
  773    HG3  PRO 106           HG1      PRO 106   2.920 -12.866  -9.778
  774    HD2  PRO 106           HD2      PRO 106   5.906 -12.858  -9.798
  775    HD3  PRO 106           HD1      PRO 106   4.743 -11.515 -10.086
  776    H    GLY 107           HN       GLY 107   3.192 -12.931  -4.858
  777    HA2  GLY 107           HA2      GLY 107   3.927 -13.766  -2.839
  778    HA3  GLY 107           HA1      GLY 107   5.148 -14.684  -3.738
  779    H    PHE 108           HN       PHE 108   5.365 -11.270  -4.257
  780    HA   PHE 108           HA       PHE 108   7.594 -11.161  -2.351
  781    HB2  PHE 108           HB2      PHE 108   8.430 -10.840  -4.591
  782    HB3  PHE 108           HB1      PHE 108   7.139  -9.653  -4.968
  783    HD1  PHE 108           HD1      PHE 108  10.305 -10.213  -3.139
  784    HD2  PHE 108           HD2      PHE 108   7.354  -7.372  -4.326
  785    HE1  PHE 108           HE1      PHE 108  11.795  -8.385  -2.456
  786    HE2  PHE 108           HE2      PHE 108   8.846  -5.536  -3.637
  787    HZ   PHE 108           HZ       PHE 108  11.080  -6.033  -2.763
  788    H    GLU 109           HN       GLU 109   7.895  -9.104  -1.173
  789    HA   GLU 109           HA       GLU 109   5.864  -7.147  -1.163
  790    HB2  GLU 109           HB2      GLU 109   4.872  -7.500   0.997
  791    HB3  GLU 109           HB1      GLU 109   4.661  -8.992   0.097
  792    HG2  GLU 109           HG2      GLU 109   6.383 -10.069   1.356
  793    HG3  GLU 109           HG1      GLU 109   6.844  -8.546   2.123
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1 -43.050   4.380  -1.288
    2    H2   GLY   1           HT2      GLY   1 -41.467   4.070  -1.817
    3    H3   GLY   1           HT3      GLY   1 -42.382   5.294  -2.550
    4    HA2  GLY   1           HA1      GLY   1 -42.393   6.575  -0.525
    5    HA3  GLY   1           HA2      GLY   1 -41.495   5.296   0.279
    6    H    SER   2           HN       SER   2 -40.394   7.713   0.418
    7    HA   SER   2           HA       SER   2 -38.629   8.274  -1.764
    8    HB2  SER   2           HB2      SER   2 -38.502   9.252   1.099
    9    HB3  SER   2           HB1      SER   2 -37.648   9.950  -0.279
   10    HG   SER   2           HG       SER   2 -39.603  10.564  -1.167
   11    H    HIS   3           HN       HIS   3 -37.658   6.211  -2.051
   12    HA   HIS   3           HA       HIS   3 -35.514   5.660  -0.105
   13    HB2  HIS   3           HB2      HIS   3 -37.459   3.887  -1.405
   14    HB3  HIS   3           HB1      HIS   3 -35.800   3.341  -1.608
   15    HD1  HIS   3           HD1      HIS   3 -38.002   1.887   0.116
   16    HD2  HIS   3           HD2      HIS   3 -34.982   4.356   1.551
   17    HE1  HIS   3           HE1      HIS   3 -37.637   1.189   2.504
   18    HE2  HIS   3           HE2      HIS   3 -35.626   2.515   3.246
   19    H    MET   4           HN       MET   4 -33.432   5.221  -1.003
   20    HA   MET   4           HA       MET   4 -33.202   5.584  -3.918
   21    HB2  MET   4           HB2      MET   4 -31.255   6.556  -1.794
   22    HB3  MET   4           HB1      MET   4 -30.994   6.651  -3.526
   23    HG2  MET   4           HG2      MET   4 -33.209   8.031  -2.033
   24    HG3  MET   4           HG1      MET   4 -31.699   8.782  -2.548
   25    HE1  MET   4           HE1      MET   4 -34.288  10.412  -4.976
   26    HE2  MET   4           HE2      MET   4 -32.941  10.706  -3.876
   27    HE3  MET   4           HE3      MET   4 -34.454  10.048  -3.259
   28    H    GLN   5           HN       GLN   5 -31.949   4.059  -4.956
   29    HA   GLN   5           HA       GLN   5 -31.214   1.760  -3.338
   30    HB2  GLN   5           HB2      GLN   5 -32.413   1.457  -5.491
   31    HB3  GLN   5           HB1      GLN   5 -31.029   2.149  -6.329
   32    HG2  GLN   5           HG2      GLN   5 -29.643   0.303  -5.350
   33    HG3  GLN   5           HG1      GLN   5 -31.151  -0.431  -4.802
   34   HE21  GLN   5          HE21      GLN   5 -32.612  -1.203  -6.302
   35   HE22  GLN   5          HE22      GLN   5 -32.127  -1.580  -7.941
   36    H    TYR   6           HN       TYR   6 -29.352   2.129  -2.261
   37    HA   TYR   6           HA       TYR   6 -27.115   3.320  -3.719
   38    HB2  TYR   6           HB2      TYR   6 -27.416   2.645  -0.759
   39    HB3  TYR   6           HB1      TYR   6 -25.912   3.234  -1.452
   40    HD1  TYR   6           HD1      TYR   6 -25.761   5.532  -2.303
   41    HD2  TYR   6           HD2      TYR   6 -29.287   4.114  -0.390
   42    HE1  TYR   6           HE1      TYR   6 -26.514   7.847  -1.984
   43    HE2  TYR   6           HE2      TYR   6 -30.046   6.428  -0.065
   44    HH   TYR   6           HH       TYR   6 -28.634   9.057  -1.649
   45    H    LYS   7           HN       LYS   7 -25.317   2.192  -4.265
   46    HA   LYS   7           HA       LYS   7 -25.359  -0.692  -3.718
   47    HB2  LYS   7           HB2      LYS   7 -24.159  -0.814  -6.031
   48    HB3  LYS   7           HB1      LYS   7 -25.922  -0.605  -5.997
   49    HG2  LYS   7           HG2      LYS   7 -25.424   1.905  -6.159
   50    HG3  LYS   7           HG1      LYS   7 -23.807   1.403  -6.636
   51    HD2  LYS   7           HD2      LYS   7 -25.003   1.709  -8.648
   52    HD3  LYS   7           HD1      LYS   7 -24.919  -0.036  -8.403
   53    HE2  LYS   7           HE2      LYS   7 -27.151   0.531  -9.085
   54    HE3  LYS   7           HE1      LYS   7 -27.183   0.049  -7.389
   55    HZ1  LYS   7           HZ1      LYS   7 -27.474   2.253  -6.700
   56    HZ2  LYS   7           HZ2      LYS   7 -28.500   2.108  -8.039
   57    HZ3  LYS   7           HZ3      LYS   7 -27.009   2.894  -8.196
   58    H    LEU   8           HN       LEU   8 -23.367  -1.725  -3.565
   59    HA   LEU   8           HA       LEU   8 -21.107   0.083  -2.980
   60    HB2  LEU   8           HB2      LEU   8 -22.314  -0.704  -0.885
   61    HB3  LEU   8           HB1      LEU   8 -21.834  -2.324  -1.315
   62    HG   LEU   8           HG       LEU   8 -19.437  -1.507  -1.214
   63   HD11  LEU   8          HD11      LEU   8 -19.154   0.440   0.384
   64   HD12  LEU   8          HD12      LEU   8 -20.833   0.855   0.048
   65   HD13  LEU   8          HD13      LEU   8 -19.639   0.864  -1.254
   66   HD21  LEU   8          HD21      LEU   8 -20.195  -2.927   0.460
   67   HD22  LEU   8          HD22      LEU   8 -21.294  -1.713   1.108
   68   HD23  LEU   8          HD23      LEU   8 -19.551  -1.535   1.337
   69    H    ILE   9           HN       ILE   9 -19.121  -0.668  -3.565
   70    HA   ILE   9           HA       ILE   9 -19.019  -3.379  -4.691
   71    HB   ILE   9           HB       ILE   9 -17.566  -0.930  -5.739
   72   HG12  ILE   9          HG12      ILE   9 -19.613  -2.737  -7.112
   73   HG13  ILE   9          HG11      ILE   9 -20.007  -1.123  -6.415
   74   HG21  ILE   9          HG21      ILE   9 -17.374  -3.837  -6.533
   75   HG22  ILE   9          HG22      ILE   9 -16.090  -2.817  -5.874
   76   HG23  ILE   9          HG23      ILE   9 -16.731  -2.503  -7.489
   77   HD11  ILE   9          HD11      ILE   9 -18.502  -0.070  -8.012
   78   HD12  ILE   9          HD12      ILE   9 -19.675  -1.083  -8.863
   79   HD13  ILE   9          HD13      ILE   9 -18.018  -1.645  -8.645
   80    H    LEU  10           HN       LEU  10 -17.616  -4.655  -3.688
   81    HA   LEU  10           HA       LEU  10 -15.812  -3.395  -1.777
   82    HB2  LEU  10           HB2      LEU  10 -16.370  -6.339  -2.130
   83    HB3  LEU  10           HB1      LEU  10 -15.392  -5.617  -0.874
   84    HG   LEU  10           HG       LEU  10 -17.285  -6.040   0.289
   85   HD11  LEU  10          HD11      LEU  10 -16.828  -3.641   0.417
   86   HD12  LEU  10          HD12      LEU  10 -18.508  -4.070   0.733
   87   HD13  LEU  10          HD13      LEU  10 -18.061  -3.377  -0.827
   88   HD21  LEU  10          HD21      LEU  10 -19.508  -6.128  -0.517
   89   HD22  LEU  10          HD22      LEU  10 -18.495  -6.894  -1.741
   90   HD23  LEU  10          HD23      LEU  10 -19.082  -5.249  -1.982
   91    H    ASN  11           HN       ASN  11 -14.187  -2.599  -2.989
   92    HA   ASN  11           HA       ASN  11 -12.903  -4.363  -4.892
   93    HB2  ASN  11           HB2      ASN  11 -11.901  -1.637  -4.023
   94    HB3  ASN  11           HB1      ASN  11 -11.518  -2.499  -5.502
   95   HD21  ASN  11          HD21      ASN  11 -12.085  -0.795  -6.805
   96   HD22  ASN  11          HD22      ASN  11 -13.730  -0.322  -7.046
   97    H    GLY  12           HN       GLY  12 -12.310  -5.979  -3.364
   98    HA2  GLY  12           HA2      GLY  12  -9.815  -5.234  -1.995
   99    HA3  GLY  12           HA1      GLY  12 -11.003  -6.241  -1.157
  100    H    LYS  13           HN       LYS  13  -8.160  -6.492  -2.420
  101    HA   LYS  13           HA       LYS  13  -8.009  -8.262  -4.471
  102    HB2  LYS  13           HB2      LYS  13  -6.230  -8.222  -2.026
  103    HB3  LYS  13           HB1      LYS  13  -5.798  -8.863  -3.606
  104    HG2  LYS  13           HG2      LYS  13  -5.827  -6.685  -4.574
  105    HG3  LYS  13           HG1      LYS  13  -6.537  -5.989  -3.119
  106    HD2  LYS  13           HD2      LYS  13  -3.790  -7.237  -3.303
  107    HD3  LYS  13           HD1      LYS  13  -4.125  -5.504  -3.301
  108    HE2  LYS  13           HE2      LYS  13  -5.178  -5.756  -1.067
  109    HE3  LYS  13           HE1      LYS  13  -4.702  -7.453  -1.063
  110    HZ1  LYS  13           HZ1      LYS  13  -2.878  -5.102  -1.122
  111    HZ2  LYS  13           HZ2      LYS  13  -2.368  -6.715  -1.240
  112    HZ3  LYS  13           HZ3      LYS  13  -3.118  -6.164   0.175
  113    H    THR  14           HN       THR  14  -8.897  -9.003  -1.158
  114    HA   THR  14           HA       THR  14  -8.488 -11.852  -1.536
  115    HB   THR  14           HB       THR  14  -9.810 -10.411   0.782
  116    HG1  THR  14           HG1      THR  14  -7.130 -11.247   0.258
  117   HG21  THR  14          HG21      THR  14  -8.710 -13.218   0.573
  118   HG22  THR  14          HG22      THR  14 -10.421 -12.793   0.601
  119   HG23  THR  14          HG23      THR  14  -9.410 -12.480   2.014
  120    H    LEU  15           HN       LEU  15 -11.338  -9.683  -1.253
  121    HA   LEU  15           HA       LEU  15 -12.777 -11.564  -2.824
  122    HB2  LEU  15           HB2      LEU  15 -14.674 -11.443  -1.343
  123    HB3  LEU  15           HB1      LEU  15 -13.333 -12.083  -0.463
  124    HG   LEU  15           HG       LEU  15 -14.310 -10.727   1.091
  125   HD11  LEU  15          HD11      LEU  15 -13.133  -8.442   1.009
  126   HD12  LEU  15          HD12      LEU  15 -12.334  -9.118  -0.422
  127   HD13  LEU  15          HD13      LEU  15 -12.168  -9.915   1.147
  128   HD21  LEU  15          HD21      LEU  15 -15.421  -8.597   0.622
  129   HD22  LEU  15          HD22      LEU  15 -16.113  -9.927  -0.306
  130   HD23  LEU  15          HD23      LEU  15 -15.025  -8.778  -1.087
  131    H    LYS  16           HN       LYS  16 -13.795 -10.610  -4.407
  132    HA   LYS  16           HA       LYS  16 -14.355  -7.718  -4.197
  133    HB2  LYS  16           HB2      LYS  16 -13.702  -9.203  -6.760
  134    HB3  LYS  16           HB1      LYS  16 -13.884  -7.469  -6.560
  135    HG2  LYS  16           HG2      LYS  16 -11.607  -7.643  -6.646
  136    HG3  LYS  16           HG1      LYS  16 -11.832  -7.778  -4.911
  137    HD2  LYS  16           HD2      LYS  16 -10.250  -9.367  -5.831
  138    HD3  LYS  16           HD1      LYS  16 -11.612 -10.176  -5.056
  139    HE2  LYS  16           HE2      LYS  16 -10.945 -11.230  -7.201
  140    HE3  LYS  16           HE1      LYS  16 -12.601 -10.624  -7.223
  141    HZ1  LYS  16           HZ1      LYS  16 -12.082  -8.982  -8.700
  142    HZ2  LYS  16           HZ2      LYS  16 -10.947 -10.146  -9.188
  143    HZ3  LYS  16           HZ3      LYS  16 -10.468  -8.852  -8.198
  144    H    GLY  17           HN       GLY  17 -16.390  -7.076  -4.798
  145    HA2  GLY  17           HA2      GLY  17 -18.188  -8.508  -6.380
  146    HA3  GLY  17           HA1      GLY  17 -18.446  -9.006  -4.715
  147    H    GLU  18           HN       GLU  18 -20.606  -8.058  -5.337
  148    HA   GLU  18           HA       GLU  18 -20.632  -5.199  -4.654
  149    HB2  GLU  18           HB2      GLU  18 -22.425  -6.553  -6.690
  150    HB3  GLU  18           HB1      GLU  18 -22.534  -4.872  -6.186
  151    HG2  GLU  18           HG2      GLU  18 -20.574  -4.287  -7.295
  152    HG3  GLU  18           HG1      GLU  18 -20.036  -5.965  -7.414
  153    H    THR  19           HN       THR  19 -22.849  -4.485  -4.016
  154    HA   THR  19           HA       THR  19 -24.772  -6.364  -3.110
  155    HB   THR  19           HB       THR  19 -23.035  -6.683  -1.346
  156    HG1  THR  19           HG1      THR  19 -25.021  -7.112  -0.575
  157   HG21  THR  19          HG21      THR  19 -22.644  -4.876   0.293
  158   HG22  THR  19          HG22      THR  19 -23.644  -3.791  -0.672
  159   HG23  THR  19          HG23      THR  19 -22.117  -4.389  -1.323
  160    H    THR  20           HN       THR  20 -26.640  -5.229  -2.150
  161    HA   THR  20           HA       THR  20 -26.629  -2.338  -2.681
  162    HB   THR  20           HB       THR  20 -28.962  -2.653  -3.666
  163    HG1  THR  20           HG1      THR  20 -29.007  -4.895  -4.706
  164   HG21  THR  20          HG21      THR  20 -26.551  -3.729  -5.152
  165   HG22  THR  20          HG22      THR  20 -27.140  -2.063  -5.146
  166   HG23  THR  20          HG23      THR  20 -28.090  -3.332  -5.918
  167    H    THR  21           HN       THR  21 -28.378  -1.170  -1.680
  168    HA   THR  21           HA       THR  21 -30.129  -2.499   0.185
  169    HB   THR  21           HB       THR  21 -27.871  -2.235   1.426
  170    HG1  THR  21           HG1      THR  21 -30.008  -2.508   2.412
  171   HG21  THR  21          HG21      THR  21 -27.516   0.022   2.452
  172   HG22  THR  21          HG22      THR  21 -28.805   0.664   1.434
  173   HG23  THR  21          HG23      THR  21 -27.323   0.063   0.695
  174    H    GLU  22           HN       GLU  22 -31.683  -0.977   1.114
  175    HA   GLU  22           HA       GLU  22 -31.934   1.381  -0.629
  176    HB2  GLU  22           HB2      GLU  22 -34.388   1.229   0.523
  177    HB3  GLU  22           HB1      GLU  22 -33.988   0.429  -0.986
  178    HG2  GLU  22           HG2      GLU  22 -35.204  -1.076   0.429
  179    HG3  GLU  22           HG1      GLU  22 -33.506  -1.647   0.264
  180    H    ALA  23           HN       ALA  23 -31.812   3.388   0.206
  181    HA   ALA  23           HA       ALA  23 -32.266   3.738   3.093
  182    HB1  ALA  23           HB1      ALA  23 -29.841   3.343   2.849
  183    HB2  ALA  23           HB2      ALA  23 -30.182   4.985   3.391
  184    HB3  ALA  23           HB3      ALA  23 -29.742   4.683   1.710
  185    H    VAL  24           HN       VAL  24 -32.654   6.011   3.665
  186    HA   VAL  24           HA       VAL  24 -33.783   7.473   1.410
  187    HB   VAL  24           HB       VAL  24 -34.838   8.901   3.109
  188   HG11  VAL  24          HG11      VAL  24 -35.129   5.948   3.647
  189   HG12  VAL  24          HG12      VAL  24 -36.001   6.880   2.431
  190   HG13  VAL  24          HG13      VAL  24 -36.275   7.190   4.145
  191   HG21  VAL  24          HG21      VAL  24 -34.631   8.322   5.483
  192   HG22  VAL  24          HG22      VAL  24 -33.101   8.864   4.793
  193   HG23  VAL  24          HG23      VAL  24 -33.386   7.145   5.068
  194    H    ASP  25           HN       ASP  25 -30.823   7.385   2.796
  195    HA   ASP  25           HA       ASP  25 -30.131  10.013   1.853
  196    HB2  ASP  25           HB2      ASP  25 -30.737  10.690   4.063
  197    HB3  ASP  25           HB1      ASP  25 -29.909   9.314   4.782
  198    H    ALA  26           HN       ALA  26 -27.797  10.356   1.864
  199    HA   ALA  26           HA       ALA  26 -26.475   7.930   1.030
  200    HB1  ALA  26           HB1      ALA  26 -24.656   9.439   0.341
  201    HB2  ALA  26           HB2      ALA  26 -25.499  10.790   1.099
  202    HB3  ALA  26           HB3      ALA  26 -26.219   9.967  -0.285
  203    H    ALA  27           HN       ALA  27 -26.133  10.295   3.658
  204    HA   ALA  27           HA       ALA  27 -23.680   9.224   4.659
  205    HB1  ALA  27           HB1      ALA  27 -24.071  10.632   6.602
  206    HB2  ALA  27           HB2      ALA  27 -25.731  10.918   6.085
  207    HB3  ALA  27           HB3      ALA  27 -24.390  11.535   5.121
  208    H    THR  28           HN       THR  28 -27.049   8.623   5.137
  209    HA   THR  28           HA       THR  28 -26.809   6.949   7.436
  210    HB   THR  28           HB       THR  28 -29.068   6.884   5.419
  211    HG1  THR  28           HG1      THR  28 -28.448   9.080   6.258
  212   HG21  THR  28          HG21      THR  28 -28.990   6.405   8.408
  213   HG22  THR  28          HG22      THR  28 -29.083   5.149   7.174
  214   HG23  THR  28          HG23      THR  28 -30.416   6.287   7.379
  215    H    ALA  29           HN       ALA  29 -26.412   6.449   4.020
  216    HA   ALA  29           HA       ALA  29 -26.818   3.579   4.087
  217    HB1  ALA  29           HB1      ALA  29 -27.290   4.823   2.035
  218    HB2  ALA  29           HB2      ALA  29 -26.011   3.636   1.772
  219    HB3  ALA  29           HB3      ALA  29 -25.609   5.343   1.955
  220    H    GLU  30           HN       GLU  30 -24.192   5.891   4.051
  221    HA   GLU  30           HA       GLU  30 -21.944   4.329   3.912
  222    HB2  GLU  30           HB2      GLU  30 -22.079   6.865   4.141
  223    HB3  GLU  30           HB1      GLU  30 -22.346   6.603   5.852
  224    HG2  GLU  30           HG2      GLU  30 -20.144   5.234   5.734
  225    HG3  GLU  30           HG1      GLU  30 -19.885   6.184   4.270
  226    H    LYS  31           HN       LYS  31 -23.548   5.355   6.900
  227    HA   LYS  31           HA       LYS  31 -22.091   3.994   8.754
  228    HB2  LYS  31           HB2      LYS  31 -25.070   4.415   8.966
  229    HB3  LYS  31           HB1      LYS  31 -23.915   4.290  10.285
  230    HG2  LYS  31           HG2      LYS  31 -24.260   6.536   8.321
  231    HG3  LYS  31           HG1      LYS  31 -24.464   6.573  10.073
  232    HD2  LYS  31           HD2      LYS  31 -22.066   6.197  10.359
  233    HD3  LYS  31           HD1      LYS  31 -21.863   6.142   8.607
  234    HE2  LYS  31           HE2      LYS  31 -22.799   8.454   8.512
  235    HE3  LYS  31           HE1      LYS  31 -22.749   8.492  10.274
  236    HZ1  LYS  31           HZ1      LYS  31 -20.456   8.244   8.404
  237    HZ2  LYS  31           HZ2      LYS  31 -20.327   7.991  10.073
  238    HZ3  LYS  31           HZ3      LYS  31 -20.786   9.516   9.489
  239    H    VAL  32           HN       VAL  32 -24.876   2.716   6.947
  240    HA   VAL  32           HA       VAL  32 -24.980   0.277   8.453
  241    HB   VAL  32           HB       VAL  32 -26.203   0.908   5.761
  242   HG11  VAL  32          HG11      VAL  32 -26.772  -1.299   7.735
  243   HG12  VAL  32          HG12      VAL  32 -26.081  -1.474   6.121
  244   HG13  VAL  32          HG13      VAL  32 -27.748  -0.940   6.312
  245   HG21  VAL  32          HG21      VAL  32 -27.341   1.146   8.544
  246   HG22  VAL  32          HG22      VAL  32 -28.269   1.298   7.054
  247   HG23  VAL  32          HG23      VAL  32 -26.999   2.465   7.421
  248    H    PHE  33           HN       PHE  33 -23.758   1.172   5.234
  249    HA   PHE  33           HA       PHE  33 -22.881  -1.469   4.609
  250    HB2  PHE  33           HB2      PHE  33 -22.494   1.210   3.380
  251    HB3  PHE  33           HB1      PHE  33 -21.343  -0.042   2.967
  252    HD1  PHE  33           HD1      PHE  33 -23.229  -2.388   3.024
  253    HD2  PHE  33           HD2      PHE  33 -23.591   1.501   1.327
  254    HE1  PHE  33           HE1      PHE  33 -24.770  -3.272   1.323
  255    HE2  PHE  33           HE2      PHE  33 -25.138   0.620  -0.370
  256    HZ   PHE  33           HZ       PHE  33 -25.729  -1.771  -0.374
  257    H    LYS  34           HN       LYS  34 -21.502   1.030   6.551
  258    HA   LYS  34           HA       LYS  34 -18.799   0.196   6.254
  259    HB2  LYS  34           HB2      LYS  34 -20.230   1.899   8.276
  260    HB3  LYS  34           HB1      LYS  34 -18.526   1.560   8.423
  261    HG2  LYS  34           HG2      LYS  34 -18.424   2.449   5.972
  262    HG3  LYS  34           HG1      LYS  34 -19.971   3.193   6.386
  263    HD2  LYS  34           HD2      LYS  34 -18.311   4.829   6.854
  264    HD3  LYS  34           HD1      LYS  34 -18.847   4.177   8.402
  265    HE2  LYS  34           HE2      LYS  34 -16.912   2.727   8.507
  266    HE3  LYS  34           HE1      LYS  34 -16.387   3.273   6.916
  267    HZ1  LYS  34           HZ1      LYS  34 -16.293   4.685   9.490
  268    HZ2  LYS  34           HZ2      LYS  34 -16.454   5.590   8.069
  269    HZ3  LYS  34           HZ3      LYS  34 -15.113   4.580   8.273
  270    H    GLN  35           HN       GLN  35 -21.340  -0.421   8.647
  271    HA   GLN  35           HA       GLN  35 -19.847  -2.250  10.195
  272    HB2  GLN  35           HB2      GLN  35 -21.987  -1.192  10.936
  273    HB3  GLN  35           HB1      GLN  35 -22.853  -2.190   9.780
  274    HG2  GLN  35           HG2      GLN  35 -23.042  -3.154  11.968
  275    HG3  GLN  35           HG1      GLN  35 -22.058  -4.203  10.949
  276   HE21  GLN  35          HE21      GLN  35 -21.037  -5.198  12.641
  277   HE22  GLN  35          HE22      GLN  35 -19.881  -4.390  13.650
  278    H    TYR  36           HN       TYR  36 -21.651  -2.474   7.226
  279    HA   TYR  36           HA       TYR  36 -21.774  -5.302   7.029
  280    HB2  TYR  36           HB2      TYR  36 -23.255  -4.057   5.631
  281    HB3  TYR  36           HB1      TYR  36 -21.942  -3.072   4.998
  282    HD1  TYR  36           HD1      TYR  36 -20.662  -3.795   3.112
  283    HD2  TYR  36           HD2      TYR  36 -23.477  -6.418   4.917
  284    HE1  TYR  36           HE1      TYR  36 -20.462  -5.327   1.197
  285    HE2  TYR  36           HE2      TYR  36 -23.295  -7.950   3.021
  286    HH   TYR  36           HH       TYR  36 -20.840  -7.710   0.694
  287    H    ALA  37           HN       ALA  37 -19.572  -2.899   5.564
  288    HA   ALA  37           HA       ALA  37 -17.857  -4.790   4.340
  289    HB1  ALA  37           HB1      ALA  37 -16.275  -2.917   4.125
  290    HB2  ALA  37           HB2      ALA  37 -17.273  -1.954   5.216
  291    HB3  ALA  37           HB3      ALA  37 -17.909  -2.454   3.649
  292    H    ASN  38           HN       ASN  38 -17.888  -3.212   7.468
  293    HA   ASN  38           HA       ASN  38 -15.459  -4.024   8.532
  294    HB2  ASN  38           HB2      ASN  38 -16.952  -2.466   9.726
  295    HB3  ASN  38           HB1      ASN  38 -18.145  -3.748   9.935
  296   HD21  ASN  38          HD21      ASN  38 -17.824  -5.340  11.475
  297   HD22  ASN  38          HD22      ASN  38 -16.575  -5.212  12.739
  298    H    ASP  39           HN       ASP  39 -18.542  -5.737   8.455
  299    HA   ASP  39           HA       ASP  39 -17.616  -7.981   9.962
  300    HB2  ASP  39           HB2      ASP  39 -20.042  -7.113   9.655
  301    HB3  ASP  39           HB1      ASP  39 -20.019  -8.020   8.147
  302    H    ASN  40           HN       ASN  40 -17.388  -7.031   6.695
  303    HA   ASN  40           HA       ASN  40 -17.015  -9.751   5.714
  304    HB2  ASN  40           HB2      ASN  40 -17.375  -7.081   4.418
  305    HB3  ASN  40           HB1      ASN  40 -16.514  -8.333   3.532
  306   HD21  ASN  40          HD21      ASN  40 -19.571  -7.305   4.839
  307   HD22  ASN  40          HD22      ASN  40 -20.540  -8.540   4.019
  308    H    GLY  41           HN       GLY  41 -15.205  -7.285   7.046
  309    HA2  GLY  41           HA2      GLY  41 -12.949  -7.451   7.616
  310    HA3  GLY  41           HA1      GLY  41 -12.741  -8.670   6.371
  311    H    VAL  42           HN       VAL  42 -14.415  -5.910   5.280
  312    HA   VAL  42           HA       VAL  42 -12.029  -5.069   3.819
  313    HB   VAL  42           HB       VAL  42 -14.929  -4.381   3.279
  314   HG11  VAL  42          HG11      VAL  42 -12.489  -4.067   1.513
  315   HG12  VAL  42          HG12      VAL  42 -13.236  -2.759   2.434
  316   HG13  VAL  42          HG13      VAL  42 -14.139  -3.555   1.142
  317   HG21  VAL  42          HG21      VAL  42 -14.622  -6.736   2.978
  318   HG22  VAL  42          HG22      VAL  42 -13.128  -6.474   2.078
  319   HG23  VAL  42          HG23      VAL  42 -14.674  -5.983   1.381
  320    H    ASP  43           HN       ASP  43 -11.122  -3.174   4.117
  321    HA   ASP  43           HA       ASP  43 -12.531  -0.962   5.361
  322    HB2  ASP  43           HB2      ASP  43 -11.693  -2.212   7.340
  323    HB3  ASP  43           HB1      ASP  43 -10.063  -2.123   6.680
  324    H    GLY  44           HN       GLY  44 -12.114   0.373   3.644
  325    HA2  GLY  44           HA2      GLY  44  -9.356   1.096   3.109
  326    HA3  GLY  44           HA1      GLY  44 -10.249   0.397   1.769
  327    H    GLU  45           HN       GLU  45  -9.682   2.532   0.837
  328    HA   GLU  45           HA       GLU  45 -10.626   5.005   1.726
  329    HB2  GLU  45           HB2      GLU  45 -10.565   4.251  -1.188
  330    HB3  GLU  45           HB1      GLU  45 -10.203   5.802  -0.448
  331    HG2  GLU  45           HG2      GLU  45  -8.508   3.384   0.040
  332    HG3  GLU  45           HG1      GLU  45  -8.258   4.427  -1.359
  333    H    TRP  46           HN       TRP  46 -12.453   6.247   1.119
  334    HA   TRP  46           HA       TRP  46 -14.786   4.666   0.249
  335    HB2  TRP  46           HB2      TRP  46 -14.449   6.319   2.705
  336    HB3  TRP  46           HB1      TRP  46 -15.999   6.432   1.888
  337    HD1  TRP  46           HD1      TRP  46 -13.664   3.781   3.443
  338    HE1  TRP  46           HE1      TRP  46 -15.085   1.838   4.325
  339    HE3  TRP  46           HE3      TRP  46 -18.310   5.324   1.836
  340    HZ2  TRP  46           HZ2      TRP  46 -17.774   1.060   4.349
  341    HZ3  TRP  46           HZ3      TRP  46 -20.250   3.904   2.359
  342    HH2  TRP  46           HH2      TRP  46 -19.982   1.810   3.583
  343    H    THR  47           HN       THR  47 -15.400   5.454  -1.651
  344    HA   THR  47           HA       THR  47 -15.646   8.370  -1.906
  345    HB   THR  47           HB       THR  47 -15.295   7.787  -4.469
  346    HG1  THR  47           HG1      THR  47 -14.964   5.555  -4.194
  347   HG21  THR  47          HG21      THR  47 -13.971   9.382  -3.151
  348   HG22  THR  47          HG22      THR  47 -12.946   8.420  -4.217
  349   HG23  THR  47          HG23      THR  47 -13.020   8.046  -2.494
  350    H    TYR  48           HN       TYR  48 -17.368   9.098  -3.321
  351    HA   TYR  48           HA       TYR  48 -19.395   7.064  -3.884
  352    HB2  TYR  48           HB2      TYR  48 -20.107   7.943  -1.791
  353    HB3  TYR  48           HB1      TYR  48 -19.753   9.574  -2.265
  354    HD1  TYR  48           HD1      TYR  48 -21.553  10.931  -2.718
  355    HD2  TYR  48           HD2      TYR  48 -21.942   6.745  -3.401
  356    HE1  TYR  48           HE1      TYR  48 -23.908  11.255  -3.337
  357    HE2  TYR  48           HE2      TYR  48 -24.299   7.062  -4.019
  358    HH   TYR  48           HH       TYR  48 -25.662  10.173  -4.582
  359    H    ASP  49           HN       ASP  49 -20.907   7.599  -5.502
  360    HA   ASP  49           HA       ASP  49 -20.331  10.055  -7.042
  361    HB2  ASP  49           HB2      ASP  49 -19.198   8.203  -8.290
  362    HB3  ASP  49           HB1      ASP  49 -20.735   7.358  -8.430
  363    H    ASP  50           HN       ASP  50 -22.224  11.062  -7.776
  364    HA   ASP  50           HA       ASP  50 -24.608  10.009  -6.402
  365    HB2  ASP  50           HB2      ASP  50 -23.882  12.372  -5.975
  366    HB3  ASP  50           HB1      ASP  50 -24.187  12.739  -7.670
  367    H    ALA  51           HN       ALA  51 -23.316   9.975  -9.496
  368    HA   ALA  51           HA       ALA  51 -25.767  10.302 -10.935
  369    HB1  ALA  51           HB1      ALA  51 -23.171   9.082 -11.847
  370    HB2  ALA  51           HB2      ALA  51 -23.606  10.787 -11.969
  371    HB3  ALA  51           HB3      ALA  51 -24.509   9.578 -12.882
  372    H    THR  52           HN       THR  52 -23.981   7.529  -9.639
  373    HA   THR  52           HA       THR  52 -26.223   5.832 -10.518
  374    HB   THR  52           HB       THR  52 -24.526   3.940 -10.327
  375    HG1  THR  52           HG1      THR  52 -22.714   4.617  -9.440
  376   HG21  THR  52          HG21      THR  52 -25.273   4.770 -12.498
  377   HG22  THR  52          HG22      THR  52 -23.538   4.446 -12.551
  378   HG23  THR  52          HG23      THR  52 -24.123   6.102 -12.405
  379    H    LYS  53           HN       LYS  53 -25.253   7.302  -7.813
  380    HA   LYS  53           HA       LYS  53 -25.384   6.904  -5.535
  381    HB2  LYS  53           HB2      LYS  53 -27.561   5.276  -6.743
  382    HB3  LYS  53           HB1      LYS  53 -27.140   4.911  -5.079
  383    HG2  LYS  53           HG2      LYS  53 -28.995   6.510  -5.273
  384    HG3  LYS  53           HG1      LYS  53 -27.616   7.165  -4.397
  385    HD2  LYS  53           HD2      LYS  53 -26.914   8.374  -6.402
  386    HD3  LYS  53           HD1      LYS  53 -28.292   7.714  -7.285
  387    HE2  LYS  53           HE2      LYS  53 -29.832   8.831  -5.790
  388    HE3  LYS  53           HE1      LYS  53 -28.490   9.416  -4.810
  389    HZ1  LYS  53           HZ1      LYS  53 -29.392  11.089  -6.352
  390    HZ2  LYS  53           HZ2      LYS  53 -28.903  10.125  -7.663
  391    HZ3  LYS  53           HZ3      LYS  53 -27.746  10.776  -6.604
  392    H    THR  54           HN       THR  54 -23.156   5.790  -6.475
  393    HA   THR  54           HA       THR  54 -23.108   3.082  -5.340
  394    HB   THR  54           HB       THR  54 -21.147   4.124  -7.387
  395    HG1  THR  54           HG1      THR  54 -23.622   2.763  -7.743
  396   HG21  THR  54          HG21      THR  54 -20.344   2.196  -6.130
  397   HG22  THR  54          HG22      THR  54 -20.772   1.676  -7.762
  398   HG23  THR  54          HG23      THR  54 -21.856   1.335  -6.415
  399    H    TYR  55           HN       TYR  55 -21.962   2.861  -3.540
  400    HA   TYR  55           HA       TYR  55 -19.852   4.800  -2.930
  401    HB2  TYR  55           HB2      TYR  55 -21.463   2.951  -1.197
  402    HB3  TYR  55           HB1      TYR  55 -19.854   3.421  -0.679
  403    HD1  TYR  55           HD1      TYR  55 -19.371   5.737  -0.051
  404    HD2  TYR  55           HD2      TYR  55 -23.275   4.545  -1.259
  405    HE1  TYR  55           HE1      TYR  55 -20.287   7.835   0.849
  406    HE2  TYR  55           HE2      TYR  55 -24.198   6.635  -0.360
  407    HH   TYR  55           HH       TYR  55 -23.611   8.339   1.307
  408    H    THR  56           HN       THR  56 -17.741   4.202  -2.777
  409    HA   THR  56           HA       THR  56 -17.169   1.417  -3.557
  410    HB   THR  56           HB       THR  56 -14.914   2.796  -4.336
  411    HG1  THR  56           HG1      THR  56 -17.179   4.497  -4.611
  412   HG21  THR  56          HG21      THR  56 -17.412   2.243  -5.969
  413   HG22  THR  56          HG22      THR  56 -16.028   1.167  -5.753
  414   HG23  THR  56          HG23      THR  56 -15.845   2.670  -6.656
  415    H    VAL  57           HN       VAL  57 -15.923   0.275  -2.228
  416    HA   VAL  57           HA       VAL  57 -14.212   1.750  -0.351
  417    HB   VAL  57           HB       VAL  57 -16.123   0.789   0.929
  418   HG11  VAL  57          HG11      VAL  57 -15.093  -1.891  -0.001
  419   HG12  VAL  57          HG12      VAL  57 -16.667  -1.184  -0.359
  420   HG13  VAL  57          HG13      VAL  57 -16.267  -1.658   1.289
  421   HG21  VAL  57          HG21      VAL  57 -13.451  -0.484   1.502
  422   HG22  VAL  57          HG22      VAL  57 -14.776  -0.329   2.655
  423   HG23  VAL  57          HG23      VAL  57 -13.987   1.114   2.018
  424    H    THR  58           HN       THR  58 -12.287   1.528  -1.161
  425    HA   THR  58           HA       THR  58 -11.501  -1.019  -2.392
  426    HB   THR  58           HB       THR  58 -10.125   1.664  -2.636
  427    HG1  THR  58           HG1      THR  58 -12.407   0.776  -3.735
  428   HG21  THR  58          HG21      THR  58  -9.859  -0.888  -4.240
  429   HG22  THR  58          HG22      THR  58  -8.665  -0.240  -3.115
  430   HG23  THR  58          HG23      THR  58  -9.050   0.639  -4.594
  431    H    GLU  59           HN       GLU  59 -10.019  -2.262  -1.510
  432    HA   GLU  59           HA       GLU  59  -9.050  -1.804   1.105
  433    HB2  GLU  59           HB2      GLU  59  -8.283  -3.847  -0.981
  434    HB3  GLU  59           HB1      GLU  59  -7.465  -3.760   0.547
  435    HG2  GLU  59           HG2      GLU  59 -10.429  -4.108   0.357
  436    HG3  GLU  59           HG1      GLU  59  -9.289  -5.453   0.406
  437    H    GLY  60           HN       GLY  60  -6.930  -1.228   1.859
  438    HA2  GLY  60           HA2      GLY  60  -5.371   0.269  -0.159
  439    HA3  GLY  60           HA1      GLY  60  -5.393   0.608   1.567
  440    H    SER  61           HN       SER  61  -3.024   0.559   1.239
  441    HA   SER  61           HA       SER  61  -2.009  -2.200   1.339
  442    HB2  SER  61           HB2      SER  61  -0.553   0.281   0.403
  443    HB3  SER  61           HB1      SER  61   0.115  -1.352   0.449
  444    HG   SER  61           HG       SER  61  -0.832  -0.507  -1.617
  445    H    GLY  62           HN       GLY  62  -1.351  -2.787   3.303
  446    HA2  GLY  62           HA2      GLY  62   0.051  -0.832   4.982
  447    HA3  GLY  62           HA1      GLY  62  -1.385  -1.612   5.635
  448    H    GLY  63           HN       GLY  63   0.476  -2.175   7.233
  449    HA2  GLY  63           HA2      GLY  63   2.141  -4.380   6.319
  450    HA3  GLY  63           HA1      GLY  63   2.167  -3.641   7.912
  451    H    ALA  64           HN       ALA  64  -0.830  -3.913   8.038
  452    HA   ALA  64           HA       ALA  64  -0.916  -6.381   9.412
  453    HB1  ALA  64           HB1      ALA  64  -2.393  -4.534   9.994
  454    HB2  ALA  64           HB2      ALA  64  -3.331  -5.974   9.593
  455    HB3  ALA  64           HB3      ALA  64  -3.187  -4.659   8.425
  456    H    GLY  65           HN       GLY  65  -1.607  -8.358   8.833
  457    HA2  GLY  65           HA2      GLY  65  -3.057  -9.632   7.235
  458    HA3  GLY  65           HA1      GLY  65  -2.218  -8.742   5.971
  459    H    GLY  66           HN       GLY  66   0.374  -8.833   7.128
  460    HA2  GLY  66           HA2      GLY  66   1.179 -11.462   6.291
  461    HA3  GLY  66           HA1      GLY  66   2.234 -10.205   6.929
  462    H    GLN  67           HN       GLN  67   1.001  -9.756   9.360
  463    HA   GLN  67           HA       GLN  67   0.841 -10.416  11.511
  464    HB2  GLN  67           HB2      GLN  67   0.360 -13.209  10.428
  465    HB3  GLN  67           HB1      GLN  67  -0.053 -12.600  12.051
  466    HG2  GLN  67           HG2      GLN  67  -1.259 -11.741   9.424
  467    HG3  GLN  67           HG1      GLN  67  -2.030 -12.710  10.676
  468   HE21  GLN  67          HE21      GLN  67  -2.760 -11.718  12.549
  469   HE22  GLN  67          HE22      GLN  67  -2.937  -9.996  12.665
  470    H    GLY  68           HN       GLY  68   1.830 -11.832  13.198
  471    HA2  GLY  68           HA2      GLY  68   4.178 -13.340  12.530
  472    HA3  GLY  68           HA1      GLY  68   4.556 -11.749  13.174
  473    H    MET  69           HN       MET  69   2.456 -11.495  14.987
  474    HA   MET  69           HA       MET  69   1.847 -11.927  17.118
  475    HB2  MET  69           HB2      MET  69   2.414 -14.770  16.288
  476    HB3  MET  69           HB1      MET  69   1.763 -14.338  17.864
  477    HG2  MET  69           HG2      MET  69   0.483 -13.825  15.190
  478    HG3  MET  69           HG1      MET  69  -0.017 -15.015  16.392
  479    HE1  MET  69           HE1      MET  69  -2.511 -14.152  16.415
  480    HE2  MET  69           HE2      MET  69  -2.083 -13.015  15.138
  481    HE3  MET  69           HE3      MET  69  -2.955 -12.455  16.566
  482    H    ILE  70           HN       ILE  70   2.748 -13.559  19.074
  483    HA   ILE  70           HA       ILE  70   4.353 -13.908  20.606
  484    HB   ILE  70           HB       ILE  70   6.336 -13.295  18.395
  485   HG12  ILE  70          HG12      ILE  70   5.341 -15.881  19.621
  486   HG13  ILE  70          HG11      ILE  70   5.073 -15.307  17.978
  487   HG21  ILE  70          HG21      ILE  70   8.076 -14.170  19.865
  488   HG22  ILE  70          HG22      ILE  70   6.894 -14.495  21.131
  489   HG23  ILE  70          HG23      ILE  70   7.260 -12.831  20.677
  490   HD11  ILE  70          HD11      ILE  70   7.449 -15.528  17.494
  491   HD12  ILE  70          HD12      ILE  70   6.765 -17.055  18.050
  492   HD13  ILE  70          HD13      ILE  70   7.740 -16.075  19.146
  493    H    GLN  71           HN       GLN  71   3.062 -11.941  21.057
  494    HA   GLN  71           HA       GLN  71   4.806  -9.602  21.421
  495    HB2  GLN  71           HB2      GLN  71   2.715  -8.289  21.608
  496    HB3  GLN  71           HB1      GLN  71   2.871  -9.072  20.047
  497    HG2  GLN  71           HG2      GLN  71   1.249 -10.260  22.275
  498    HG3  GLN  71           HG1      GLN  71   0.581  -9.082  21.152
  499   HE21  GLN  71          HE21      GLN  71   0.294  -9.662  18.979
  500   HE22  GLN  71          HE22      GLN  71   0.270 -11.327  18.484
  501    H    GLU  72           HN       GLU  72   4.474 -12.120  22.946
  502    HA   GLU  72           HA       GLU  72   3.156 -11.393  25.419
  503    HB2  GLU  72           HB2      GLU  72   4.886 -13.796  24.783
  504    HB3  GLU  72           HB1      GLU  72   3.845 -13.606  26.185
  505    HG2  GLU  72           HG2      GLU  72   3.030 -13.970  23.316
  506    HG3  GLU  72           HG1      GLU  72   2.736 -15.045  24.680
  507    HA   PRO  73           HA       PRO  73   6.679  -9.849  27.615
  508    HB2  PRO  73           HB2      PRO  73   6.807 -11.357  29.919
  509    HB3  PRO  73           HB1      PRO  73   5.623 -10.020  29.653
  510    HG2  PRO  73           HG2      PRO  73   5.244 -12.994  29.333
  511    HG3  PRO  73           HG1      PRO  73   4.157 -11.790  30.055
  512    HD2  PRO  73           HD2      PRO  73   3.771 -12.734  27.573
  513    HD3  PRO  73           HD1      PRO  73   3.418 -11.027  27.998
  514    H    ALA  74           HN       ALA  74   8.683 -10.620  28.961
  515    HA   ALA  74           HA       ALA  74  10.712 -11.598  28.971
  516    HB1  ALA  74           HB1      ALA  74  10.934 -13.962  28.567
  517    HB2  ALA  74           HB2      ALA  74   9.369 -14.005  27.753
  518    HB3  ALA  74           HB3      ALA  74   9.458 -13.655  29.479
  519    H    LEU  75           HN       LEU  75  12.538 -11.943  27.689
  520    HA   LEU  75           HA       LEU  75  12.164 -11.176  24.889
  521    HB2  LEU  75           HB2      LEU  75  14.522 -10.956  26.742
  522    HB3  LEU  75           HB1      LEU  75  14.678 -10.756  25.013
  523    HG   LEU  75           HG       LEU  75  14.581  -8.593  25.988
  524   HD11  LEU  75          HD11      LEU  75  13.419  -8.753  23.900
  525   HD12  LEU  75          HD12      LEU  75  12.541  -7.647  24.955
  526   HD13  LEU  75          HD13      LEU  75  11.947  -9.290  24.711
  527   HD21  LEU  75          HD21      LEU  75  13.592  -9.122  28.127
  528   HD22  LEU  75          HD22      LEU  75  12.043  -9.470  27.358
  529   HD23  LEU  75          HD23      LEU  75  12.680  -7.827  27.350
  530    HA   PRO  76           HA       PRO  76  13.448 -15.244  23.437
  531    HB2  PRO  76           HB2      PRO  76  15.370 -13.739  21.687
  532    HB3  PRO  76           HB1      PRO  76  14.274 -15.049  21.238
  533    HG2  PRO  76           HG2      PRO  76  13.679 -12.537  20.614
  534    HG3  PRO  76           HG1      PRO  76  12.400 -13.654  21.221
  535    HD2  PRO  76           HD2      PRO  76  13.785 -11.403  22.627
  536    HD3  PRO  76           HD1      PRO  76  12.124 -11.979  22.773
  537    HA   PRO  77           HA       PRO  77  16.827 -16.428  25.983
  538    HB2  PRO  77           HB2      PRO  77  17.445 -18.139  23.578
  539    HB3  PRO  77           HB1      PRO  77  17.455 -18.592  25.290
  540    HG2  PRO  77           HG2      PRO  77  15.365 -19.250  23.871
  541    HG3  PRO  77           HG1      PRO  77  15.115 -18.470  25.449
  542    HD2  PRO  77           HD2      PRO  77  14.884 -17.257  22.693
  543    HD3  PRO  77           HD1      PRO  77  13.849 -17.022  24.151
  544    H    GLY  78           HN       GLY  78  18.662 -15.420  26.374
  545    HA2  GLY  78           HA2      GLY  78  20.822 -14.650  26.023
  546    HA3  GLY  78           HA1      GLY  78  20.723 -15.213  24.367
  547    H    TRP  79           HN       TRP  79  18.081 -13.345  24.461
  548    HA   TRP  79           HA       TRP  79  19.616 -11.047  23.436
  549    HB2  TRP  79           HB2      TRP  79  16.707 -11.849  23.149
  550    HB3  TRP  79           HB1      TRP  79  17.340 -10.309  22.590
  551    HD1  TRP  79           HD1      TRP  79  17.811 -14.095  21.917
  552    HE1  TRP  79           HE1      TRP  79  18.616 -14.381  19.487
  553    HE3  TRP  79           HE3      TRP  79  18.354  -9.177  20.648
  554    HZ2  TRP  79           HZ2      TRP  79  19.366 -12.744  17.320
  555    HZ3  TRP  79           HZ3      TRP  79  19.115  -8.619  18.371
  556    HH2  TRP  79           HH2      TRP  79  19.614 -10.366  16.746
  557    H    GLU  80           HN       GLU  80  19.585  -9.029  24.422
  558    HA   GLU  80           HA       GLU  80  17.823  -8.747  26.774
  559    HB2  GLU  80           HB2      GLU  80  20.294  -8.871  27.313
  560    HB3  GLU  80           HB1      GLU  80  20.514  -7.404  26.370
  561    HG2  GLU  80           HG2      GLU  80  19.005  -6.208  27.897
  562    HG3  GLU  80           HG1      GLU  80  18.837  -7.674  28.859
  563    H    MET  81           HN       MET  81  17.025  -6.594  27.183
  564    HA   MET  81           HA       MET  81  17.097  -4.801  24.881
  565    HB2  MET  81           HB2      MET  81  15.075  -6.283  24.711
  566    HB3  MET  81           HB1      MET  81  14.520  -5.610  26.262
  567    HG2  MET  81           HG2      MET  81  15.101  -3.851  23.895
  568    HG3  MET  81           HG1      MET  81  13.551  -4.673  24.074
  569    HE1  MET  81           HE1      MET  81  12.293  -3.158  27.495
  570    HE2  MET  81           HE2      MET  81  13.232  -4.631  27.254
  571    HE3  MET  81           HE3      MET  81  11.897  -4.247  26.166
  572    H    LYS  82           HN       LYS  82  17.021  -2.614  25.452
  573    HA   LYS  82           HA       LYS  82  16.281  -1.712  28.000
  574    HB2  LYS  82           HB2      LYS  82  18.741  -0.882  28.569
  575    HB3  LYS  82           HB1      LYS  82  18.199  -2.468  29.082
  576    HG2  LYS  82           HG2      LYS  82  19.371  -3.512  27.232
  577    HG3  LYS  82           HG1      LYS  82  19.884  -1.895  26.643
  578    HD2  LYS  82           HD2      LYS  82  21.032  -1.571  28.835
  579    HD3  LYS  82           HD1      LYS  82  20.609  -3.233  29.256
  580    HE2  LYS  82           HE2      LYS  82  21.778  -3.879  27.061
  581    HE3  LYS  82           HE1      LYS  82  22.460  -2.255  27.106
  582    HZ1  LYS  82           HZ1      LYS  82  22.747  -4.289  29.247
  583    HZ2  LYS  82           HZ2      LYS  82  23.444  -2.741  29.235
  584    HZ3  LYS  82           HZ3      LYS  82  23.935  -3.899  28.105
  585    H    TYR  83           HN       TYR  83  16.664   0.665  28.213
  586    HA   TYR  83           HA       TYR  83  16.594   1.822  25.498
  587    HB2  TYR  83           HB2      TYR  83  15.510   2.923  28.129
  588    HB3  TYR  83           HB1      TYR  83  15.322   3.704  26.534
  589    HD1  TYR  83           HD1      TYR  83  13.910   2.597  24.803
  590    HD2  TYR  83           HD2      TYR  83  14.088   1.154  28.796
  591    HE1  TYR  83           HE1      TYR  83  11.833   1.343  24.436
  592    HE2  TYR  83           HE2      TYR  83  12.005  -0.099  28.439
  593    HH   TYR  83           HH       TYR  83  10.704  -0.658  25.404
  594    H    THR  84           HN       THR  84  17.538   3.916  25.114
  595    HA   THR  84           HA       THR  84  20.081   4.263  26.455
  596    HB   THR  84           HB       THR  84  20.610   5.899  24.769
  597    HG1  THR  84           HG1      THR  84  19.103   7.003  23.663
  598   HG21  THR  84          HG21      THR  84  20.159   4.733  22.673
  599   HG22  THR  84          HG22      THR  84  18.922   3.764  23.471
  600   HG23  THR  84          HG23      THR  84  20.609   3.597  23.948
  601    H    SER  85           HN       SER  85  20.491   6.961  26.547
  602    HA   SER  85           HA       SER  85  18.853   7.718  28.808
  603    HB2  SER  85           HB2      SER  85  20.499   9.750  28.711
  604    HB3  SER  85           HB1      SER  85  21.102   8.163  29.204
  605    HG   SER  85           HG       SER  85  21.185   9.101  26.515
  606    H    GLU  86           HN       GLU  86  18.072   7.832  25.776
  607    HA   GLU  86           HA       GLU  86  16.870  10.549  25.922
  608    HB2  GLU  86           HB2      GLU  86  17.475   9.039  23.347
  609    HB3  GLU  86           HB1      GLU  86  16.915  10.697  23.488
  610    HG2  GLU  86           HG2      GLU  86  19.142  10.977  23.011
  611    HG3  GLU  86           HG1      GLU  86  19.135  11.065  24.772
  612    H    GLY  87           HN       GLY  87  16.274   7.375  26.288
  613    HA2  GLY  87           HA2      GLY  87  14.190   6.327  26.502
  614    HA3  GLY  87           HA1      GLY  87  13.462   7.645  25.594
  615    H    VAL  88           HN       VAL  88  16.179   6.550  23.992
  616    HA   VAL  88           HA       VAL  88  14.575   5.385  21.903
  617    HB   VAL  88           HB       VAL  88  17.576   5.722  22.122
  618   HG11  VAL  88          HG11      VAL  88  15.926   4.972  19.718
  619   HG12  VAL  88          HG12      VAL  88  16.991   3.882  20.610
  620   HG13  VAL  88          HG13      VAL  88  17.664   5.263  19.743
  621   HG21  VAL  88          HG21      VAL  88  17.270   7.555  20.545
  622   HG22  VAL  88          HG22      VAL  88  16.361   7.840  22.031
  623   HG23  VAL  88          HG23      VAL  88  15.526   7.296  20.578
  624    H    ARG  89           HN       ARG  89  14.490   3.272  21.281
  625    HA   ARG  89           HA       ARG  89  15.232   1.318  23.317
  626    HB2  ARG  89           HB2      ARG  89  12.937   1.594  22.007
  627    HB3  ARG  89           HB1      ARG  89  13.770   0.614  20.814
  628    HG2  ARG  89           HG2      ARG  89  14.013  -1.181  22.339
  629    HG3  ARG  89           HG1      ARG  89  13.460  -0.178  23.692
  630    HD2  ARG  89           HD2      ARG  89  11.313   0.132  22.419
  631    HD3  ARG  89           HD1      ARG  89  11.880  -1.115  21.317
  632    HE   ARG  89           HE       ARG  89  11.795  -1.824  24.132
  633   HH11  ARG  89          HH11      ARG  89  10.334  -2.035  20.963
  634   HH12  ARG  89          HH12      ARG  89   9.131  -3.193  21.459
  635   HH21  ARG  89          HH21      ARG  89  10.221  -3.361  24.783
  636   HH22  ARG  89          HH22      ARG  89   9.042  -3.923  23.640
  637    H    TYR  90           HN       TYR  90  16.821  -0.157  23.063
  638    HA   TYR  90           HA       TYR  90  17.756  -0.746  20.366
  639    HB2  TYR  90           HB2      TYR  90  20.100  -0.548  20.964
  640    HB3  TYR  90           HB1      TYR  90  19.286   0.974  21.253
  641    HD1  TYR  90           HD1      TYR  90  18.837   1.711  23.588
  642    HD2  TYR  90           HD2      TYR  90  21.165  -1.741  22.727
  643    HE1  TYR  90           HE1      TYR  90  19.807   1.808  25.845
  644    HE2  TYR  90           HE2      TYR  90  22.126  -1.651  24.991
  645    HH   TYR  90           HH       TYR  90  20.882   0.325  27.452
  646    H    PHE  91           HN       PHE  91  18.973  -2.823  20.257
  647    HA   PHE  91           HA       PHE  91  18.194  -4.583  22.473
  648    HB2  PHE  91           HB2      PHE  91  18.121  -5.014  19.507
  649    HB3  PHE  91           HB1      PHE  91  18.383  -6.374  20.573
  650    HD1  PHE  91           HD1      PHE  91  16.557  -7.600  21.141
  651    HD2  PHE  91           HD2      PHE  91  16.052  -3.442  20.369
  652    HE1  PHE  91           HE1      PHE  91  14.148  -7.821  21.551
  653    HE2  PHE  91           HE2      PHE  91  13.636  -3.660  20.788
  654    HZ   PHE  91           HZ       PHE  91  12.680  -5.849  21.381
  655    H    VAL  92           HN       VAL  92  19.641  -6.326  22.952
  656    HA   VAL  92           HA       VAL  92  22.435  -5.647  22.265
  657    HB   VAL  92           HB       VAL  92  21.487  -6.850  24.872
  658   HG11  VAL  92          HG11      VAL  92  23.688  -6.225  25.699
  659   HG12  VAL  92          HG12      VAL  92  24.106  -5.564  24.120
  660   HG13  VAL  92          HG13      VAL  92  23.822  -7.297  24.308
  661   HG21  VAL  92          HG21      VAL  92  20.535  -4.668  24.765
  662   HG22  VAL  92          HG22      VAL  92  22.052  -3.979  24.193
  663   HG23  VAL  92          HG23      VAL  92  21.933  -4.602  25.838
  664    H    ASP  93           HN       ASP  93  23.600  -7.269  21.344
  665    HA   ASP  93           HA       ASP  93  22.520 -10.000  21.503
  666    HB2  ASP  93           HB2      ASP  93  23.251  -9.268  19.261
  667    HB3  ASP  93           HB1      ASP  93  24.868  -8.951  19.866
  668    H    HIS  94           HN       HIS  94  23.488 -11.549  22.814
  669    HA   HIS  94           HA       HIS  94  25.414 -10.503  24.686
  670    HB2  HIS  94           HB2      HIS  94  24.922 -12.381  26.031
  671    HB3  HIS  94           HB1      HIS  94  23.395 -11.927  25.284
  672    HD1  HIS  94           HD1      HIS  94  22.617 -13.503  23.220
  673    HD2  HIS  94           HD2      HIS  94  25.699 -14.977  25.600
  674    HE1  HIS  94           HE1      HIS  94  22.771 -15.961  22.702
  675    HE2  HIS  94           HE2      HIS  94  24.582 -16.850  24.202
  676    H    ASN  95           HN       ASN  95  25.554 -12.490  21.844
  677    HA   ASN  95           HA       ASN  95  27.898 -13.930  22.738
  678    HB2  ASN  95           HB2      ASN  95  27.259 -15.432  21.139
  679    HB3  ASN  95           HB1      ASN  95  25.881 -14.385  20.826
  680   HD21  ASN  95          HD21      ASN  95  25.934 -12.973  19.069
  681   HD22  ASN  95          HD22      ASN  95  27.057 -13.210  17.763
  682    H    THR  96           HN       THR  96  27.191 -11.262  20.525
  683    HA   THR  96           HA       THR  96  30.036 -11.028  19.912
  684    HB   THR  96           HB       THR  96  29.208  -9.131  18.422
  685    HG1  THR  96           HG1      THR  96  26.685 -10.347  19.010
  686   HG21  THR  96          HG21      THR  96  28.192 -11.929  17.915
  687   HG22  THR  96          HG22      THR  96  29.783 -11.301  17.490
  688   HG23  THR  96          HG23      THR  96  28.346 -10.665  16.693
  689    H    ARG  97           HN       ARG  97  27.741  -9.739  22.037
  690    HA   ARG  97           HA       ARG  97  27.633  -7.953  23.433
  691    HB2  ARG  97           HB2      ARG  97  30.596  -8.326  23.184
  692    HB3  ARG  97           HB1      ARG  97  29.945  -6.968  24.095
  693    HG2  ARG  97           HG2      ARG  97  28.582  -8.641  25.383
  694    HG3  ARG  97           HG1      ARG  97  29.556  -9.897  24.613
  695    HD2  ARG  97           HD2      ARG  97  31.550  -9.052  25.583
  696    HD3  ARG  97           HD1      ARG  97  30.740  -7.591  26.141
  697    HE   ARG  97           HE       ARG  97  29.614  -9.982  27.248
  698   HH11  ARG  97          HH11      ARG  97  32.210  -7.646  27.579
  699   HH12  ARG  97          HH12      ARG  97  32.398  -7.909  29.286
  700   HH21  ARG  97          HH21      ARG  97  29.860 -10.326  29.507
  701   HH22  ARG  97          HH22      ARG  97  31.070  -9.439  30.385
  702    H    THR  98           HN       THR  98  26.573  -6.995  21.639
  703    HA   THR  98           HA       THR  98  27.847  -4.496  20.809
  704    HB   THR  98           HB       THR  98  28.130  -6.340  19.005
  705    HG1  THR  98           HG1      THR  98  27.918  -4.773  17.426
  706   HG21  THR  98          HG21      THR  98  26.210  -6.670  17.515
  707   HG22  THR  98          HG22      THR  98  25.200  -5.697  18.584
  708   HG23  THR  98          HG23      THR  98  25.830  -7.247  19.141
  709    H    THR  99           HN       THR  99  26.142  -3.088  19.676
  710    HA   THR  99           HA       THR  99  23.518  -3.554  20.954
  711    HB   THR  99           HB       THR  99  23.327  -0.975  20.885
  712    HG1  THR  99           HG1      THR  99  24.953   0.033  20.024
  713   HG21  THR  99          HG21      THR  99  24.639  -0.690  22.985
  714   HG22  THR  99          HG22      THR  99  25.492  -2.197  22.660
  715   HG23  THR  99          HG23      THR  99  23.765  -2.227  23.010
  716    H    THR 100           HN       THR 100  21.812  -3.717  19.489
  717    HA   THR 100           HA       THR 100  22.217  -2.523  16.840
  718    HB   THR 100           HB       THR 100  22.750  -4.968  16.719
  719    HG1  THR 100           HG1      THR 100  21.226  -5.343  14.936
  720   HG21  THR 100          HG21      THR 100  19.867  -5.239  17.549
  721   HG22  THR 100          HG22      THR 100  21.286  -5.920  18.345
  722   HG23  THR 100          HG23      THR 100  20.779  -6.534  16.772
  723    H    PHE 101           HN       PHE 101  20.195  -2.211  15.651
  724    HA   PHE 101           HA       PHE 101  17.986  -1.684  17.520
  725    HB2  PHE 101           HB2      PHE 101  18.731  -0.396  14.872
  726    HB3  PHE 101           HB1      PHE 101  17.187  -0.064  15.765
  727    HD1  PHE 101           HD1      PHE 101  20.856   0.349  15.782
  728    HD2  PHE 101           HD2      PHE 101  17.187   1.254  17.736
  729    HE1  PHE 101           HE1      PHE 101  21.998   2.078  17.119
  730    HE2  PHE 101           HE2      PHE 101  18.312   2.975  19.073
  731    HZ   PHE 101           HZ       PHE 101  20.728   3.390  18.766
  732    H    LYS 102           HN       LYS 102  16.697  -3.428  17.477
  733    HA   LYS 102           HA       LYS 102  15.489  -4.113  14.900
  734    HB2  LYS 102           HB2      LYS 102  17.309  -5.796  15.531
  735    HB3  LYS 102           HB1      LYS 102  16.287  -6.257  16.883
  736    HG2  LYS 102           HG2      LYS 102  15.270  -6.329  14.062
  737    HG3  LYS 102           HG1      LYS 102  16.190  -7.665  14.749
  738    HD2  LYS 102           HD2      LYS 102  13.682  -6.549  16.005
  739    HD3  LYS 102           HD1      LYS 102  13.690  -7.910  14.882
  740    HE2  LYS 102           HE2      LYS 102  15.370  -7.892  17.370
  741    HE3  LYS 102           HE1      LYS 102  13.692  -8.436  17.388
  742    HZ1  LYS 102           HZ1      LYS 102  15.281 -10.263  17.104
  743    HZ2  LYS 102           HZ2      LYS 102  15.823  -9.573  15.651
  744    HZ3  LYS 102           HZ3      LYS 102  14.224 -10.124  15.786
  745    H    ASP 103           HN       ASP 103  13.606  -3.083  15.432
  746    HA   ASP 103           HA       ASP 103  12.119  -4.201  17.719
  747    HB2  ASP 103           HB2      ASP 103  12.787  -1.722  17.881
  748    HB3  ASP 103           HB1      ASP 103  11.649  -1.441  16.567
  749    HA   PRO 104           HA       PRO 104   9.445  -5.626  14.476
  750    HB2  PRO 104           HB2      PRO 104   7.408  -6.109  16.537
  751    HB3  PRO 104           HB1      PRO 104   8.300  -7.295  15.582
  752    HG2  PRO 104           HG2      PRO 104   8.698  -6.932  18.246
  753    HG3  PRO 104           HG1      PRO 104   9.978  -7.479  17.149
  754    HD2  PRO 104           HD2      PRO 104   9.498  -4.768  18.309
  755    HD3  PRO 104           HD1      PRO 104  11.033  -5.612  18.008
  756    H    ARG 105           HN       ARG 105   8.764  -2.990  16.548
  757    HA   ARG 105           HA       ARG 105   6.135  -2.376  15.569
  758    HB2  ARG 105           HB2      ARG 105   7.925  -1.409  17.560
  759    HB3  ARG 105           HB1      ARG 105   7.426  -0.051  16.559
  760    HG2  ARG 105           HG2      ARG 105   5.977  -0.290  18.472
  761    HG3  ARG 105           HG1      ARG 105   5.091  -0.599  16.977
  762    HD2  ARG 105           HD2      ARG 105   5.314  -3.020  17.363
  763    HD3  ARG 105           HD1      ARG 105   6.172  -2.693  18.870
  764    HE   ARG 105           HE       ARG 105   3.758  -1.312  18.988
  765   HH11  ARG 105          HH11      ARG 105   4.805  -4.653  18.806
  766   HH12  ARG 105          HH12      ARG 105   3.462  -5.252  19.720
  767   HH21  ARG 105          HH21      ARG 105   1.990  -2.099  20.180
  768   HH22  ARG 105          HH22      ARG 105   1.878  -3.805  20.531
  769    HA   PRO 106           HA       PRO 106   7.846  -0.803  11.640
  770    HB2  PRO 106           HB2      PRO 106   5.006   0.049  11.311
  771    HB3  PRO 106           HB1      PRO 106   6.064  -0.871  10.181
  772    HG2  PRO 106           HG2      PRO 106   4.092  -2.052  11.593
  773    HG3  PRO 106           HG1      PRO 106   5.598  -2.870  11.228
  774    HD2  PRO 106           HD2      PRO 106   4.658  -1.774  13.758
  775    HD3  PRO 106           HD1      PRO 106   5.744  -3.154  13.444
  776    H    GLY 107           HN       GLY 107   8.922   1.067  11.780
  777    HA2  GLY 107           HA2      GLY 107   9.175   3.362  11.657
  778    HA3  GLY 107           HA1      GLY 107   7.442   3.558  11.993
  779    H    PHE 108           HN       PHE 108   7.582   1.956  14.489
  780    HA   PHE 108           HA       PHE 108   7.466   2.629  16.716
  781    HB2  PHE 108           HB2      PHE 108   9.771   2.758  17.753
  782    HB3  PHE 108           HB1      PHE 108   9.469   1.299  16.752
  783    HD1  PHE 108           HD1      PHE 108  11.332   4.446  17.059
  784    HD2  PHE 108           HD2      PHE 108  10.689   0.968  14.676
  785    HE1  PHE 108           HE1      PHE 108  13.399   4.912  15.813
  786    HE2  PHE 108           HE2      PHE 108  12.750   1.438  13.429
  787    HZ   PHE 108           HZ       PHE 108  14.113   3.412  13.999
  788    H    GLU 109           HN       GLU 109   7.133   4.868  14.919
  789    HA   GLU 109           HA       GLU 109   7.034   6.991  16.713
  790    HB2  GLU 109           HB2      GLU 109   9.486   7.033  16.536
  791    HB3  GLU 109           HB1      GLU 109   9.369   7.130  14.786
  792    HG2  GLU 109           HG2      GLU 109   9.883   9.297  15.628
  793    HG3  GLU 109           HG1      GLU 109   8.222   9.320  15.040
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1 -40.139   3.114  -5.212
    2    H2   GLY   1           HT2      GLY   1 -38.715   3.627  -4.454
    3    H3   GLY   1           HT3      GLY   1 -39.617   4.714  -5.390
    4    HA2  GLY   1           HA1      GLY   1 -41.463   4.546  -3.828
    5    HA3  GLY   1           HA2      GLY   1 -40.494   3.450  -2.852
    6    H    SER   2           HN       SER   2 -40.570   4.807  -1.063
    7    HA   SER   2           HA       SER   2 -39.708   7.540  -1.198
    8    HB2  SER   2           HB2      SER   2 -39.972   5.802   1.264
    9    HB3  SER   2           HB1      SER   2 -40.061   7.563   1.174
   10    HG   SER   2           HG       SER   2 -41.957   7.246  -0.179
   11    H    HIS   3           HN       HIS   3 -38.171   4.487  -0.816
   12    HA   HIS   3           HA       HIS   3 -35.762   5.676   0.334
   13    HB2  HIS   3           HB2      HIS   3 -36.285   2.792  -0.444
   14    HB3  HIS   3           HB1      HIS   3 -34.911   3.388   0.477
   15    HD1  HIS   3           HD1      HIS   3 -36.954   1.199   1.480
   16    HD2  HIS   3           HD2      HIS   3 -37.012   5.236   2.502
   17    HE1  HIS   3           HE1      HIS   3 -38.196   1.337   3.664
   18    HE2  HIS   3           HE2      HIS   3 -38.430   3.799   4.122
   19    H    MET   4           HN       MET   4 -33.642   5.328  -0.765
   20    HA   MET   4           HA       MET   4 -33.974   5.209  -3.692
   21    HB2  MET   4           HB2      MET   4 -31.816   6.696  -2.165
   22    HB3  MET   4           HB1      MET   4 -31.989   6.635  -3.907
   23    HG2  MET   4           HG2      MET   4 -34.225   7.731  -3.632
   24    HG3  MET   4           HG1      MET   4 -33.806   7.971  -1.937
   25    HE1  MET   4           HE1      MET   4 -31.575   9.857  -5.508
   26    HE2  MET   4           HE2      MET   4 -33.049   8.898  -5.650
   27    HE3  MET   4           HE3      MET   4 -31.540   8.129  -5.161
   28    H    GLN   5           HN       GLN   5 -32.722   3.781  -4.816
   29    HA   GLN   5           HA       GLN   5 -31.451   1.705  -3.346
   30    HB2  GLN   5           HB2      GLN   5 -32.553   1.160  -5.401
   31    HB3  GLN   5           HB1      GLN   5 -31.575   2.311  -6.297
   32    HG2  GLN   5           HG2      GLN   5 -29.607   0.959  -5.977
   33    HG3  GLN   5           HG1      GLN   5 -30.505  -0.157  -4.948
   34   HE21  GLN   5          HE21      GLN   5 -30.037   1.004  -8.204
   35   HE22  GLN   5          HE22      GLN   5 -30.823  -0.348  -9.005
   36    H    TYR   6           HN       TYR   6 -29.495   1.721  -2.519
   37    HA   TYR   6           HA       TYR   6 -27.412   3.332  -3.859
   38    HB2  TYR   6           HB2      TYR   6 -27.831   2.746  -0.901
   39    HB3  TYR   6           HB1      TYR   6 -26.238   3.182  -1.503
   40    HD1  TYR   6           HD1      TYR   6 -25.742   5.471  -2.121
   41    HD2  TYR   6           HD2      TYR   6 -29.692   4.352  -0.986
   42    HE1  TYR   6           HE1      TYR   6 -26.359   7.840  -1.939
   43    HE2  TYR   6           HE2      TYR   6 -30.310   6.724  -0.806
   44    HH   TYR   6           HH       TYR   6 -29.261   8.890  -0.492
   45    H    LYS   7           HN       LYS   7 -25.529   2.257  -4.395
   46    HA   LYS   7           HA       LYS   7 -25.506  -0.609  -3.761
   47    HB2  LYS   7           HB2      LYS   7 -24.224  -0.788  -6.025
   48    HB3  LYS   7           HB1      LYS   7 -25.996  -0.635  -6.039
   49    HG2  LYS   7           HG2      LYS   7 -25.634   1.848  -6.337
   50    HG3  LYS   7           HG1      LYS   7 -23.940   1.463  -6.647
   51    HD2  LYS   7           HD2      LYS   7 -26.275   0.314  -8.174
   52    HD3  LYS   7           HD1      LYS   7 -25.288   1.670  -8.719
   53    HE2  LYS   7           HE2      LYS   7 -24.171  -1.047  -8.073
   54    HE3  LYS   7           HE1      LYS   7 -24.692  -0.572  -9.686
   55    HZ1  LYS   7           HZ1      LYS   7 -22.655   0.942  -8.156
   56    HZ2  LYS   7           HZ2      LYS   7 -23.020   1.069  -9.804
   57    HZ3  LYS   7           HZ3      LYS   7 -22.263  -0.326  -9.210
   58    H    LEU   8           HN       LEU   8 -23.521  -1.674  -3.668
   59    HA   LEU   8           HA       LEU   8 -21.255   0.088  -2.974
   60    HB2  LEU   8           HB2      LEU   8 -22.409  -0.798  -0.915
   61    HB3  LEU   8           HB1      LEU   8 -22.036  -2.413  -1.461
   62    HG   LEU   8           HG       LEU   8 -19.592  -1.783  -1.334
   63   HD11  LEU   8          HD11      LEU   8 -19.161   0.110   0.310
   64   HD12  LEU   8          HD12      LEU   8 -20.800   0.662  -0.051
   65   HD13  LEU   8          HD13      LEU   8 -19.588   0.575  -1.328
   66   HD21  LEU   8          HD21      LEU   8 -19.665  -1.882   1.217
   67   HD22  LEU   8          HD22      LEU   8 -20.442  -3.188   0.321
   68   HD23  LEU   8          HD23      LEU   8 -21.419  -1.902   1.029
   69    H    ILE   9           HN       ILE   9 -19.232  -0.690  -3.432
   70    HA   ILE   9           HA       ILE   9 -19.067  -3.278  -4.822
   71    HB   ILE   9           HB       ILE   9 -17.654  -0.712  -5.617
   72   HG12  ILE   9          HG12      ILE   9 -19.632  -2.416  -7.197
   73   HG13  ILE   9          HG11      ILE   9 -20.073  -0.886  -6.352
   74   HG21  ILE   9          HG21      ILE   9 -16.719  -2.062  -7.468
   75   HG22  ILE   9          HG22      ILE   9 -17.403  -3.507  -6.723
   76   HG23  ILE   9          HG23      ILE   9 -16.162  -2.585  -5.878
   77   HD11  ILE   9          HD11      ILE   9 -19.722  -0.532  -8.742
   78   HD12  ILE   9          HD12      ILE   9 -18.087  -1.187  -8.621
   79   HD13  ILE   9          HD13      ILE   9 -18.495   0.318  -7.798
   80    H    LEU  10           HN       LEU  10 -17.688  -4.603  -3.794
   81    HA   LEU  10           HA       LEU  10 -15.851  -3.400  -1.865
   82    HB2  LEU  10           HB2      LEU  10 -16.500  -6.320  -2.224
   83    HB3  LEU  10           HB1      LEU  10 -15.470  -5.645  -0.989
   84    HG   LEU  10           HG       LEU  10 -17.374  -6.057   0.190
   85   HD11  LEU  10          HD11      LEU  10 -16.758  -3.706   0.438
   86   HD12  LEU  10          HD12      LEU  10 -18.458  -4.043   0.759
   87   HD13  LEU  10          HD13      LEU  10 -17.986  -3.293  -0.766
   88   HD21  LEU  10          HD21      LEU  10 -18.712  -6.770  -1.769
   89   HD22  LEU  10          HD22      LEU  10 -19.118  -5.076  -2.053
   90   HD23  LEU  10          HD23      LEU  10 -19.632  -5.869  -0.567
   91    H    ASN  11           HN       ASN  11 -13.975  -2.840  -2.677
   92    HA   ASN  11           HA       ASN  11 -12.817  -4.569  -4.754
   93    HB2  ASN  11           HB2      ASN  11 -13.189  -1.982  -5.017
   94    HB3  ASN  11           HB1      ASN  11 -11.729  -1.862  -4.045
   95   HD21  ASN  11          HD21      ASN  11 -12.207  -1.037  -6.761
   96   HD22  ASN  11          HD22      ASN  11 -11.051  -1.867  -7.745
   97    H    GLY  12           HN       GLY  12 -12.115  -6.136  -3.237
   98    HA2  GLY  12           HA2      GLY  12  -9.665  -5.272  -1.817
   99    HA3  GLY  12           HA1      GLY  12 -10.761  -6.497  -1.129
  100    H    LYS  13           HN       LYS  13  -8.853  -7.843  -1.077
  101    HA   LYS  13           HA       LYS  13  -7.939  -8.781  -3.674
  102    HB2  LYS  13           HB2      LYS  13  -6.992  -9.503  -0.899
  103    HB3  LYS  13           HB1      LYS  13  -6.408 -10.292  -2.355
  104    HG2  LYS  13           HG2      LYS  13  -5.815  -7.946  -3.169
  105    HG3  LYS  13           HG1      LYS  13  -6.044  -7.453  -1.488
  106    HD2  LYS  13           HD2      LYS  13  -3.702  -7.931  -1.874
  107    HD3  LYS  13           HD1      LYS  13  -4.384  -9.159  -0.804
  108    HE2  LYS  13           HE2      LYS  13  -4.724 -10.589  -2.852
  109    HE3  LYS  13           HE1      LYS  13  -3.762  -9.408  -3.742
  110    HZ1  LYS  13           HZ1      LYS  13  -2.508 -11.369  -2.909
  111    HZ2  LYS  13           HZ2      LYS  13  -2.796 -10.840  -1.323
  112    HZ3  LYS  13           HZ3      LYS  13  -1.884  -9.880  -2.388
  113    H    THR  14           HN       THR  14  -9.291 -10.517  -0.786
  114    HA   THR  14           HA       THR  14 -10.021 -12.680  -2.611
  115    HB   THR  14           HB       THR  14 -10.694 -13.763  -0.341
  116    HG1  THR  14           HG1      THR  14  -9.829 -12.834   1.467
  117   HG21  THR  14          HG21      THR  14  -7.806 -13.171  -1.011
  118   HG22  THR  14          HG22      THR  14  -8.781 -14.491  -1.662
  119   HG23  THR  14          HG23      THR  14  -8.366 -14.462   0.050
  120    H    LEU  15           HN       LEU  15 -11.417  -9.969  -1.192
  121    HA   LEU  15           HA       LEU  15 -14.098 -11.082  -1.523
  122    HB2  LEU  15           HB2      LEU  15 -12.973  -9.139   0.417
  123    HB3  LEU  15           HB1      LEU  15 -14.642  -9.001  -0.040
  124    HG   LEU  15           HG       LEU  15 -13.382 -11.477   1.125
  125   HD11  LEU  15          HD11      LEU  15 -14.518 -10.891   3.170
  126   HD12  LEU  15          HD12      LEU  15 -15.153  -9.424   2.427
  127   HD13  LEU  15          HD13      LEU  15 -13.416  -9.601   2.691
  128   HD21  LEU  15          HD21      LEU  15 -16.276 -10.767   0.707
  129   HD22  LEU  15          HD22      LEU  15 -15.629 -12.289   1.318
  130   HD23  LEU  15          HD23      LEU  15 -15.339 -11.814  -0.355
  131    H    LYS  16           HN       LYS  16 -14.439 -10.597  -3.595
  132    HA   LYS  16           HA       LYS  16 -14.542  -7.761  -4.300
  133    HB2  LYS  16           HB2      LYS  16 -13.474 -10.059  -5.950
  134    HB3  LYS  16           HB1      LYS  16 -13.855  -8.479  -6.621
  135    HG2  LYS  16           HG2      LYS  16 -12.096  -7.456  -5.555
  136    HG3  LYS  16           HG1      LYS  16 -11.992  -8.681  -4.296
  137    HD2  LYS  16           HD2      LYS  16 -10.165  -8.623  -6.019
  138    HD3  LYS  16           HD1      LYS  16 -10.923 -10.190  -5.728
  139    HE2  LYS  16           HE2      LYS  16 -10.608  -9.848  -8.119
  140    HE3  LYS  16           HE1      LYS  16 -12.328  -9.825  -7.738
  141    HZ1  LYS  16           HZ1      LYS  16 -10.636  -7.407  -8.148
  142    HZ2  LYS  16           HZ2      LYS  16 -12.306  -7.421  -7.845
  143    HZ3  LYS  16           HZ3      LYS  16 -11.705  -8.065  -9.287
  144    H    GLY  17           HN       GLY  17 -16.527  -7.235  -4.762
  145    HA2  GLY  17           HA2      GLY  17 -18.263  -8.520  -6.486
  146    HA3  GLY  17           HA1      GLY  17 -18.652  -9.096  -4.866
  147    H    GLU  18           HN       GLU  18 -20.709  -7.937  -5.640
  148    HA   GLU  18           HA       GLU  18 -20.594  -5.212  -4.538
  149    HB2  GLU  18           HB2      GLU  18 -22.032  -6.086  -7.051
  150    HB3  GLU  18           HB1      GLU  18 -22.263  -4.526  -6.271
  151    HG2  GLU  18           HG2      GLU  18 -20.403  -3.685  -7.150
  152    HG3  GLU  18           HG1      GLU  18 -19.464  -5.134  -6.794
  153    H    THR  19           HN       THR  19 -22.842  -4.391  -4.089
  154    HA   THR  19           HA       THR  19 -24.906  -6.308  -3.561
  155    HB   THR  19           HB       THR  19 -23.363  -6.708  -1.631
  156    HG1  THR  19           HG1      THR  19 -25.182  -7.145  -0.678
  157   HG21  THR  19          HG21      THR  19 -23.181  -4.975   0.122
  158   HG22  THR  19          HG22      THR  19 -24.051  -3.841  -0.909
  159   HG23  THR  19          HG23      THR  19 -22.455  -4.419  -1.390
  160    H    THR  20           HN       THR  20 -26.746  -5.108  -2.290
  161    HA   THR  20           HA       THR  20 -26.732  -2.254  -2.866
  162    HB   THR  20           HB       THR  20 -29.079  -2.547  -3.883
  163    HG1  THR  20           HG1      THR  20 -28.721  -4.803  -5.133
  164   HG21  THR  20          HG21      THR  20 -26.586  -3.349  -5.400
  165   HG22  THR  20          HG22      THR  20 -27.313  -1.743  -5.308
  166   HG23  THR  20          HG23      THR  20 -28.133  -3.036  -6.177
  167    H    THR  21           HN       THR  21 -28.351  -1.051  -1.812
  168    HA   THR  21           HA       THR  21 -30.271  -2.379  -0.110
  169    HB   THR  21           HB       THR  21 -28.083  -2.232   1.275
  170    HG1  THR  21           HG1      THR  21 -30.019  -2.610   2.326
  171   HG21  THR  21          HG21      THR  21 -28.927   0.698   1.293
  172   HG22  THR  21          HG22      THR  21 -27.401   0.064   0.675
  173   HG23  THR  21          HG23      THR  21 -27.754  -0.004   2.406
  174    H    GLU  22           HN       GLU  22 -31.820  -0.796   0.801
  175    HA   GLU  22           HA       GLU  22 -31.880   1.611  -0.894
  176    HB2  GLU  22           HB2      GLU  22 -34.363   1.562  -0.453
  177    HB3  GLU  22           HB1      GLU  22 -33.794   0.145  -1.329
  178    HG2  GLU  22           HG2      GLU  22 -33.758  -1.115   0.799
  179    HG3  GLU  22           HG1      GLU  22 -34.505   0.313   1.605
  180    H    ALA  23           HN       ALA  23 -31.627   3.545   0.030
  181    HA   ALA  23           HA       ALA  23 -32.339   3.872   2.874
  182    HB1  ALA  23           HB1      ALA  23 -29.663   4.746   1.744
  183    HB2  ALA  23           HB2      ALA  23 -29.904   3.326   2.760
  184    HB3  ALA  23           HB3      ALA  23 -30.222   4.936   3.406
  185    H    VAL  24           HN       VAL  24 -32.580   6.190   3.453
  186    HA   VAL  24           HA       VAL  24 -33.445   7.730   1.122
  187    HB   VAL  24           HB       VAL  24 -34.642   9.163   2.730
  188   HG11  VAL  24          HG11      VAL  24 -35.190   6.219   3.092
  189   HG12  VAL  24          HG12      VAL  24 -35.766   7.224   1.763
  190   HG13  VAL  24          HG13      VAL  24 -36.328   7.529   3.407
  191   HG21  VAL  24          HG21      VAL  24 -34.793   8.490   5.091
  192   HG22  VAL  24          HG22      VAL  24 -33.150   8.942   4.640
  193   HG23  VAL  24          HG23      VAL  24 -33.582   7.241   4.803
  194    H    ASP  25           HN       ASP  25 -30.623   7.437   2.534
  195    HA   ASP  25           HA       ASP  25 -29.860  10.175   2.085
  196    HB2  ASP  25           HB2      ASP  25 -30.606  10.429   4.347
  197    HB3  ASP  25           HB1      ASP  25 -29.743   8.984   4.852
  198    H    ALA  26           HN       ALA  26 -27.534  10.499   2.246
  199    HA   ALA  26           HA       ALA  26 -26.173   8.191   1.134
  200    HB1  ALA  26           HB1      ALA  26 -25.925  10.446   0.127
  201    HB2  ALA  26           HB2      ALA  26 -24.381   9.727   0.591
  202    HB3  ALA  26           HB3      ALA  26 -25.108  10.980   1.598
  203    H    ALA  27           HN       ALA  27 -25.978  10.223   4.027
  204    HA   ALA  27           HA       ALA  27 -23.540   9.058   4.996
  205    HB1  ALA  27           HB1      ALA  27 -24.237  11.323   5.654
  206    HB2  ALA  27           HB2      ALA  27 -24.009  10.278   7.054
  207    HB3  ALA  27           HB3      ALA  27 -25.637  10.646   6.485
  208    H    THR  28           HN       THR  28 -26.963   8.610   5.482
  209    HA   THR  28           HA       THR  28 -26.826   6.639   7.502
  210    HB   THR  28           HB       THR  28 -29.002   6.869   5.410
  211    HG1  THR  28           HG1      THR  28 -28.501   8.931   6.418
  212   HG21  THR  28          HG21      THR  28 -29.142   4.916   6.909
  213   HG22  THR  28          HG22      THR  28 -30.445   6.068   7.222
  214   HG23  THR  28          HG23      THR  28 -29.053   5.990   8.305
  215    H    ALA  29           HN       ALA  29 -26.423   6.461   4.034
  216    HA   ALA  29           HA       ALA  29 -26.780   3.595   3.875
  217    HB1  ALA  29           HB1      ALA  29 -26.069   3.850   1.564
  218    HB2  ALA  29           HB2      ALA  29 -25.580   5.515   1.875
  219    HB3  ALA  29           HB3      ALA  29 -27.282   5.063   1.959
  220    H    GLU  30           HN       GLU  30 -24.172   5.930   4.060
  221    HA   GLU  30           HA       GLU  30 -21.971   4.281   3.683
  222    HB2  GLU  30           HB2      GLU  30 -22.077   6.842   3.940
  223    HB3  GLU  30           HB1      GLU  30 -22.081   6.542   5.671
  224    HG2  GLU  30           HG2      GLU  30 -19.943   5.283   5.373
  225    HG3  GLU  30           HG1      GLU  30 -19.931   5.861   3.706
  226    H    LYS  31           HN       LYS  31 -23.245   5.407   6.796
  227    HA   LYS  31           HA       LYS  31 -21.801   3.933   8.518
  228    HB2  LYS  31           HB2      LYS  31 -24.711   4.635   8.817
  229    HB3  LYS  31           HB1      LYS  31 -23.655   4.127  10.126
  230    HG2  LYS  31           HG2      LYS  31 -23.416   6.627   8.471
  231    HG3  LYS  31           HG1      LYS  31 -23.853   6.509  10.173
  232    HD2  LYS  31           HD2      LYS  31 -21.193   5.675   9.018
  233    HD3  LYS  31           HD1      LYS  31 -21.507   7.219   9.810
  234    HE2  LYS  31           HE2      LYS  31 -21.895   4.536  11.119
  235    HE3  LYS  31           HE1      LYS  31 -20.432   5.505  11.266
  236    HZ1  LYS  31           HZ1      LYS  31 -21.776   7.283  12.232
  237    HZ2  LYS  31           HZ2      LYS  31 -21.860   5.862  13.149
  238    HZ3  LYS  31           HZ3      LYS  31 -23.153   6.301  12.147
  239    H    VAL  32           HN       VAL  32 -24.754   2.760   6.910
  240    HA   VAL  32           HA       VAL  32 -24.867   0.330   8.412
  241    HB   VAL  32           HB       VAL  32 -26.096   0.980   5.721
  242   HG11  VAL  32          HG11      VAL  32 -26.710  -1.252   7.663
  243   HG12  VAL  32          HG12      VAL  32 -25.978  -1.422   6.066
  244   HG13  VAL  32          HG13      VAL  32 -27.647  -0.871   6.218
  245   HG21  VAL  32          HG21      VAL  32 -28.149   1.393   6.987
  246   HG22  VAL  32          HG22      VAL  32 -26.858   2.496   7.464
  247   HG23  VAL  32          HG23      VAL  32 -27.273   1.126   8.494
  248    H    PHE  33           HN       PHE  33 -23.726   1.115   5.121
  249    HA   PHE  33           HA       PHE  33 -22.890  -1.536   4.532
  250    HB2  PHE  33           HB2      PHE  33 -22.416   1.127   3.281
  251    HB3  PHE  33           HB1      PHE  33 -21.352  -0.188   2.840
  252    HD1  PHE  33           HD1      PHE  33 -23.339  -2.444   2.872
  253    HD2  PHE  33           HD2      PHE  33 -23.584   1.515   1.328
  254    HE1  PHE  33           HE1      PHE  33 -24.975  -3.201   1.198
  255    HE2  PHE  33           HE2      PHE  33 -25.229   0.767  -0.341
  256    HZ   PHE  33           HZ       PHE  33 -25.932  -1.598  -0.415
  257    H    LYS  34           HN       LYS  34 -21.429   1.003   6.389
  258    HA   LYS  34           HA       LYS  34 -18.753   0.156   6.151
  259    HB2  LYS  34           HB2      LYS  34 -20.127   1.588   8.445
  260    HB3  LYS  34           HB1      LYS  34 -18.400   1.438   8.282
  261    HG2  LYS  34           HG2      LYS  34 -19.056   2.519   5.908
  262    HG3  LYS  34           HG1      LYS  34 -20.179   3.298   7.042
  263    HD2  LYS  34           HD2      LYS  34 -18.211   4.564   7.101
  264    HD3  LYS  34           HD1      LYS  34 -18.196   3.623   8.565
  265    HE2  LYS  34           HE2      LYS  34 -16.688   2.012   7.512
  266    HE3  LYS  34           HE1      LYS  34 -16.716   2.951   6.020
  267    HZ1  LYS  34           HZ1      LYS  34 -14.739   3.503   7.182
  268    HZ2  LYS  34           HZ2      LYS  34 -15.578   3.775   8.631
  269    HZ3  LYS  34           HZ3      LYS  34 -15.781   4.838   7.324
  270    H    GLN  35           HN       GLN  35 -21.349  -0.690   8.379
  271    HA   GLN  35           HA       GLN  35 -19.775  -2.477   9.942
  272    HB2  GLN  35           HB2      GLN  35 -21.876  -1.397  10.762
  273    HB3  GLN  35           HB1      GLN  35 -22.792  -2.385   9.637
  274    HG2  GLN  35           HG2      GLN  35 -22.834  -3.283  11.926
  275    HG3  GLN  35           HG1      GLN  35 -22.116  -4.401  10.770
  276   HE21  GLN  35          HE21      GLN  35 -19.950  -4.867  10.885
  277   HE22  GLN  35          HE22      GLN  35 -18.986  -4.483  12.271
  278    H    TYR  36           HN       TYR  36 -21.696  -2.695   7.052
  279    HA   TYR  36           HA       TYR  36 -21.845  -5.499   6.813
  280    HB2  TYR  36           HB2      TYR  36 -23.286  -4.161   5.455
  281    HB3  TYR  36           HB1      TYR  36 -21.940  -3.227   4.823
  282    HD1  TYR  36           HD1      TYR  36 -23.730  -6.415   4.637
  283    HD2  TYR  36           HD2      TYR  36 -20.624  -4.046   2.960
  284    HE1  TYR  36           HE1      TYR  36 -23.630  -7.932   2.714
  285    HE2  TYR  36           HE2      TYR  36 -20.516  -5.553   1.021
  286    HH   TYR  36           HH       TYR  36 -22.897  -7.803   0.309
  287    H    ALA  37           HN       ALA  37 -19.553  -3.123   5.488
  288    HA   ALA  37           HA       ALA  37 -17.851  -5.078   4.296
  289    HB1  ALA  37           HB1      ALA  37 -18.006  -2.719   3.558
  290    HB2  ALA  37           HB2      ALA  37 -16.349  -3.229   3.882
  291    HB3  ALA  37           HB3      ALA  37 -17.210  -2.223   5.049
  292    H    ASN  38           HN       ASN  38 -17.856  -3.298   7.326
  293    HA   ASN  38           HA       ASN  38 -15.364  -4.025   8.358
  294    HB2  ASN  38           HB2      ASN  38 -16.858  -2.308   9.392
  295    HB3  ASN  38           HB1      ASN  38 -17.968  -3.580   9.882
  296   HD21  ASN  38          HD21      ASN  38 -15.158  -1.787  10.735
  297   HD22  ASN  38          HD22      ASN  38 -14.783  -2.688  12.224
  298    H    ASP  39           HN       ASP  39 -18.471  -5.700   8.554
  299    HA   ASP  39           HA       ASP  39 -17.568  -7.759  10.280
  300    HB2  ASP  39           HB2      ASP  39 -19.979  -6.991   9.763
  301    HB3  ASP  39           HB1      ASP  39 -19.873  -8.057   8.369
  302    H    ASN  40           HN       ASN  40 -17.140  -7.227   6.917
  303    HA   ASN  40           HA       ASN  40 -16.490 -10.052   6.462
  304    HB2  ASN  40           HB2      ASN  40 -17.021  -7.766   4.578
  305    HB3  ASN  40           HB1      ASN  40 -16.165  -9.199   4.034
  306   HD21  ASN  40          HD21      ASN  40 -19.224  -7.881   5.033
  307   HD22  ASN  40          HD22      ASN  40 -20.190  -9.299   4.601
  308    H    GLY  41           HN       GLY  41 -15.014  -7.211   7.392
  309    HA2  GLY  41           HA2      GLY  41 -12.759  -6.961   7.904
  310    HA3  GLY  41           HA1      GLY  41 -12.406  -8.369   6.918
  311    H    VAL  42           HN       VAL  42 -14.317  -5.760   5.591
  312    HA   VAL  42           HA       VAL  42 -12.002  -5.007   3.968
  313    HB   VAL  42           HB       VAL  42 -14.931  -4.813   3.243
  314   HG11  VAL  42          HG11      VAL  42 -12.436  -4.234   1.639
  315   HG12  VAL  42          HG12      VAL  42 -13.560  -3.033   2.269
  316   HG13  VAL  42          HG13      VAL  42 -14.086  -4.167   1.020
  317   HG21  VAL  42          HG21      VAL  42 -12.750  -6.701   2.369
  318   HG22  VAL  42          HG22      VAL  42 -14.306  -6.545   1.550
  319   HG23  VAL  42          HG23      VAL  42 -14.239  -7.098   3.228
  320    H    ASP  43           HN       ASP  43 -11.210  -3.112   4.370
  321    HA   ASP  43           HA       ASP  43 -12.977  -0.849   4.813
  322    HB2  ASP  43           HB2      ASP  43 -12.110  -1.833   7.081
  323    HB3  ASP  43           HB1      ASP  43 -10.579  -1.094   6.618
  324    H    GLY  44           HN       GLY  44 -11.986   1.145   4.185
  325    HA2  GLY  44           HA2      GLY  44  -9.399   1.464   3.299
  326    HA3  GLY  44           HA1      GLY  44 -10.294   0.810   1.932
  327    H    GLU  45           HN       GLU  45  -9.559   2.977   1.086
  328    HA   GLU  45           HA       GLU  45 -10.702   5.403   1.922
  329    HB2  GLU  45           HB2      GLU  45  -9.317   4.385  -0.436
  330    HB3  GLU  45           HB1      GLU  45 -10.549   5.571  -0.849
  331    HG2  GLU  45           HG2      GLU  45  -8.409   6.027   1.216
  332    HG3  GLU  45           HG1      GLU  45  -8.277   6.510  -0.476
  333    H    TRP  46           HN       TRP  46 -12.630   6.369   1.522
  334    HA   TRP  46           HA       TRP  46 -14.656   4.655   0.256
  335    HB2  TRP  46           HB2      TRP  46 -14.788   6.367   2.699
  336    HB3  TRP  46           HB1      TRP  46 -16.226   6.281   1.699
  337    HD1  TRP  46           HD1      TRP  46 -13.712   3.783   3.261
  338    HE1  TRP  46           HE1      TRP  46 -14.993   1.725   4.102
  339    HE3  TRP  46           HE3      TRP  46 -18.485   5.101   1.840
  340    HZ2  TRP  46           HZ2      TRP  46 -17.622   0.778   4.159
  341    HZ3  TRP  46           HZ3      TRP  46 -20.310   3.550   2.353
  342    HH2  TRP  46           HH2      TRP  46 -19.888   1.424   3.484
  343    H    THR  47           HN       THR  47 -15.169   5.319  -1.672
  344    HA   THR  47           HA       THR  47 -15.228   8.204  -2.229
  345    HB   THR  47           HB       THR  47 -15.070   7.319  -4.697
  346    HG1  THR  47           HG1      THR  47 -14.158   5.146  -3.126
  347   HG21  THR  47          HG21      THR  47 -12.678   7.321  -2.856
  348   HG22  THR  47          HG22      THR  47 -13.407   8.747  -3.591
  349   HG23  THR  47          HG23      THR  47 -12.638   7.528  -4.608
  350    H    TYR  48           HN       TYR  48 -17.025   8.996  -3.466
  351    HA   TYR  48           HA       TYR  48 -19.265   7.121  -3.652
  352    HB2  TYR  48           HB2      TYR  48 -19.731   8.225  -1.638
  353    HB3  TYR  48           HB1      TYR  48 -19.181   9.759  -2.232
  354    HD1  TYR  48           HD1      TYR  48 -20.852  11.350  -2.556
  355    HD2  TYR  48           HD2      TYR  48 -21.788   7.231  -3.111
  356    HE1  TYR  48           HE1      TYR  48 -23.172  11.954  -3.109
  357    HE2  TYR  48           HE2      TYR  48 -24.112   7.827  -3.646
  358    HH   TYR  48           HH       TYR  48 -25.656   9.494  -3.548
  359    H    ASP  49           HN       ASP  49 -20.415   7.263  -5.512
  360    HA   ASP  49           HA       ASP  49 -19.860   9.601  -7.268
  361    HB2  ASP  49           HB2      ASP  49 -19.000   7.426  -8.249
  362    HB3  ASP  49           HB1      ASP  49 -20.640   6.817  -8.241
  363    H    ASP  50           HN       ASP  50 -21.587  10.931  -7.020
  364    HA   ASP  50           HA       ASP  50 -24.083   9.981  -5.954
  365    HB2  ASP  50           HB2      ASP  50 -24.782  12.334  -6.058
  366    HB3  ASP  50           HB1      ASP  50 -23.075  12.351  -5.590
  367    H    ALA  51           HN       ALA  51 -22.887  10.393  -9.182
  368    HA   ALA  51           HA       ALA  51 -25.421  10.669 -10.448
  369    HB1  ALA  51           HB1      ALA  51 -24.239  10.237 -12.525
  370    HB2  ALA  51           HB2      ALA  51 -22.826   9.677 -11.632
  371    HB3  ALA  51           HB3      ALA  51 -23.323  11.366 -11.524
  372    H    THR  52           HN       THR  52 -23.437   7.918  -9.520
  373    HA   THR  52           HA       THR  52 -25.466   6.108 -10.636
  374    HB   THR  52           HB       THR  52 -23.707   4.335 -10.157
  375    HG1  THR  52           HG1      THR  52 -21.998   6.615  -9.919
  376   HG21  THR  52          HG21      THR  52 -22.368   4.909 -12.140
  377   HG22  THR  52          HG22      THR  52 -22.976   6.562 -12.075
  378   HG23  THR  52          HG23      THR  52 -24.079   5.230 -12.419
  379    H    LYS  53           HN       LYS  53 -24.800   7.558  -7.749
  380    HA   LYS  53           HA       LYS  53 -25.231   7.126  -5.524
  381    HB2  LYS  53           HB2      LYS  53 -27.364   5.446  -6.833
  382    HB3  LYS  53           HB1      LYS  53 -27.226   5.602  -5.103
  383    HG2  LYS  53           HG2      LYS  53 -27.561   7.927  -6.948
  384    HG3  LYS  53           HG1      LYS  53 -28.880   7.127  -6.098
  385    HD2  LYS  53           HD2      LYS  53 -27.772   7.597  -3.981
  386    HD3  LYS  53           HD1      LYS  53 -26.486   8.445  -4.831
  387    HE2  LYS  53           HE2      LYS  53 -28.125  10.069  -5.661
  388    HE3  LYS  53           HE1      LYS  53 -29.396   9.224  -4.781
  389    HZ1  LYS  53           HZ1      LYS  53 -28.388   9.764  -2.720
  390    HZ2  LYS  53           HZ2      LYS  53 -28.454  11.212  -3.620
  391    HZ3  LYS  53           HZ3      LYS  53 -26.995  10.366  -3.473
  392    H    THR  54           HN       THR  54 -23.055   5.928  -6.229
  393    HA   THR  54           HA       THR  54 -23.223   3.240  -5.069
  394    HB   THR  54           HB       THR  54 -21.263   4.059  -7.225
  395    HG1  THR  54           HG1      THR  54 -23.723   3.752  -7.671
  396   HG21  THR  54          HG21      THR  54 -21.998   1.347  -6.072
  397   HG22  THR  54          HG22      THR  54 -20.505   2.231  -5.746
  398   HG23  THR  54          HG23      THR  54 -20.837   1.635  -7.373
  399    H    TYR  55           HN       TYR  55 -21.965   2.916  -3.375
  400    HA   TYR  55           HA       TYR  55 -19.783   4.800  -2.819
  401    HB2  TYR  55           HB2      TYR  55 -21.586   3.270  -1.056
  402    HB3  TYR  55           HB1      TYR  55 -19.891   3.155  -0.613
  403    HD1  TYR  55           HD1      TYR  55 -22.790   4.870   0.054
  404    HD2  TYR  55           HD2      TYR  55 -18.683   5.607  -0.774
  405    HE1  TYR  55           HE1      TYR  55 -22.971   7.071   1.137
  406    HE2  TYR  55           HE2      TYR  55 -18.850   7.804   0.314
  407    HH   TYR  55           HH       TYR  55 -20.854   9.496   0.729
  408    H    THR  56           HN       THR  56 -17.721   4.133  -2.945
  409    HA   THR  56           HA       THR  56 -17.316   1.266  -3.493
  410    HB   THR  56           HB       THR  56 -15.669   3.563  -4.590
  411    HG1  THR  56           HG1      THR  56 -17.975   2.975  -5.393
  412   HG21  THR  56          HG21      THR  56 -14.389   1.477  -4.278
  413   HG22  THR  56          HG22      THR  56 -14.621   1.838  -5.989
  414   HG23  THR  56          HG23      THR  56 -15.601   0.600  -5.208
  415    H    VAL  57           HN       VAL  57 -16.121   0.208  -2.061
  416    HA   VAL  57           HA       VAL  57 -14.319   1.772  -0.332
  417    HB   VAL  57           HB       VAL  57 -16.061   0.630   1.032
  418   HG11  VAL  57          HG11      VAL  57 -14.930  -1.914  -0.116
  419   HG12  VAL  57          HG12      VAL  57 -16.592  -1.333  -0.237
  420   HG13  VAL  57          HG13      VAL  57 -15.947  -1.840   1.316
  421   HG21  VAL  57          HG21      VAL  57 -13.857   1.060   1.959
  422   HG22  VAL  57          HG22      VAL  57 -13.304  -0.516   1.392
  423   HG23  VAL  57          HG23      VAL  57 -14.558  -0.415   2.626
  424    H    THR  58           HN       THR  58 -12.323   1.630  -0.961
  425    HA   THR  58           HA       THR  58 -11.482  -0.757  -2.455
  426    HB   THR  58           HB       THR  58 -10.154   1.959  -2.457
  427    HG1  THR  58           HG1      THR  58 -12.503   1.297  -3.487
  428   HG21  THR  58          HG21      THR  58  -8.785   0.019  -3.188
  429   HG22  THR  58          HG22      THR  58  -9.084   1.174  -4.487
  430   HG23  THR  58          HG23      THR  58  -9.993  -0.338  -4.420
  431    H    GLU  59           HN       GLU  59 -10.058  -2.063  -1.551
  432    HA   GLU  59           HA       GLU  59  -8.859  -1.398   0.984
  433    HB2  GLU  59           HB2      GLU  59  -9.730  -3.706   0.175
  434    HB3  GLU  59           HB1      GLU  59  -8.215  -3.818  -0.702
  435    HG2  GLU  59           HG2      GLU  59  -8.597  -3.676   2.277
  436    HG3  GLU  59           HG1      GLU  59  -8.104  -5.068   1.334
  437    H    GLY  60           HN       GLY  60  -6.666  -0.780   1.280
  438    HA2  GLY  60           HA2      GLY  60  -4.892  -0.982  -1.032
  439    HA3  GLY  60           HA1      GLY  60  -5.198   0.638  -0.408
  440    H    SER  61           HN       SER  61  -3.377  -2.168  -0.113
  441    HA   SER  61           HA       SER  61  -2.175  -1.133   2.355
  442    HB2  SER  61           HB2      SER  61  -1.592  -3.678   2.691
  443    HB3  SER  61           HB1      SER  61  -3.195  -3.086   3.135
  444    HG   SER  61           HG       SER  61  -4.052  -3.985   1.317
  445    H    GLY  62           HN       GLY  62  -0.118  -0.577   2.128
  446    HA2  GLY  62           HA2      GLY  62   1.273  -1.108  -0.336
  447    HA3  GLY  62           HA1      GLY  62   1.880  -0.190   1.033
  448    H    GLY  63           HN       GLY  63   0.754  -3.551   0.941
  449    HA2  GLY  63           HA2      GLY  63   3.273  -4.370   2.177
  450    HA3  GLY  63           HA1      GLY  63   1.830  -5.365   1.998
  451    H    ALA  64           HN       ALA  64   1.614  -4.505  -0.833
  452    HA   ALA  64           HA       ALA  64   2.185  -5.160  -2.916
  453    HB1  ALA  64           HB1      ALA  64   4.320  -4.068  -2.496
  454    HB2  ALA  64           HB2      ALA  64   4.536  -5.510  -3.485
  455    HB3  ALA  64           HB3      ALA  64   4.950  -5.546  -1.771
  456    H    GLY  65           HN       GLY  65   4.296  -7.329  -1.032
  457    HA2  GLY  65           HA2      GLY  65   2.612  -9.571  -1.150
  458    HA3  GLY  65           HA1      GLY  65   3.674  -9.613  -2.550
  459    H    GLY  66           HN       GLY  66   3.746 -11.614  -0.695
  460    HA2  GLY  66           HA2      GLY  66   6.260 -11.091   0.771
  461    HA3  GLY  66           HA1      GLY  66   5.032 -12.225   1.322
  462    H    GLN  67           HN       GLN  67   5.722 -11.988  -2.036
  463    HA   GLN  67           HA       GLN  67   6.650 -14.735  -2.041
  464    HB2  GLN  67           HB2      GLN  67   4.913 -13.993  -3.639
  465    HB3  GLN  67           HB1      GLN  67   6.072 -12.838  -4.347
  466    HG2  GLN  67           HG2      GLN  67   5.812 -14.877  -5.687
  467    HG3  GLN  67           HG1      GLN  67   7.462 -14.657  -5.106
  468   HE21  GLN  67          HE21      GLN  67   4.531 -16.535  -4.796
  469   HE22  GLN  67          HE22      GLN  67   5.252 -17.854  -3.937
  470    H    GLY  68           HN       GLY  68   8.686 -15.392  -2.496
  471    HA2  GLY  68           HA2      GLY  68  10.734 -13.295  -2.707
  472    HA3  GLY  68           HA1      GLY  68  11.010 -14.955  -2.197
  473    H    MET  69           HN       MET  69  12.683 -15.316  -3.710
  474    HA   MET  69           HA       MET  69  11.706 -16.011  -6.337
  475    HB2  MET  69           HB2      MET  69  13.368 -14.735  -7.575
  476    HB3  MET  69           HB1      MET  69  12.342 -13.651  -6.650
  477    HG2  MET  69           HG2      MET  69  14.071 -13.379  -4.985
  478    HG3  MET  69           HG1      MET  69  15.095 -14.543  -5.821
  479    HE1  MET  69           HE1      MET  69  13.358 -11.055  -5.989
  480    HE2  MET  69           HE2      MET  69  12.824 -11.765  -7.511
  481    HE3  MET  69           HE3      MET  69  13.949 -10.406  -7.519
  482    H    ILE  70           HN       ILE  70  13.082 -17.435  -7.453
  483    HA   ILE  70           HA       ILE  70  15.262 -18.564  -5.814
  484    HB   ILE  70           HB       ILE  70  13.726 -20.126  -7.929
  485   HG12  ILE  70          HG12      ILE  70  13.134 -20.067  -4.952
  486   HG13  ILE  70          HG11      ILE  70  12.142 -19.315  -6.198
  487   HG21  ILE  70          HG21      ILE  70  15.948 -21.001  -7.150
  488   HG22  ILE  70          HG22      ILE  70  14.599 -22.098  -6.852
  489   HG23  ILE  70          HG23      ILE  70  15.266 -21.152  -5.524
  490   HD11  ILE  70          HD11      ILE  70  12.685 -22.261  -5.896
  491   HD12  ILE  70          HD12      ILE  70  11.729 -21.524  -7.183
  492   HD13  ILE  70          HD13      ILE  70  11.183 -21.422  -5.509
  493    H    GLN  71           HN       GLN  71  15.282 -16.375  -7.711
  494    HA   GLN  71           HA       GLN  71  16.537 -17.408 -10.128
  495    HB2  GLN  71           HB2      GLN  71  15.865 -14.570  -9.323
  496    HB3  GLN  71           HB1      GLN  71  16.475 -15.073 -10.896
  497    HG2  GLN  71           HG2      GLN  71  14.446 -16.460 -11.186
  498    HG3  GLN  71           HG1      GLN  71  13.829 -15.811  -9.666
  499   HE21  GLN  71          HE21      GLN  71  13.168 -13.670  -9.568
  500   HE22  GLN  71          HE22      GLN  71  12.861 -12.736 -10.987
  501    H    GLU  72           HN       GLU  72  17.832 -17.444  -7.381
  502    HA   GLU  72           HA       GLU  72  19.976 -15.546  -7.545
  503    HB2  GLU  72           HB2      GLU  72  19.712 -18.029  -5.834
  504    HB3  GLU  72           HB1      GLU  72  20.967 -16.809  -5.666
  505    HG2  GLU  72           HG2      GLU  72  19.017 -15.159  -5.348
  506    HG3  GLU  72           HG1      GLU  72  18.048 -16.600  -5.055
  507    HA   PRO  73           HA       PRO  73  22.356 -17.959 -10.399
  508    HB2  PRO  73           HB2      PRO  73  24.621 -16.453 -10.381
  509    HB3  PRO  73           HB1      PRO  73  23.104 -15.928 -11.212
  510    HG2  PRO  73           HG2      PRO  73  24.213 -15.089  -8.546
  511    HG3  PRO  73           HG1      PRO  73  23.394 -14.117  -9.782
  512    HD2  PRO  73           HD2      PRO  73  22.191 -15.070  -7.503
  513    HD3  PRO  73           HD1      PRO  73  21.316 -14.677  -9.022
  514    H    ALA  74           HN       ALA  74  24.696 -18.730 -10.545
  515    HA   ALA  74           HA       ALA  74  26.448 -19.936  -9.784
  516    HB1  ALA  74           HB1      ALA  74  27.302 -19.526  -7.502
  517    HB2  ALA  74           HB2      ALA  74  25.906 -18.486  -7.209
  518    HB3  ALA  74           HB3      ALA  74  27.084 -18.056  -8.449
  519    H    LEU  75           HN       LEU  75  26.928 -21.285  -7.503
  520    HA   LEU  75           HA       LEU  75  25.237 -23.509  -7.693
  521    HB2  LEU  75           HB2      LEU  75  27.188 -22.762  -5.533
  522    HB3  LEU  75           HB1      LEU  75  26.399 -24.313  -5.638
  523    HG   LEU  75           HG       LEU  75  28.581 -24.604  -6.489
  524   HD11  LEU  75          HD11      LEU  75  26.692 -24.332  -8.816
  525   HD12  LEU  75          HD12      LEU  75  26.866 -25.740  -7.770
  526   HD13  LEU  75          HD13      LEU  75  28.198 -25.249  -8.815
  527   HD21  LEU  75          HD21      LEU  75  29.514 -23.270  -8.330
  528   HD22  LEU  75          HD22      LEU  75  29.198 -22.296  -6.892
  529   HD23  LEU  75          HD23      LEU  75  28.097 -22.222  -8.270
  530    HA   PRO  76           HA       PRO  76  21.911 -21.927  -5.085
  531    HB2  PRO  76           HB2      PRO  76  20.964 -24.743  -5.352
  532    HB3  PRO  76           HB1      PRO  76  20.087 -23.254  -5.724
  533    HG2  PRO  76           HG2      PRO  76  20.962 -24.807  -7.696
  534    HG3  PRO  76           HG1      PRO  76  21.121 -23.012  -7.808
  535    HD2  PRO  76           HD2      PRO  76  23.256 -25.047  -7.048
  536    HD3  PRO  76           HD1      PRO  76  23.359 -23.666  -8.167
  537    HA   PRO  77           HA       PRO  77  23.043 -23.197  -0.981
  538    HB2  PRO  77           HB2      PRO  77  20.051 -23.484  -0.708
  539    HB3  PRO  77           HB1      PRO  77  21.201 -22.767   0.433
  540    HG2  PRO  77           HG2      PRO  77  19.826 -21.144  -1.073
  541    HG3  PRO  77           HG1      PRO  77  21.583 -20.909  -0.948
  542    HD2  PRO  77           HD2      PRO  77  20.012 -22.145  -3.212
  543    HD3  PRO  77           HD1      PRO  77  21.417 -21.019  -3.267
  544    H    GLY  78           HN       GLY  78  23.773 -25.124  -0.393
  545    HA2  GLY  78           HA2      GLY  78  23.523 -27.408   0.187
  546    HA3  GLY  78           HA1      GLY  78  22.113 -27.497  -0.852
  547    H    TRP  79           HN       TRP  79  23.682 -26.144  -3.093
  548    HA   TRP  79           HA       TRP  79  24.968 -28.615  -4.036
  549    HB2  TRP  79           HB2      TRP  79  24.197 -26.047  -5.448
  550    HB3  TRP  79           HB1      TRP  79  25.098 -27.346  -6.226
  551    HD1  TRP  79           HD1      TRP  79  21.633 -26.661  -4.672
  552    HE1  TRP  79           HE1      TRP  79  19.951 -28.308  -5.690
  553    HE3  TRP  79           HE3      TRP  79  24.863 -29.520  -7.443
  554    HZ2  TRP  79           HZ2      TRP  79  19.972 -30.512  -7.448
  555    HZ3  TRP  79           HZ3      TRP  79  23.937 -31.380  -8.767
  556    HH2  TRP  79           HH2      TRP  79  21.541 -31.866  -8.769
  557    H    GLU  80           HN       GLU  80  27.178 -28.832  -4.225
  558    HA   GLU  80           HA       GLU  80  28.772 -26.369  -4.000
  559    HB2  GLU  80           HB2      GLU  80  29.383 -29.086  -2.797
  560    HB3  GLU  80           HB1      GLU  80  30.502 -27.732  -2.801
  561    HG2  GLU  80           HG2      GLU  80  28.802 -26.435  -1.520
  562    HG3  GLU  80           HG1      GLU  80  27.856 -27.917  -1.392
  563    H    MET  81           HN       MET  81  30.603 -26.250  -5.279
  564    HA   MET  81           HA       MET  81  30.812 -28.320  -7.351
  565    HB2  MET  81           HB2      MET  81  29.847 -26.109  -8.110
  566    HB3  MET  81           HB1      MET  81  31.411 -25.368  -7.709
  567    HG2  MET  81           HG2      MET  81  31.166 -27.657  -9.647
  568    HG3  MET  81           HG1      MET  81  30.964 -25.981 -10.143
  569    HE1  MET  81           HE1      MET  81  34.493 -24.492  -9.207
  570    HE2  MET  81           HE2      MET  81  33.114 -24.607  -8.116
  571    HE3  MET  81           HE3      MET  81  32.872 -24.121  -9.793
  572    H    LYS  82           HN       LYS  82  32.847 -29.196  -7.667
  573    HA   LYS  82           HA       LYS  82  35.147 -27.834  -6.552
  574    HB2  LYS  82           HB2      LYS  82  34.478 -30.626  -5.565
  575    HB3  LYS  82           HB1      LYS  82  35.893 -29.690  -5.138
  576    HG2  LYS  82           HG2      LYS  82  34.445 -28.052  -4.003
  577    HG3  LYS  82           HG1      LYS  82  33.037 -29.087  -4.388
  578    HD2  LYS  82           HD2      LYS  82  34.194 -30.939  -3.165
  579    HD3  LYS  82           HD1      LYS  82  35.423 -29.777  -2.661
  580    HE2  LYS  82           HE2      LYS  82  33.629 -28.418  -1.613
  581    HE3  LYS  82           HE1      LYS  82  32.475 -29.680  -2.032
  582    HZ1  LYS  82           HZ1      LYS  82  33.119 -30.012   0.205
  583    HZ2  LYS  82           HZ2      LYS  82  34.763 -29.879  -0.159
  584    HZ3  LYS  82           HZ3      LYS  82  33.891 -31.229  -0.695
  585    H    TYR  83           HN       TYR  83  37.175 -28.838  -7.260
  586    HA   TYR  83           HA       TYR  83  36.792 -30.408  -9.736
  587    HB2  TYR  83           HB2      TYR  83  39.083 -28.559  -8.921
  588    HB3  TYR  83           HB1      TYR  83  39.023 -29.481 -10.446
  589    HD1  TYR  83           HD1      TYR  83  37.735 -26.585  -8.601
  590    HD2  TYR  83           HD2      TYR  83  37.493 -28.795 -12.226
  591    HE1  TYR  83           HE1      TYR  83  36.536 -24.716  -9.664
  592    HE2  TYR  83           HE2      TYR  83  36.303 -26.933 -13.296
  593    HH   TYR  83           HH       TYR  83  34.836 -25.004 -12.504
  594    H    THR  84           HN       THR  84  38.223 -32.160 -10.153
  595    HA   THR  84           HA       THR  84  39.210 -33.481  -7.783
  596    HB   THR  84           HB       THR  84  39.674 -35.375  -9.201
  597    HG1  THR  84           HG1      THR  84  39.648 -35.193 -11.473
  598   HG21  THR  84          HG21      THR  84  37.177 -34.008 -10.196
  599   HG22  THR  84          HG22      THR  84  37.303 -35.038  -8.770
  600   HG23  THR  84          HG23      THR  84  37.553 -35.721 -10.375
  601    H    SER  85           HN       SER  85  41.535 -34.738  -8.607
  602    HA   SER  85           HA       SER  85  43.425 -32.550  -8.430
  603    HB2  SER  85           HB2      SER  85  45.085 -34.459  -8.184
  604    HB3  SER  85           HB1      SER  85  43.836 -34.353  -6.942
  605    HG   SER  85           HG       SER  85  43.025 -36.195  -7.583
  606    H    GLU  86           HN       GLU  86  41.898 -33.645 -10.949
  607    HA   GLU  86           HA       GLU  86  44.261 -33.632 -12.744
  608    HB2  GLU  86           HB2      GLU  86  43.127 -35.859 -12.587
  609    HB3  GLU  86           HB1      GLU  86  41.626 -35.107 -13.104
  610    HG2  GLU  86           HG2      GLU  86  42.419 -34.752 -15.273
  611    HG3  GLU  86           HG1      GLU  86  44.098 -35.030 -14.801
  612    H    GLY  87           HN       GLY  87  41.806 -31.827 -11.642
  613    HA2  GLY  87           HA2      GLY  87  41.011 -29.808 -12.475
  614    HA3  GLY  87           HA1      GLY  87  41.696 -30.221 -14.042
  615    H    VAL  88           HN       VAL  88  39.847 -32.750 -12.803
  616    HA   VAL  88           HA       VAL  88  37.769 -32.298 -14.758
  617    HB   VAL  88           HB       VAL  88  38.173 -34.531 -12.756
  618   HG11  VAL  88          HG11      VAL  88  36.179 -34.341 -15.016
  619   HG12  VAL  88          HG12      VAL  88  35.801 -34.277 -13.295
  620   HG13  VAL  88          HG13      VAL  88  36.459 -35.754 -13.997
  621   HG21  VAL  88          HG21      VAL  88  38.805 -35.828 -14.758
  622   HG22  VAL  88          HG22      VAL  88  39.884 -34.467 -14.457
  623   HG23  VAL  88          HG23      VAL  88  38.666 -34.360 -15.727
  624    H    ARG  89           HN       ARG  89  35.637 -31.888 -14.331
  625    HA   ARG  89           HA       ARG  89  35.140 -30.474 -11.823
  626    HB2  ARG  89           HB2      ARG  89  34.758 -29.562 -14.203
  627    HB3  ARG  89           HB1      ARG  89  33.355 -30.611 -14.237
  628    HG2  ARG  89           HG2      ARG  89  32.554 -29.441 -12.167
  629    HG3  ARG  89           HG1      ARG  89  33.858 -28.275 -12.427
  630    HD2  ARG  89           HD2      ARG  89  32.832 -28.264 -14.875
  631    HD3  ARG  89           HD1      ARG  89  31.382 -28.745 -13.997
  632    HE   ARG  89           HE       ARG  89  32.549 -26.519 -12.742
  633   HH11  ARG  89          HH11      ARG  89  30.783 -27.439 -15.623
  634   HH12  ARG  89          HH12      ARG  89  30.146 -25.837 -15.880
  635   HH21  ARG  89          HH21      ARG  89  31.721 -24.413 -13.085
  636   HH22  ARG  89          HH22      ARG  89  30.708 -24.108 -14.473
  637    H    TYR  90           HN       TYR  90  33.794 -31.275 -10.277
  638    HA   TYR  90           HA       TYR  90  31.666 -33.087 -11.112
  639    HB2  TYR  90           HB2      TYR  90  32.134 -34.750  -9.441
  640    HB3  TYR  90           HB1      TYR  90  33.604 -34.487 -10.357
  641    HD1  TYR  90           HD1      TYR  90  35.462 -33.145  -9.317
  642    HD2  TYR  90           HD2      TYR  90  32.082 -34.450  -7.086
  643    HE1  TYR  90           HE1      TYR  90  36.685 -32.722  -7.228
  644    HE2  TYR  90           HE2      TYR  90  33.300 -34.036  -4.989
  645    HH   TYR  90           HH       TYR  90  36.186 -32.260  -4.870
  646    H    PHE  91           HN       PHE  91  29.946 -33.285  -9.339
  647    HA   PHE  91           HA       PHE  91  29.901 -30.766  -7.821
  648    HB2  PHE  91           HB2      PHE  91  27.715 -32.127  -9.359
  649    HB3  PHE  91           HB1      PHE  91  27.327 -31.075  -8.011
  650    HD1  PHE  91           HD1      PHE  91  26.904 -28.825  -8.493
  651    HD2  PHE  91           HD2      PHE  91  29.428 -31.081 -11.076
  652    HE1  PHE  91           HE1      PHE  91  27.088 -26.897  -9.999
  653    HE2  PHE  91           HE2      PHE  91  29.603 -29.150 -12.589
  654    HZ   PHE  91           HZ       PHE  91  28.346 -26.993 -11.970
  655    H    VAL  92           HN       VAL  92  28.710 -30.758  -5.839
  656    HA   VAL  92           HA       VAL  92  28.531 -33.423  -4.590
  657    HB   VAL  92           HB       VAL  92  29.606 -30.917  -3.274
  658   HG11  VAL  92          HG11      VAL  92  28.459 -32.331  -1.679
  659   HG12  VAL  92          HG12      VAL  92  30.200 -32.422  -1.411
  660   HG13  VAL  92          HG13      VAL  92  29.361 -33.739  -2.231
  661   HG21  VAL  92          HG21      VAL  92  31.173 -31.823  -4.918
  662   HG22  VAL  92          HG22      VAL  92  31.085 -33.403  -4.137
  663   HG23  VAL  92          HG23      VAL  92  31.774 -32.026  -3.275
  664    H    ASP  93           HN       ASP  93  26.559 -33.816  -3.772
  665    HA   ASP  93           HA       ASP  93  24.688 -31.588  -3.338
  666    HB2  ASP  93           HB2      ASP  93  24.418 -34.559  -3.592
  667    HB3  ASP  93           HB1      ASP  93  23.336 -33.788  -2.438
  668    H    HIS  94           HN       HIS  94  25.305 -30.515  -1.447
  669    HA   HIS  94           HA       HIS  94  26.430 -31.858   0.807
  670    HB2  HIS  94           HB2      HIS  94  26.918 -29.483   0.078
  671    HB3  HIS  94           HB1      HIS  94  25.324 -29.033   0.667
  672    HD1  HIS  94           HD1      HIS  94  28.749 -29.167   1.669
  673    HD2  HIS  94           HD2      HIS  94  25.072 -29.626   3.550
  674    HE1  HIS  94           HE1      HIS  94  29.195 -28.811   4.130
  675    HE2  HIS  94           HE2      HIS  94  26.914 -28.847   5.209
  676    H    ASN  95           HN       ASN  95  23.266 -31.386  -0.283
  677    HA   ASN  95           HA       ASN  95  21.986 -31.141   2.284
  678    HB2  ASN  95           HB2      ASN  95  19.868 -31.407   0.989
  679    HB3  ASN  95           HB1      ASN  95  20.904 -30.146   0.329
  680   HD21  ASN  95          HD21      ASN  95  21.953 -30.498  -1.631
  681   HD22  ASN  95          HD22      ASN  95  21.459 -31.741  -2.739
  682    H    THR  96           HN       THR  96  22.535 -33.765  -0.048
  683    HA   THR  96           HA       THR  96  21.451 -35.654   1.902
  684    HB   THR  96           HB       THR  96  21.739 -37.295  -0.056
  685    HG1  THR  96           HG1      THR  96  22.796 -36.417  -1.672
  686   HG21  THR  96          HG21      THR  96  19.817 -34.985  -0.367
  687   HG22  THR  96          HG22      THR  96  19.568 -36.392   0.666
  688   HG23  THR  96          HG23      THR  96  19.647 -36.587  -1.084
  689    H    ARG  97           HN       ARG  97  24.355 -34.387   0.858
  690    HA   ARG  97           HA       ARG  97  26.547 -34.856   1.238
  691    HB2  ARG  97           HB2      ARG  97  25.367 -36.792   3.220
  692    HB3  ARG  97           HB1      ARG  97  27.090 -36.451   3.080
  693    HG2  ARG  97           HG2      ARG  97  26.441 -34.015   3.340
  694    HG3  ARG  97           HG1      ARG  97  24.883 -34.615   3.908
  695    HD2  ARG  97           HD2      ARG  97  25.941 -35.808   5.702
  696    HD3  ARG  97           HD1      ARG  97  27.541 -35.395   5.092
  697    HE   ARG  97           HE       ARG  97  25.670 -33.297   5.986
  698   HH11  ARG  97          HH11      ARG  97  28.786 -34.908   6.123
  699   HH12  ARG  97          HH12      ARG  97  29.493 -33.731   7.198
  700   HH21  ARG  97          HH21      ARG  97  26.571 -31.756   7.409
  701   HH22  ARG  97          HH22      ARG  97  28.209 -31.941   7.958
  702    H    THR  98           HN       THR  98  25.872 -35.674  -0.966
  703    HA   THR  98           HA       THR  98  27.111 -38.312  -1.342
  704    HB   THR  98           HB       THR  98  25.365 -38.712  -3.208
  705    HG1  THR  98           HG1      THR  98  24.262 -36.839  -3.358
  706   HG21  THR  98          HG21      THR  98  23.721 -39.686  -1.629
  707   HG22  THR  98          HG22      THR  98  24.453 -38.768  -0.313
  708   HG23  THR  98          HG23      THR  98  25.378 -40.032  -1.123
  709    H    THR  99           HN       THR  99  27.974 -38.587  -3.573
  710    HA   THR  99           HA       THR  99  28.682 -35.975  -4.742
  711    HB   THR  99           HB       THR  99  30.285 -37.546  -6.128
  712    HG1  THR  99           HG1      THR  99  29.815 -39.213  -3.856
  713   HG21  THR  99          HG21      THR  99  31.963 -37.543  -4.251
  714   HG22  THR  99          HG22      THR  99  30.674 -37.085  -3.140
  715   HG23  THR  99          HG23      THR  99  31.157 -35.979  -4.428
  716    H    THR 100           HN       THR 100  28.353 -35.550  -6.988
  717    HA   THR 100           HA       THR 100  26.964 -37.562  -8.555
  718    HB   THR 100           HB       THR 100  25.134 -36.322  -7.462
  719    HG1  THR 100           HG1      THR 100  24.023 -36.317  -9.283
  720   HG21  THR 100          HG21      THR 100  26.234 -34.167  -7.112
  721   HG22  THR 100          HG22      THR 100  24.727 -33.961  -8.009
  722   HG23  THR 100          HG23      THR 100  26.272 -33.898  -8.855
  723    H    PHE 101           HN       PHE 101  26.963 -37.027 -10.861
  724    HA   PHE 101           HA       PHE 101  29.109 -35.101 -11.487
  725    HB2  PHE 101           HB2      PHE 101  29.509 -37.768 -11.579
  726    HB3  PHE 101           HB1      PHE 101  28.816 -37.503 -13.234
  727    HD1  PHE 101           HD1      PHE 101  29.895 -35.273 -14.348
  728    HD2  PHE 101           HD2      PHE 101  31.774 -37.794 -11.481
  729    HE1  PHE 101           HE1      PHE 101  32.096 -34.524 -15.128
  730    HE2  PHE 101           HE2      PHE 101  33.984 -37.046 -12.263
  731    HZ   PHE 101           HZ       PHE 101  34.142 -35.412 -14.097
  732    H    LYS 102           HN       LYS 102  27.851 -33.477 -12.298
  733    HA   LYS 102           HA       LYS 102  26.458 -34.069 -14.785
  734    HB2  LYS 102           HB2      LYS 102  24.574 -32.573 -14.061
  735    HB3  LYS 102           HB1      LYS 102  24.651 -34.121 -13.240
  736    HG2  LYS 102           HG2      LYS 102  25.626 -33.083 -11.288
  737    HG3  LYS 102           HG1      LYS 102  25.681 -31.525 -12.117
  738    HD2  LYS 102           HD2      LYS 102  23.232 -33.083 -11.301
  739    HD3  LYS 102           HD1      LYS 102  23.774 -31.527 -10.668
  740    HE2  LYS 102           HE2      LYS 102  23.461 -30.534 -12.893
  741    HE3  LYS 102           HE1      LYS 102  22.866 -32.087 -13.482
  742    HZ1  LYS 102           HZ1      LYS 102  21.091 -31.919 -11.774
  743    HZ2  LYS 102           HZ2      LYS 102  21.012 -30.723 -12.972
  744    HZ3  LYS 102           HZ3      LYS 102  21.617 -30.342 -11.437
  745    H    ASP 103           HN       ASP 103  27.453 -32.831 -16.258
  746    HA   ASP 103           HA       ASP 103  27.984 -30.027 -15.525
  747    HB2  ASP 103           HB2      ASP 103  30.099 -31.318 -15.881
  748    HB3  ASP 103           HB1      ASP 103  29.576 -31.644 -17.531
  749    HA   PRO 104           HA       PRO 104  25.110 -29.370 -18.818
  750    HB2  PRO 104           HB2      PRO 104  24.903 -26.710 -18.635
  751    HB3  PRO 104           HB1      PRO 104  24.357 -27.748 -17.313
  752    HG2  PRO 104           HG2      PRO 104  26.894 -26.189 -17.568
  753    HG3  PRO 104           HG1      PRO 104  25.838 -26.386 -16.158
  754    HD2  PRO 104           HD2      PRO 104  28.158 -27.826 -16.596
  755    HD3  PRO 104           HD1      PRO 104  26.818 -28.360 -15.557
  756    H    ARG 105           HN       ARG 105  28.232 -29.169 -19.375
  757    HA   ARG 105           HA       ARG 105  28.024 -27.355 -21.673
  758    HB2  ARG 105           HB2      ARG 105  30.347 -28.399 -20.110
  759    HB3  ARG 105           HB1      ARG 105  30.600 -27.928 -21.783
  760    HG2  ARG 105           HG2      ARG 105  31.148 -26.139 -20.174
  761    HG3  ARG 105           HG1      ARG 105  29.881 -25.677 -21.315
  762    HD2  ARG 105           HD2      ARG 105  28.185 -26.165 -19.604
  763    HD3  ARG 105           HD1      ARG 105  29.464 -26.598 -18.470
  764    HE   ARG 105           HE       ARG 105  30.233 -24.192 -18.832
  765   HH11  ARG 105          HH11      ARG 105  26.883 -25.171 -19.108
  766   HH12  ARG 105          HH12      ARG 105  26.251 -23.649 -18.572
  767   HH21  ARG 105          HH21      ARG 105  29.397 -22.162 -18.124
  768   HH22  ARG 105          HH22      ARG 105  27.671 -21.953 -17.962
  769    HA   PRO 106           HA       PRO 106  27.568 -30.737 -24.468
  770    HB2  PRO 106           HB2      PRO 106  28.560 -29.636 -26.768
  771    HB3  PRO 106           HB1      PRO 106  26.963 -29.172 -26.069
  772    HG2  PRO 106           HG2      PRO 106  29.629 -27.794 -25.844
  773    HG3  PRO 106           HG1      PRO 106  28.029 -27.101 -26.159
  774    HD2  PRO 106           HD2      PRO 106  29.179 -27.029 -23.724
  775    HD3  PRO 106           HD1      PRO 106  27.403 -27.177 -23.946
  776    H    GLY 107           HN       GLY 107  28.703 -32.527 -24.971
  777    HA2  GLY 107           HA2      GLY 107  30.562 -33.651 -25.922
  778    HA3  GLY 107           HA1      GLY 107  31.580 -32.242 -25.554
  779    H    PHE 108           HN       PHE 108  30.505 -32.199 -22.691
  780    HA   PHE 108           HA       PHE 108  32.312 -34.333 -21.803
  781    HB2  PHE 108           HB2      PHE 108  33.041 -32.028 -21.242
  782    HB3  PHE 108           HB1      PHE 108  31.529 -31.805 -20.294
  783    HD1  PHE 108           HD1      PHE 108  34.825 -33.419 -20.437
  784    HD2  PHE 108           HD2      PHE 108  31.256 -32.919 -18.181
  785    HE1  PHE 108           HE1      PHE 108  35.939 -34.375 -18.462
  786    HE2  PHE 108           HE2      PHE 108  32.365 -33.873 -16.204
  787    HZ   PHE 108           HZ       PHE 108  34.782 -34.575 -16.372
  788    H    GLU 109           HN       GLU 109  30.577 -35.879 -21.968
  789    HA   GLU 109           HA       GLU 109  29.080 -36.062 -19.492
  790    HB2  GLU 109           HB2      GLU 109  27.554 -34.868 -21.070
  791    HB3  GLU 109           HB1      GLU 109  27.689 -36.215 -22.187
  792    HG2  GLU 109           HG2      GLU 109  25.620 -36.402 -21.018
  793    HG3  GLU 109           HG1      GLU 109  26.689 -37.688 -20.462
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1 -38.885  10.548  -4.873
    2    H2   GLY   1           HT2      GLY   1 -37.449  10.755  -4.007
    3    H3   GLY   1           HT3      GLY   1 -38.507  12.061  -4.197
    4    HA2  GLY   1           HA1      GLY   1 -38.735  11.205  -1.985
    5    HA3  GLY   1           HA2      GLY   1 -40.192  10.843  -2.906
    6    H    SER   2           HN       SER   2 -40.251   9.251  -1.017
    7    HA   SER   2           HA       SER   2 -40.198   7.118  -0.258
    8    HB2  SER   2           HB2      SER   2 -39.422   6.503  -3.124
    9    HB3  SER   2           HB1      SER   2 -39.987   5.320  -1.946
   10    HG   SER   2           HG       SER   2 -41.847   7.037  -1.835
   11    H    HIS   3           HN       HIS   3 -38.481   4.942  -1.019
   12    HA   HIS   3           HA       HIS   3 -36.056   5.799   0.358
   13    HB2  HIS   3           HB2      HIS   3 -36.997   3.057  -0.545
   14    HB3  HIS   3           HB1      HIS   3 -35.497   3.350   0.325
   15    HD1  HIS   3           HD1      HIS   3 -35.812   2.525   2.638
   16    HD2  HIS   3           HD2      HIS   3 -39.213   4.475   1.222
   17    HE1  HIS   3           HE1      HIS   3 -37.444   2.533   4.549
   18    HE2  HIS   3           HE2      HIS   3 -39.568   3.483   3.591
   19    H    MET   4           HN       MET   4 -33.904   5.420  -0.583
   20    HA   MET   4           HA       MET   4 -33.984   5.403  -3.530
   21    HB2  MET   4           HB2      MET   4 -31.951   6.766  -1.744
   22    HB3  MET   4           HB1      MET   4 -31.930   6.764  -3.493
   23    HG2  MET   4           HG2      MET   4 -34.077   7.972  -3.502
   24    HG3  MET   4           HG1      MET   4 -34.015   8.026  -1.742
   25    HE1  MET   4           HE1      MET   4 -30.982   8.377  -4.223
   26    HE2  MET   4           HE2      MET   4 -30.936  10.121  -4.474
   27    HE3  MET   4           HE3      MET   4 -32.299   9.173  -5.074
   28    H    GLN   5           HN       GLN   5 -32.681   3.982  -4.608
   29    HA   GLN   5           HA       GLN   5 -31.497   1.875  -3.073
   30    HB2  GLN   5           HB2      GLN   5 -32.677   1.418  -5.174
   31    HB3  GLN   5           HB1      GLN   5 -31.473   2.346  -6.054
   32    HG2  GLN   5           HG2      GLN   5 -29.750   0.739  -5.209
   33    HG3  GLN   5           HG1      GLN   5 -31.075  -0.243  -4.592
   34   HE21  GLN   5          HE21      GLN   5 -32.424  -1.322  -6.029
   35   HE22  GLN   5          HE22      GLN   5 -31.983  -1.554  -7.707
   36    H    TYR   6           HN       TYR   6 -29.445   1.713  -2.429
   37    HA   TYR   6           HA       TYR   6 -27.424   3.349  -3.835
   38    HB2  TYR   6           HB2      TYR   6 -27.682   2.741  -0.858
   39    HB3  TYR   6           HB1      TYR   6 -26.152   3.266  -1.551
   40    HD1  TYR   6           HD1      TYR   6 -25.801   5.559  -2.128
   41    HD2  TYR   6           HD2      TYR   6 -29.660   4.270  -0.880
   42    HE1  TYR   6           HE1      TYR   6 -26.496   7.901  -1.872
   43    HE2  TYR   6           HE2      TYR   6 -30.361   6.611  -0.626
   44    HH   TYR   6           HH       TYR   6 -28.473   9.246  -1.782
   45    H    LYS   7           HN       LYS   7 -25.394   2.323  -4.127
   46    HA   LYS   7           HA       LYS   7 -25.471  -0.572  -3.737
   47    HB2  LYS   7           HB2      LYS   7 -24.240  -0.746  -5.979
   48    HB3  LYS   7           HB1      LYS   7 -25.970  -0.357  -6.049
   49    HG2  LYS   7           HG2      LYS   7 -23.835   1.757  -6.166
   50    HG3  LYS   7           HG1      LYS   7 -24.420   0.908  -7.598
   51    HD2  LYS   7           HD2      LYS   7 -26.216   2.383  -5.682
   52    HD3  LYS   7           HD1      LYS   7 -25.512   3.123  -7.116
   53    HE2  LYS   7           HE2      LYS   7 -27.214   0.642  -7.197
   54    HE3  LYS   7           HE1      LYS   7 -27.866   2.274  -7.356
   55    HZ1  LYS   7           HZ1      LYS   7 -27.536   1.469  -9.527
   56    HZ2  LYS   7           HZ2      LYS   7 -25.983   0.884  -9.180
   57    HZ3  LYS   7           HZ3      LYS   7 -26.265   2.552  -9.252
   58    H    LEU   8           HN       LEU   8 -23.473  -1.654  -3.605
   59    HA   LEU   8           HA       LEU   8 -21.204   0.113  -2.937
   60    HB2  LEU   8           HB2      LEU   8 -22.395  -0.796  -0.873
   61    HB3  LEU   8           HB1      LEU   8 -21.893  -2.385  -1.399
   62    HG   LEU   8           HG       LEU   8 -19.505  -1.563  -1.263
   63   HD11  LEU   8          HD11      LEU   8 -19.228   0.338   0.409
   64   HD12  LEU   8          HD12      LEU   8 -20.894   0.775   0.021
   65   HD13  LEU   8          HD13      LEU   8 -19.660   0.783  -1.237
   66   HD21  LEU   8          HD21      LEU   8 -21.319  -1.806   1.101
   67   HD22  LEU   8          HD22      LEU   8 -19.563  -1.690   1.273
   68   HD23  LEU   8          HD23      LEU   8 -20.279  -3.035   0.380
   69    H    ILE   9           HN       ILE   9 -19.199  -0.652  -3.454
   70    HA   ILE   9           HA       ILE   9 -19.062  -3.282  -4.760
   71    HB   ILE   9           HB       ILE   9 -17.739  -0.710  -5.673
   72   HG12  ILE   9          HG12      ILE   9 -19.688  -2.594  -7.085
   73   HG13  ILE   9          HG11      ILE   9 -20.131  -0.989  -6.391
   74   HG21  ILE   9          HG21      ILE   9 -17.363  -3.509  -6.747
   75   HG22  ILE   9          HG22      ILE   9 -16.177  -2.583  -5.827
   76   HG23  ILE   9          HG23      ILE   9 -16.675  -2.032  -7.426
   77   HD11  ILE   9          HD11      ILE   9 -18.223  -1.521  -8.691
   78   HD12  ILE   9          HD12      ILE   9 -18.565   0.062  -7.992
   79   HD13  ILE   9          HD13      ILE   9 -19.850  -0.842  -8.796
   80    H    LEU  10           HN       LEU  10 -17.676  -4.583  -3.705
   81    HA   LEU  10           HA       LEU  10 -15.736  -3.331  -1.907
   82    HB2  LEU  10           HB2      LEU  10 -16.339  -6.279  -2.160
   83    HB3  LEU  10           HB1      LEU  10 -15.320  -5.525  -0.965
   84    HG   LEU  10           HG       LEU  10 -17.169  -5.953   0.271
   85   HD11  LEU  10          HD11      LEU  10 -17.929  -3.285  -0.836
   86   HD12  LEU  10          HD12      LEU  10 -16.704  -3.581   0.410
   87   HD13  LEU  10          HD13      LEU  10 -18.396  -3.973   0.722
   88   HD21  LEU  10          HD21      LEU  10 -18.463  -6.816  -1.695
   89   HD22  LEU  10          HD22      LEU  10 -19.060  -5.170  -1.922
   90   HD23  LEU  10          HD23      LEU  10 -19.412  -6.038  -0.432
   91    H    ASN  11           HN       ASN  11 -13.879  -2.830  -2.808
   92    HA   ASN  11           HA       ASN  11 -12.814  -4.661  -4.856
   93    HB2  ASN  11           HB2      ASN  11 -13.209  -2.098  -5.282
   94    HB3  ASN  11           HB1      ASN  11 -11.745  -1.896  -4.326
   95   HD21  ASN  11          HD21      ASN  11 -12.099  -1.182  -7.036
   96   HD22  ASN  11          HD22      ASN  11 -11.005  -2.123  -7.990
   97    H    GLY  12           HN       GLY  12 -12.022  -6.113  -3.321
   98    HA2  GLY  12           HA2      GLY  12  -9.556  -5.146  -1.998
   99    HA3  GLY  12           HA1      GLY  12 -10.689  -6.213  -1.127
  100    H    LYS  13           HN       LYS  13  -8.828  -7.601  -0.939
  101    HA   LYS  13           HA       LYS  13  -8.002  -8.948  -3.368
  102    HB2  LYS  13           HB2      LYS  13  -7.001  -9.296  -0.533
  103    HB3  LYS  13           HB1      LYS  13  -6.338 -10.113  -1.942
  104    HG2  LYS  13           HG2      LYS  13  -5.780  -7.930  -2.915
  105    HG3  LYS  13           HG1      LYS  13  -6.395  -7.141  -1.460
  106    HD2  LYS  13           HD2      LYS  13  -4.008  -7.300  -1.293
  107    HD3  LYS  13           HD1      LYS  13  -4.722  -8.427  -0.140
  108    HE2  LYS  13           HE2      LYS  13  -4.391 -10.250  -1.774
  109    HE3  LYS  13           HE1      LYS  13  -3.591  -9.109  -2.849
  110    HZ1  LYS  13           HZ1      LYS  13  -1.971  -8.712  -1.035
  111    HZ2  LYS  13           HZ2      LYS  13  -1.933 -10.291  -1.662
  112    HZ3  LYS  13           HZ3      LYS  13  -2.686  -9.987  -0.170
  113    H    THR  14           HN       THR  14  -9.250 -10.187  -0.182
  114    HA   THR  14           HA       THR  14 -10.011 -12.651  -1.562
  115    HB   THR  14           HB       THR  14 -10.373 -12.098   1.385
  116    HG1  THR  14           HG1      THR  14  -8.087 -13.357   1.069
  117   HG21  THR  14          HG21      THR  14 -10.045 -14.513   1.571
  118   HG22  THR  14          HG22      THR  14  -9.736 -14.629  -0.159
  119   HG23  THR  14          HG23      THR  14 -11.335 -14.165   0.419
  120    H    LEU  15           HN       LEU  15 -11.327  -9.739  -1.192
  121    HA   LEU  15           HA       LEU  15 -14.056 -10.762  -1.080
  122    HB2  LEU  15           HB2      LEU  15 -12.947  -9.395   1.038
  123    HB3  LEU  15           HB1      LEU  15 -13.720  -8.114   0.139
  124    HG   LEU  15           HG       LEU  15 -15.247  -8.822   1.795
  125   HD11  LEU  15          HD11      LEU  15 -16.267  -8.372  -0.332
  126   HD12  LEU  15          HD12      LEU  15 -17.126  -9.690   0.465
  127   HD13  LEU  15          HD13      LEU  15 -16.004 -10.034  -0.850
  128   HD21  LEU  15          HD21      LEU  15 -14.976 -11.669   0.831
  129   HD22  LEU  15          HD22      LEU  15 -15.911 -11.085   2.205
  130   HD23  LEU  15          HD23      LEU  15 -14.150 -11.013   2.239
  131    H    LYS  16           HN       LYS  16 -14.392 -10.499  -3.184
  132    HA   LYS  16           HA       LYS  16 -14.376  -7.741  -4.209
  133    HB2  LYS  16           HB2      LYS  16 -13.609 -10.269  -5.683
  134    HB3  LYS  16           HB1      LYS  16 -13.786  -8.695  -6.434
  135    HG2  LYS  16           HG2      LYS  16 -11.816  -7.950  -5.637
  136    HG3  LYS  16           HG1      LYS  16 -11.832  -8.954  -4.179
  137    HD2  LYS  16           HD2      LYS  16 -11.308 -10.878  -5.547
  138    HD3  LYS  16           HD1      LYS  16 -11.478  -9.883  -6.991
  139    HE2  LYS  16           HE2      LYS  16  -9.395  -9.454  -4.871
  140    HE3  LYS  16           HE1      LYS  16  -9.120 -10.301  -6.394
  141    HZ1  LYS  16           HZ1      LYS  16  -9.918  -8.208  -7.509
  142    HZ2  LYS  16           HZ2      LYS  16  -8.412  -8.103  -6.745
  143    HZ3  LYS  16           HZ3      LYS  16  -9.779  -7.446  -6.000
  144    H    GLY  17           HN       GLY  17 -16.412  -7.166  -4.700
  145    HA2  GLY  17           HA2      GLY  17 -18.195  -8.634  -6.197
  146    HA3  GLY  17           HA1      GLY  17 -18.559  -9.021  -4.521
  147    H    GLU  18           HN       GLU  18 -20.643  -8.022  -5.318
  148    HA   GLU  18           HA       GLU  18 -20.603  -5.177  -4.601
  149    HB2  GLU  18           HB2      GLU  18 -22.103  -6.357  -6.953
  150    HB3  GLU  18           HB1      GLU  18 -22.278  -4.710  -6.369
  151    HG2  GLU  18           HG2      GLU  18 -20.078  -4.148  -7.027
  152    HG3  GLU  18           HG1      GLU  18 -19.668  -5.837  -7.335
  153    H    THR  19           HN       THR  19 -22.860  -4.391  -4.126
  154    HA   THR  19           HA       THR  19 -24.903  -6.269  -3.504
  155    HB   THR  19           HB       THR  19 -23.360  -6.783  -1.635
  156    HG1  THR  19           HG1      THR  19 -25.273  -7.132  -0.788
  157   HG21  THR  19          HG21      THR  19 -23.787  -3.878  -0.874
  158   HG22  THR  19          HG22      THR  19 -22.270  -4.577  -1.438
  159   HG23  THR  19          HG23      THR  19 -22.953  -5.075   0.116
  160    H    THR  20           HN       THR  20 -26.796  -5.159  -2.515
  161    HA   THR  20           HA       THR  20 -26.668  -2.247  -2.839
  162    HB   THR  20           HB       THR  20 -28.926  -2.309  -3.920
  163    HG1  THR  20           HG1      THR  20 -28.607  -4.964  -3.437
  164   HG21  THR  20          HG21      THR  20 -26.630  -3.636  -5.373
  165   HG22  THR  20          HG22      THR  20 -27.031  -1.919  -5.356
  166   HG23  THR  20          HG23      THR  20 -28.095  -3.063  -6.171
  167    H    THR  21           HN       THR  21 -28.385  -1.069  -1.806
  168    HA   THR  21           HA       THR  21 -30.215  -2.432  -0.062
  169    HB   THR  21           HB       THR  21 -27.990  -2.385   1.254
  170    HG1  THR  21           HG1      THR  21 -29.509  -2.693   2.702
  171   HG21  THR  21          HG21      THR  21 -27.312  -0.069   0.673
  172   HG22  THR  21          HG22      THR  21 -27.515  -0.231   2.418
  173   HG23  THR  21          HG23      THR  21 -28.765   0.559   1.455
  174    H    GLU  22           HN       GLU  22 -31.675  -0.883   0.977
  175    HA   GLU  22           HA       GLU  22 -31.852   1.566  -0.633
  176    HB2  GLU  22           HB2      GLU  22 -34.247   1.625   0.271
  177    HB3  GLU  22           HB1      GLU  22 -33.911   0.276  -0.809
  178    HG2  GLU  22           HG2      GLU  22 -35.210  -0.606   0.925
  179    HG3  GLU  22           HG1      GLU  22 -33.519  -1.122   1.283
  180    H    ALA  23           HN       ALA  23 -32.058   3.576   0.273
  181    HA   ALA  23           HA       ALA  23 -32.151   3.925   3.170
  182    HB1  ALA  23           HB1      ALA  23 -29.765   3.519   2.855
  183    HB2  ALA  23           HB2      ALA  23 -30.031   5.225   3.227
  184    HB3  ALA  23           HB3      ALA  23 -29.703   4.725   1.570
  185    H    VAL  24           HN       VAL  24 -32.501   6.247   3.698
  186    HA   VAL  24           HA       VAL  24 -33.665   7.646   1.421
  187    HB   VAL  24           HB       VAL  24 -34.583   9.213   3.125
  188   HG11  VAL  24          HG11      VAL  24 -36.222   7.618   4.016
  189   HG12  VAL  24          HG12      VAL  24 -35.165   6.284   3.551
  190   HG13  VAL  24          HG13      VAL  24 -35.881   7.316   2.313
  191   HG21  VAL  24          HG21      VAL  24 -33.358   7.260   5.064
  192   HG22  VAL  24          HG22      VAL  24 -34.493   8.538   5.487
  193   HG23  VAL  24          HG23      VAL  24 -32.898   8.949   4.855
  194    H    ASP  25           HN       ASP  25 -30.702   7.681   2.997
  195    HA   ASP  25           HA       ASP  25 -30.062  10.264   1.831
  196    HB2  ASP  25           HB2      ASP  25 -29.615   9.628   4.756
  197    HB3  ASP  25           HB1      ASP  25 -28.746  10.898   3.907
  198    H    ALA  26           HN       ALA  26 -27.755  10.587   1.560
  199    HA   ALA  26           HA       ALA  26 -26.460   8.158   0.795
  200    HB1  ALA  26           HB1      ALA  26 -26.162  10.242  -0.464
  201    HB2  ALA  26           HB2      ALA  26 -24.615   9.606   0.093
  202    HB3  ALA  26           HB3      ALA  26 -25.362  10.967   0.929
  203    H    ALA  27           HN       ALA  27 -26.102  10.434   3.456
  204    HA   ALA  27           HA       ALA  27 -23.702   9.359   4.509
  205    HB1  ALA  27           HB1      ALA  27 -24.324  10.589   6.576
  206    HB2  ALA  27           HB2      ALA  27 -25.885  10.960   5.843
  207    HB3  ALA  27           HB3      ALA  27 -24.398  11.582   5.121
  208    H    THR  28           HN       THR  28 -27.052   8.488   4.849
  209    HA   THR  28           HA       THR  28 -26.717   6.824   7.149
  210    HB   THR  28           HB       THR  28 -28.961   6.586   5.146
  211    HG1  THR  28           HG1      THR  28 -29.479   8.308   7.172
  212   HG21  THR  28          HG21      THR  28 -28.945   4.958   6.989
  213   HG22  THR  28          HG22      THR  28 -30.279   6.096   7.184
  214   HG23  THR  28          HG23      THR  28 -28.822   6.272   8.162
  215    H    ALA  29           HN       ALA  29 -26.313   6.388   3.731
  216    HA   ALA  29           HA       ALA  29 -26.603   3.529   3.703
  217    HB1  ALA  29           HB1      ALA  29 -25.253   5.370   1.723
  218    HB2  ALA  29           HB2      ALA  29 -26.937   4.849   1.669
  219    HB3  ALA  29           HB3      ALA  29 -25.644   3.671   1.455
  220    H    GLU  30           HN       GLU  30 -24.056   5.860   4.116
  221    HA   GLU  30           HA       GLU  30 -21.782   4.287   3.978
  222    HB2  GLU  30           HB2      GLU  30 -22.024   6.842   4.344
  223    HB3  GLU  30           HB1      GLU  30 -22.216   6.439   6.042
  224    HG2  GLU  30           HG2      GLU  30 -20.015   5.165   5.809
  225    HG3  GLU  30           HG1      GLU  30 -19.819   6.078   4.315
  226    H    LYS  31           HN       LYS  31 -23.402   5.308   6.932
  227    HA   LYS  31           HA       LYS  31 -22.093   3.860   8.789
  228    HB2  LYS  31           HB2      LYS  31 -25.060   4.379   8.919
  229    HB3  LYS  31           HB1      LYS  31 -23.947   4.202  10.272
  230    HG2  LYS  31           HG2      LYS  31 -24.126   6.467   8.306
  231    HG3  LYS  31           HG1      LYS  31 -24.407   6.504  10.046
  232    HD2  LYS  31           HD2      LYS  31 -22.072   6.080  10.475
  233    HD3  LYS  31           HD1      LYS  31 -21.756   5.893   8.749
  234    HE2  LYS  31           HE2      LYS  31 -22.509   8.240   8.424
  235    HE3  LYS  31           HE1      LYS  31 -22.628   8.400  10.175
  236    HZ1  LYS  31           HZ1      LYS  31 -20.547   9.261   9.519
  237    HZ2  LYS  31           HZ2      LYS  31 -20.184   7.899   8.569
  238    HZ3  LYS  31           HZ3      LYS  31 -20.231   7.768  10.263
  239    H    VAL  32           HN       VAL  32 -24.848   2.667   6.883
  240    HA   VAL  32           HA       VAL  32 -25.085   0.229   8.380
  241    HB   VAL  32           HB       VAL  32 -26.145   0.876   5.621
  242   HG11  VAL  32          HG11      VAL  32 -26.092  -1.516   6.025
  243   HG12  VAL  32          HG12      VAL  32 -27.755  -0.928   6.048
  244   HG13  VAL  32          HG13      VAL  32 -26.929  -1.299   7.562
  245   HG21  VAL  32          HG21      VAL  32 -26.976   2.450   7.277
  246   HG22  VAL  32          HG22      VAL  32 -27.477   1.119   8.320
  247   HG23  VAL  32          HG23      VAL  32 -28.263   1.364   6.761
  248    H    PHE  33           HN       PHE  33 -23.723   1.095   5.213
  249    HA   PHE  33           HA       PHE  33 -22.863  -1.557   4.616
  250    HB2  PHE  33           HB2      PHE  33 -22.379   1.129   3.399
  251    HB3  PHE  33           HB1      PHE  33 -21.290  -0.179   2.986
  252    HD1  PHE  33           HD1      PHE  33 -23.234  -2.443   2.963
  253    HD2  PHE  33           HD2      PHE  33 -23.506   1.500   1.386
  254    HE1  PHE  33           HE1      PHE  33 -24.796  -3.244   1.244
  255    HE2  PHE  33           HE2      PHE  33 -25.076   0.706  -0.339
  256    HZ   PHE  33           HZ       PHE  33 -25.721  -1.671  -0.419
  257    H    LYS  34           HN       LYS  34 -21.517   0.980   6.556
  258    HA   LYS  34           HA       LYS  34 -18.817   0.195   6.438
  259    HB2  LYS  34           HB2      LYS  34 -20.338   1.538   8.693
  260    HB3  LYS  34           HB1      LYS  34 -18.601   1.437   8.623
  261    HG2  LYS  34           HG2      LYS  34 -19.174   2.550   6.238
  262    HG3  LYS  34           HG1      LYS  34 -20.366   3.277   7.339
  263    HD2  LYS  34           HD2      LYS  34 -18.394   4.572   7.451
  264    HD3  LYS  34           HD1      LYS  34 -18.500   3.683   8.945
  265    HE2  LYS  34           HE2      LYS  34 -16.899   2.054   8.089
  266    HE3  LYS  34           HE1      LYS  34 -16.819   2.919   6.554
  267    HZ1  LYS  34           HZ1      LYS  34 -14.958   3.356   8.167
  268    HZ2  LYS  34           HZ2      LYS  34 -16.081   4.188   9.133
  269    HZ3  LYS  34           HZ3      LYS  34 -15.742   4.734   7.565
  270    H    GLN  35           HN       GLN  35 -21.508  -0.793   8.439
  271    HA   GLN  35           HA       GLN  35 -20.009  -2.569  10.067
  272    HB2  GLN  35           HB2      GLN  35 -22.155  -1.527  10.800
  273    HB3  GLN  35           HB1      GLN  35 -23.008  -2.384   9.541
  274    HG2  GLN  35           HG2      GLN  35 -21.607  -3.825  11.801
  275    HG3  GLN  35           HG1      GLN  35 -23.264  -3.256  11.884
  276   HE21  GLN  35          HE21      GLN  35 -22.039  -5.963  11.914
  277   HE22  GLN  35          HE22      GLN  35 -22.901  -6.844  10.698
  278    H    TYR  36           HN       TYR  36 -21.769  -2.751   7.057
  279    HA   TYR  36           HA       TYR  36 -21.812  -5.558   6.740
  280    HB2  TYR  36           HB2      TYR  36 -23.236  -4.255   5.320
  281    HB3  TYR  36           HB1      TYR  36 -21.887  -3.276   4.761
  282    HD1  TYR  36           HD1      TYR  36 -23.401  -6.657   4.530
  283    HD2  TYR  36           HD2      TYR  36 -20.581  -3.918   2.939
  284    HE1  TYR  36           HE1      TYR  36 -23.079  -8.124   2.583
  285    HE2  TYR  36           HE2      TYR  36 -20.250  -5.364   0.985
  286    HH   TYR  36           HH       TYR  36 -22.272  -8.142   0.402
  287    H    ALA  37           HN       ALA  37 -19.572  -3.096   5.456
  288    HA   ALA  37           HA       ALA  37 -17.797  -4.964   4.276
  289    HB1  ALA  37           HB1      ALA  37 -16.260  -3.067   4.061
  290    HB2  ALA  37           HB2      ALA  37 -17.267  -2.124   5.160
  291    HB3  ALA  37           HB3      ALA  37 -17.899  -2.609   3.587
  292    H    ASN  38           HN       ASN  38 -18.053  -3.513   7.448
  293    HA   ASN  38           HA       ASN  38 -15.526  -4.248   8.466
  294    HB2  ASN  38           HB2      ASN  38 -17.075  -2.607   9.571
  295    HB3  ASN  38           HB1      ASN  38 -18.123  -3.952  10.024
  296   HD21  ASN  38          HD21      ASN  38 -17.474  -5.354  11.685
  297   HD22  ASN  38          HD22      ASN  38 -16.103  -4.979  12.757
  298    H    ASP  39           HN       ASP  39 -18.629  -5.933   8.379
  299    HA   ASP  39           HA       ASP  39 -17.837  -8.194   9.880
  300    HB2  ASP  39           HB2      ASP  39 -20.179  -7.729   9.540
  301    HB3  ASP  39           HB1      ASP  39 -19.996  -7.842   7.791
  302    H    ASN  40           HN       ASN  40 -17.299  -7.286   6.572
  303    HA   ASN  40           HA       ASN  40 -16.516 -10.000   5.833
  304    HB2  ASN  40           HB2      ASN  40 -17.112  -7.503   4.296
  305    HB3  ASN  40           HB1      ASN  40 -16.091  -8.735   3.567
  306   HD21  ASN  40          HD21      ASN  40 -19.295  -7.888   4.587
  307   HD22  ASN  40          HD22      ASN  40 -20.103  -9.310   3.904
  308    H    GLY  41           HN       GLY  41 -15.175  -7.327   7.222
  309    HA2  GLY  41           HA2      GLY  41 -12.987  -7.061   7.924
  310    HA3  GLY  41           HA1      GLY  41 -12.524  -8.395   6.890
  311    H    VAL  42           HN       VAL  42 -14.317  -5.929   5.308
  312    HA   VAL  42           HA       VAL  42 -11.868  -5.126   3.943
  313    HB   VAL  42           HB       VAL  42 -14.750  -4.623   3.155
  314   HG11  VAL  42          HG11      VAL  42 -13.766  -3.995   0.985
  315   HG12  VAL  42          HG12      VAL  42 -12.152  -4.237   1.653
  316   HG13  VAL  42          HG13      VAL  42 -13.180  -2.949   2.281
  317   HG21  VAL  42          HG21      VAL  42 -14.269  -6.330   1.418
  318   HG22  VAL  42          HG22      VAL  42 -14.273  -6.972   3.063
  319   HG23  VAL  42          HG23      VAL  42 -12.741  -6.666   2.234
  320    H    ASP  43           HN       ASP  43 -10.962  -3.273   4.371
  321    HA   ASP  43           HA       ASP  43 -12.604  -0.976   5.106
  322    HB2  ASP  43           HB2      ASP  43 -11.765  -1.995   7.243
  323    HB3  ASP  43           HB1      ASP  43 -10.118  -1.728   6.674
  324    H    GLY  44           HN       GLY  44 -11.831   0.957   4.294
  325    HA2  GLY  44           HA2      GLY  44  -9.237   1.489   3.411
  326    HA3  GLY  44           HA1      GLY  44 -10.131   0.811   2.054
  327    H    GLU  45           HN       GLU  45  -9.576   3.083   1.254
  328    HA   GLU  45           HA       GLU  45 -10.977   5.319   2.288
  329    HB2  GLU  45           HB2      GLU  45  -9.811   4.748  -0.429
  330    HB3  GLU  45           HB1      GLU  45 -10.626   6.257  -0.049
  331    HG2  GLU  45           HG2      GLU  45  -8.996   6.685   1.723
  332    HG3  GLU  45           HG1      GLU  45  -8.172   5.177   1.312
  333    H    TRP  46           HN       TRP  46 -12.827   6.342   1.514
  334    HA   TRP  46           HA       TRP  46 -14.711   4.473   0.254
  335    HB2  TRP  46           HB2      TRP  46 -15.077   6.358   2.558
  336    HB3  TRP  46           HB1      TRP  46 -16.445   6.053   1.497
  337    HD1  TRP  46           HD1      TRP  46 -13.784   3.767   3.167
  338    HE1  TRP  46           HE1      TRP  46 -14.969   1.746   4.222
  339    HE3  TRP  46           HE3      TRP  46 -18.682   4.936   2.017
  340    HZ2  TRP  46           HZ2      TRP  46 -17.567   0.791   4.530
  341    HZ3  TRP  46           HZ3      TRP  46 -20.432   3.400   2.766
  342    HH2  TRP  46           HH2      TRP  46 -19.886   1.362   3.998
  343    H    THR  47           HN       THR  47 -15.255   5.043  -1.714
  344    HA   THR  47           HA       THR  47 -15.196   7.888  -2.447
  345    HB   THR  47           HB       THR  47 -15.180   6.926  -4.832
  346    HG1  THR  47           HG1      THR  47 -13.979   4.635  -3.793
  347   HG21  THR  47          HG21      THR  47 -12.812   6.463  -3.018
  348   HG22  THR  47          HG22      THR  47 -13.248   7.988  -3.785
  349   HG23  THR  47          HG23      THR  47 -12.751   6.616  -4.774
  350    H    TYR  48           HN       TYR  48 -16.904   8.595  -3.997
  351    HA   TYR  48           HA       TYR  48 -19.330   7.014  -3.983
  352    HB2  TYR  48           HB2      TYR  48 -19.819   8.055  -1.939
  353    HB3  TYR  48           HB1      TYR  48 -19.092   9.578  -2.396
  354    HD1  TYR  48           HD1      TYR  48 -20.405  11.283  -3.424
  355    HD2  TYR  48           HD2      TYR  48 -22.103   7.399  -2.886
  356    HE1  TYR  48           HE1      TYR  48 -22.619  12.157  -4.028
  357    HE2  TYR  48           HE2      TYR  48 -24.304   8.277  -3.494
  358    HH   TYR  48           HH       TYR  48 -25.506  10.403  -3.522
  359    H    ASP  49           HN       ASP  49 -20.743   7.544  -5.628
  360    HA   ASP  49           HA       ASP  49 -19.919   9.818  -7.354
  361    HB2  ASP  49           HB2      ASP  49 -19.289   7.686  -8.500
  362    HB3  ASP  49           HB1      ASP  49 -20.924   7.108  -8.347
  363    H    ASP  50           HN       ASP  50 -21.689  11.013  -8.244
  364    HA   ASP  50           HA       ASP  50 -24.058  10.710  -6.526
  365    HB2  ASP  50           HB2      ASP  50 -22.983  12.961  -6.712
  366    HB3  ASP  50           HB1      ASP  50 -23.363  12.964  -8.433
  367    H    ALA  51           HN       ALA  51 -23.105  10.478  -9.872
  368    HA   ALA  51           HA       ALA  51 -25.727  10.545 -10.951
  369    HB1  ALA  51           HB1      ALA  51 -24.708   9.737 -13.007
  370    HB2  ALA  51           HB2      ALA  51 -23.226   9.349 -12.135
  371    HB3  ALA  51           HB3      ALA  51 -23.738  11.028 -12.296
  372    H    THR  52           HN       THR  52 -23.692   7.996  -9.673
  373    HA   THR  52           HA       THR  52 -25.762   6.041 -10.381
  374    HB   THR  52           HB       THR  52 -23.930   4.363  -9.825
  375    HG1  THR  52           HG1      THR  52 -22.312   6.728 -10.035
  376   HG21  THR  52          HG21      THR  52 -23.495   6.301 -12.106
  377   HG22  THR  52          HG22      THR  52 -24.555   4.891 -12.125
  378   HG23  THR  52          HG23      THR  52 -22.806   4.685 -11.995
  379    H    LYS  53           HN       LYS  53 -24.478   7.646  -7.624
  380    HA   LYS  53           HA       LYS  53 -24.843   7.455  -5.359
  381    HB2  LYS  53           HB2      LYS  53 -27.125   5.885  -6.446
  382    HB3  LYS  53           HB1      LYS  53 -26.703   5.610  -4.769
  383    HG2  LYS  53           HG2      LYS  53 -28.438   7.306  -4.984
  384    HG3  LYS  53           HG1      LYS  53 -26.969   7.949  -4.255
  385    HD2  LYS  53           HD2      LYS  53 -26.341   8.868  -6.492
  386    HD3  LYS  53           HD1      LYS  53 -27.915   8.342  -7.093
  387    HE2  LYS  53           HE2      LYS  53 -29.035   9.746  -5.463
  388    HE3  LYS  53           HE1      LYS  53 -27.480  10.245  -4.801
  389    HZ1  LYS  53           HZ1      LYS  53 -28.448  11.887  -6.310
  390    HZ2  LYS  53           HZ2      LYS  53 -28.393  10.764  -7.581
  391    HZ3  LYS  53           HZ3      LYS  53 -26.953  11.320  -6.874
  392    H    THR  54           HN       THR  54 -23.287   5.401  -7.100
  393    HA   THR  54           HA       THR  54 -23.103   3.095  -5.472
  394    HB   THR  54           HB       THR  54 -21.053   4.042  -7.481
  395    HG1  THR  54           HG1      THR  54 -22.324   2.852  -9.004
  396   HG21  THR  54          HG21      THR  54 -21.879   1.257  -6.593
  397   HG22  THR  54          HG22      THR  54 -20.434   2.106  -6.040
  398   HG23  THR  54          HG23      THR  54 -20.591   1.649  -7.737
  399    H    TYR  55           HN       TYR  55 -22.061   2.880  -3.603
  400    HA   TYR  55           HA       TYR  55 -19.866   4.704  -2.922
  401    HB2  TYR  55           HB2      TYR  55 -21.647   2.920  -1.282
  402    HB3  TYR  55           HB1      TYR  55 -20.028   3.246  -0.698
  403    HD1  TYR  55           HD1      TYR  55 -23.255   4.834  -1.590
  404    HD2  TYR  55           HD2      TYR  55 -19.469   5.285   0.282
  405    HE1  TYR  55           HE1      TYR  55 -24.009   6.947  -0.581
  406    HE2  TYR  55           HE2      TYR  55 -20.205   7.405   1.278
  407    HH   TYR  55           HH       TYR  55 -23.338   8.333   1.514
  408    H    THR  56           HN       THR  56 -17.760   3.972  -2.817
  409    HA   THR  56           HA       THR  56 -17.369   1.090  -3.272
  410    HB   THR  56           HB       THR  56 -15.865   3.319  -4.660
  411    HG1  THR  56           HG1      THR  56 -18.153   2.129  -5.254
  412   HG21  THR  56          HG21      THR  56 -14.764   1.478  -5.911
  413   HG22  THR  56          HG22      THR  56 -15.575   0.311  -4.871
  414   HG23  THR  56          HG23      THR  56 -14.390   1.423  -4.188
  415    H    VAL  57           HN       VAL  57 -15.918   0.124  -2.022
  416    HA   VAL  57           HA       VAL  57 -14.209   1.847  -0.357
  417    HB   VAL  57           HB       VAL  57 -15.789   0.564   1.068
  418   HG11  VAL  57          HG11      VAL  57 -16.243  -1.429  -0.156
  419   HG12  VAL  57          HG12      VAL  57 -15.430  -1.902   1.329
  420   HG13  VAL  57          HG13      VAL  57 -14.534  -1.869  -0.185
  421   HG21  VAL  57          HG21      VAL  57 -12.942  -0.372   1.323
  422   HG22  VAL  57          HG22      VAL  57 -14.155  -0.373   2.604
  423   HG23  VAL  57          HG23      VAL  57 -13.587   1.153   1.923
  424    H    THR  58           HN       THR  58 -12.200   1.874  -0.993
  425    HA   THR  58           HA       THR  58 -11.207  -0.351  -2.637
  426    HB   THR  58           HB       THR  58  -9.958   2.391  -2.393
  427    HG1  THR  58           HG1      THR  58 -12.339   1.817  -3.369
  428   HG21  THR  58          HG21      THR  58  -9.863   0.294  -4.577
  429   HG22  THR  58          HG22      THR  58  -8.592   0.575  -3.385
  430   HG23  THR  58          HG23      THR  58  -8.991   1.829  -4.561
  431    H    GLU  59           HN       GLU  59  -9.720  -1.672  -1.858
  432    HA   GLU  59           HA       GLU  59  -8.655  -1.206   0.784
  433    HB2  GLU  59           HB2      GLU  59  -9.570  -3.407  -0.124
  434    HB3  GLU  59           HB1      GLU  59  -8.080  -3.551  -1.037
  435    HG2  GLU  59           HG2      GLU  59  -8.288  -3.436   1.966
  436    HG3  GLU  59           HG1      GLU  59  -8.112  -4.895   1.007
  437    H    GLY  60           HN       GLY  60  -7.232   0.619   0.348
  438    HA2  GLY  60           HA2      GLY  60  -4.965   1.161   0.519
  439    HA3  GLY  60           HA1      GLY  60  -4.552  -0.390  -0.189
  440    H    SER  61           HN       SER  61  -3.487   2.239  -0.737
  441    HA   SER  61           HA       SER  61  -4.248   2.591  -3.553
  442    HB2  SER  61           HB2      SER  61  -2.451   4.310  -1.811
  443    HB3  SER  61           HB1      SER  61  -2.955   4.676  -3.462
  444    HG   SER  61           HG       SER  61  -4.386   5.760  -2.241
  445    H    GLY  62           HN       GLY  62  -1.325   2.316  -1.514
  446    HA2  GLY  62           HA2      GLY  62   0.442   0.824  -1.871
  447    HA3  GLY  62           HA1      GLY  62  -0.182   0.497  -3.477
  448    H    GLY  63           HN       GLY  63   2.380   1.898  -1.892
  449    HA2  GLY  63           HA2      GLY  63   2.779   4.059  -3.791
  450    HA3  GLY  63           HA1      GLY  63   3.863   3.602  -2.484
  451    H    ALA  64           HN       ALA  64   2.953   0.905  -4.146
  452    HA   ALA  64           HA       ALA  64   3.848  -0.468  -5.696
  453    HB1  ALA  64           HB1      ALA  64   3.624   1.365  -7.287
  454    HB2  ALA  64           HB2      ALA  64   5.092   0.434  -7.595
  455    HB3  ALA  64           HB3      ALA  64   5.193   1.999  -6.790
  456    H    GLY  65           HN       GLY  65   6.062  -1.202  -6.590
  457    HA2  GLY  65           HA2      GLY  65   8.044  -0.955  -4.417
  458    HA3  GLY  65           HA1      GLY  65   7.705  -2.469  -5.246
  459    H    GLY  66           HN       GLY  66  10.274  -1.690  -5.176
  460    HA2  GLY  66           HA2      GLY  66  11.037  -0.023  -7.378
  461    HA3  GLY  66           HA1      GLY  66  12.102  -1.051  -6.429
  462    H    GLN  67           HN       GLN  67  10.735  -3.501  -6.914
  463    HA   GLN  67           HA       GLN  67  10.676  -5.246  -8.354
  464    HB2  GLN  67           HB2      GLN  67  10.315  -3.066 -10.442
  465    HB3  GLN  67           HB1      GLN  67  10.172  -4.814 -10.766
  466    HG2  GLN  67           HG2      GLN  67   8.330  -4.908  -9.110
  467    HG3  GLN  67           HG1      GLN  67   8.437  -3.156  -8.937
  468   HE21  GLN  67          HE21      GLN  67   6.348  -2.871  -9.667
  469   HE22  GLN  67          HE22      GLN  67   5.899  -3.077 -11.332
  470    H    GLY  68           HN       GLY  68  11.783  -5.978 -10.578
  471    HA2  GLY  68           HA2      GLY  68  13.734  -5.852 -11.943
  472    HA3  GLY  68           HA1      GLY  68  14.504  -4.880 -10.700
  473    H    MET  69           HN       MET  69  16.123  -6.659 -11.484
  474    HA   MET  69           HA       MET  69  16.239  -8.598  -9.330
  475    HB2  MET  69           HB2      MET  69  15.072  -9.832 -11.113
  476    HB3  MET  69           HB1      MET  69  16.389  -9.483 -12.224
  477    HG2  MET  69           HG2      MET  69  16.580 -11.739 -11.410
  478    HG3  MET  69           HG1      MET  69  17.914 -10.767 -10.794
  479    HE1  MET  69           HE1      MET  69  18.343 -12.832  -9.107
  480    HE2  MET  69           HE2      MET  69  16.904 -13.669  -9.690
  481    HE3  MET  69           HE3      MET  69  17.139 -13.418  -7.960
  482    H    ILE  70           HN       ILE  70  18.231  -8.289  -8.494
  483    HA   ILE  70           HA       ILE  70  20.474  -7.739 -10.308
  484    HB   ILE  70           HB       ILE  70  19.876  -6.130  -7.791
  485   HG12  ILE  70          HG12      ILE  70  18.474  -5.510  -9.746
  486   HG13  ILE  70          HG11      ILE  70  19.554  -4.219  -9.234
  487   HG21  ILE  70          HG21      ILE  70  22.170  -5.773  -9.739
  488   HG22  ILE  70          HG22      ILE  70  22.309  -6.518  -8.144
  489   HG23  ILE  70          HG23      ILE  70  21.855  -4.817  -8.293
  490   HD11  ILE  70          HD11      ILE  70  21.041  -4.682 -11.081
  491   HD12  ILE  70          HD12      ILE  70  19.401  -4.426 -11.677
  492   HD13  ILE  70          HD13      ILE  70  20.053  -6.061 -11.563
  493    H    GLN  71           HN       GLN  71  21.320  -9.845  -9.884
  494    HA   GLN  71           HA       GLN  71  22.223 -10.230  -7.106
  495    HB2  GLN  71           HB2      GLN  71  21.974 -12.634  -7.385
  496    HB3  GLN  71           HB1      GLN  71  20.443 -11.825  -7.670
  497    HG2  GLN  71           HG2      GLN  71  20.676 -12.081 -10.037
  498    HG3  GLN  71           HG1      GLN  71  22.311 -12.717  -9.856
  499   HE21  GLN  71          HE21      GLN  71  21.643 -14.320  -7.527
  500   HE22  GLN  71          HE22      GLN  71  20.720 -15.672  -8.108
  501    H    GLU  72           HN       GLU  72  23.248  -9.261  -9.851
  502    HA   GLU  72           HA       GLU  72  25.508 -10.980 -10.350
  503    HB2  GLU  72           HB2      GLU  72  24.794  -8.248 -11.461
  504    HB3  GLU  72           HB1      GLU  72  26.121  -9.251 -12.027
  505    HG2  GLU  72           HG2      GLU  72  24.282  -9.446 -13.543
  506    HG3  GLU  72           HG1      GLU  72  24.494 -10.979 -12.706
  507    HA   PRO  73           HA       PRO  73  28.342  -8.883  -7.654
  508    HB2  PRO  73           HB2      PRO  73  30.706  -9.283  -8.909
  509    HB3  PRO  73           HB1      PRO  73  29.813 -10.623  -8.098
  510    HG2  PRO  73           HG2      PRO  73  29.896  -9.877 -11.016
  511    HG3  PRO  73           HG1      PRO  73  30.021 -11.483 -10.269
  512    HD2  PRO  73           HD2      PRO  73  27.717 -10.545 -11.359
  513    HD3  PRO  73           HD1      PRO  73  27.742 -11.662  -9.953
  514    H    ALA  74           HN       ALA  74  30.077  -7.216  -7.671
  515    HA   ALA  74           HA       ALA  74  30.529  -5.568  -9.876
  516    HB1  ALA  74           HB1      ALA  74  28.432  -4.467  -8.005
  517    HB2  ALA  74           HB2      ALA  74  28.154  -4.998  -9.663
  518    HB3  ALA  74           HB3      ALA  74  29.188  -3.606  -9.347
  519    H    LEU  75           HN       LEU  75  31.229  -3.258  -9.043
  520    HA   LEU  75           HA       LEU  75  33.171  -3.752  -6.960
  521    HB2  LEU  75           HB2      LEU  75  32.696  -1.403  -8.797
  522    HB3  LEU  75           HB1      LEU  75  33.929  -1.415  -7.562
  523    HG   LEU  75           HG       LEU  75  35.013  -1.882  -9.604
  524   HD11  LEU  75          HD11      LEU  75  35.786  -3.222  -7.740
  525   HD12  LEU  75          HD12      LEU  75  35.944  -4.107  -9.257
  526   HD13  LEU  75          HD13      LEU  75  34.626  -4.488  -8.150
  527   HD21  LEU  75          HD21      LEU  75  33.090  -2.489 -10.954
  528   HD22  LEU  75          HD22      LEU  75  32.953  -4.027 -10.104
  529   HD23  LEU  75          HD23      LEU  75  34.360  -3.703 -11.114
  530    HA   PRO  76           HA       PRO  76  30.883  -1.769  -3.600
  531    HB2  PRO  76           HB2      PRO  76  33.428  -0.200  -3.210
  532    HB3  PRO  76           HB1      PRO  76  32.441  -1.004  -1.980
  533    HG2  PRO  76           HG2      PRO  76  34.691  -2.135  -2.795
  534    HG3  PRO  76           HG1      PRO  76  33.206  -3.138  -2.582
  535    HD2  PRO  76           HD2      PRO  76  34.497  -2.153  -5.101
  536    HD3  PRO  76           HD1      PRO  76  33.684  -3.684  -4.771
  537    HA   PRO  77           HA       PRO  77  29.365   1.998  -5.405
  538    HB2  PRO  77           HB2      PRO  77  28.434   3.372  -3.246
  539    HB3  PRO  77           HB1      PRO  77  27.623   1.925  -3.868
  540    HG2  PRO  77           HG2      PRO  77  29.613   2.174  -1.648
  541    HG3  PRO  77           HG1      PRO  77  28.029   1.361  -1.614
  542    HD2  PRO  77           HD2      PRO  77  30.261  -0.090  -1.962
  543    HD3  PRO  77           HD1      PRO  77  28.784  -0.449  -2.933
  544    H    GLY  78           HN       GLY  78  30.340   3.833  -6.085
  545    HA2  GLY  78           HA2      GLY  78  31.678   5.760  -5.927
  546    HA3  GLY  78           HA1      GLY  78  32.182   5.252  -4.323
  547    H    TRP  79           HN       TRP  79  32.831   2.501  -5.500
  548    HA   TRP  79           HA       TRP  79  35.536   3.237  -6.405
  549    HB2  TRP  79           HB2      TRP  79  34.311   0.618  -5.485
  550    HB3  TRP  79           HB1      TRP  79  35.927   0.725  -6.159
  551    HD1  TRP  79           HD1      TRP  79  33.911   2.088  -3.140
  552    HE1  TRP  79           HE1      TRP  79  35.564   2.489  -1.207
  553    HE3  TRP  79           HE3      TRP  79  38.294   1.026  -5.571
  554    HZ2  TRP  79           HZ2      TRP  79  38.353   2.383  -0.778
  555    HZ3  TRP  79           HZ3      TRP  79  40.404   1.203  -4.329
  556    HH2  TRP  79           HH2      TRP  79  40.436   1.869  -1.980
  557    H    GLU  80           HN       GLU  80  36.365   2.690  -8.424
  558    HA   GLU  80           HA       GLU  80  34.621   1.233 -10.277
  559    HB2  GLU  80           HB2      GLU  80  34.297   3.602 -10.787
  560    HB3  GLU  80           HB1      GLU  80  36.028   3.872 -10.758
  561    HG2  GLU  80           HG2      GLU  80  35.345   3.866 -13.018
  562    HG3  GLU  80           HG1      GLU  80  36.242   2.378 -12.731
  563    H    MET  81           HN       MET  81  35.751   0.136 -11.949
  564    HA   MET  81           HA       MET  81  38.652  -0.125 -11.501
  565    HB2  MET  81           HB2      MET  81  37.265  -1.964 -10.415
  566    HB3  MET  81           HB1      MET  81  36.821  -2.477 -12.059
  567    HG2  MET  81           HG2      MET  81  39.679  -2.260 -11.145
  568    HG3  MET  81           HG1      MET  81  38.715  -3.711 -10.900
  569    HE1  MET  81           HE1      MET  81  37.891  -4.708 -14.625
  570    HE2  MET  81           HE2      MET  81  36.932  -3.647 -13.591
  571    HE3  MET  81           HE3      MET  81  37.647  -5.118 -12.929
  572    H    LYS  82           HN       LYS  82  39.808   0.068 -13.373
  573    HA   LYS  82           HA       LYS  82  38.635  -0.732 -15.896
  574    HB2  LYS  82           HB2      LYS  82  39.571   2.142 -15.547
  575    HB3  LYS  82           HB1      LYS  82  39.005   1.416 -17.034
  576    HG2  LYS  82           HG2      LYS  82  36.770   1.154 -16.075
  577    HG3  LYS  82           HG1      LYS  82  37.355   1.893 -14.554
  578    HD2  LYS  82           HD2      LYS  82  37.993   3.906 -15.933
  579    HD3  LYS  82           HD1      LYS  82  37.115   3.169 -17.278
  580    HE2  LYS  82           HE2      LYS  82  35.936   3.832 -14.576
  581    HE3  LYS  82           HE1      LYS  82  35.747   4.804 -16.034
  582    HZ1  LYS  82           HZ1      LYS  82  33.929   3.089 -15.342
  583    HZ2  LYS  82           HZ2      LYS  82  34.960   1.971 -16.086
  584    HZ3  LYS  82           HZ3      LYS  82  34.340   3.271 -16.979
  585    H    TYR  83           HN       TYR  83  40.280  -0.786 -17.624
  586    HA   TYR  83           HA       TYR  83  42.954  -1.238 -16.458
  587    HB2  TYR  83           HB2      TYR  83  41.743  -2.268 -19.066
  588    HB3  TYR  83           HB1      TYR  83  43.372  -2.672 -18.465
  589    HD1  TYR  83           HD1      TYR  83  43.615  -4.169 -16.519
  590    HD2  TYR  83           HD2      TYR  83  39.784  -3.330 -18.180
  591    HE1  TYR  83           HE1      TYR  83  42.676  -6.085 -15.304
  592    HE2  TYR  83           HE2      TYR  83  38.841  -5.248 -16.959
  593    HH   TYR  83           HH       TYR  83  39.506  -7.293 -15.930
  594    H    THR  84           HN       THR  84  44.811  -0.409 -17.506
  595    HA   THR  84           HA       THR  84  44.430   2.019 -19.005
  596    HB   THR  84           HB       THR  84  46.826   2.260 -18.980
  597    HG1  THR  84           HG1      THR  84  48.206   0.605 -18.592
  598   HG21  THR  84          HG21      THR  84  45.966   1.018 -16.373
  599   HG22  THR  84          HG22      THR  84  45.687   2.691 -16.858
  600   HG23  THR  84          HG23      THR  84  47.332   2.108 -16.614
  601    H    SER  85           HN       SER  85  46.288   2.127 -20.967
  602    HA   SER  85           HA       SER  85  45.063   0.800 -23.099
  603    HB2  SER  85           HB2      SER  85  47.700   1.483 -23.871
  604    HB3  SER  85           HB1      SER  85  46.219   2.394 -24.158
  605    HG   SER  85           HG       SER  85  48.250   2.851 -22.372
  606    H    GLU  86           HN       GLU  86  47.978  -0.027 -21.270
  607    HA   GLU  86           HA       GLU  86  48.500  -2.397 -22.935
  608    HB2  GLU  86           HB2      GLU  86  49.811  -1.322 -20.416
  609    HB3  GLU  86           HB1      GLU  86  50.326  -2.795 -21.228
  610    HG2  GLU  86           HG2      GLU  86  50.927  -1.556 -23.196
  611    HG3  GLU  86           HG1      GLU  86  50.260  -0.071 -22.509
  612    H    GLY  87           HN       GLY  87  46.147  -1.839 -20.856
  613    HA2  GLY  87           HA2      GLY  87  44.717  -3.318 -19.820
  614    HA3  GLY  87           HA1      GLY  87  45.841  -4.609 -20.210
  615    H    VAL  88           HN       VAL  88  46.937  -1.808 -18.429
  616    HA   VAL  88           HA       VAL  88  47.541  -3.500 -16.156
  617    HB   VAL  88           HB       VAL  88  48.096  -0.575 -16.674
  618   HG11  VAL  88          HG11      VAL  88  47.811  -0.905 -14.284
  619   HG12  VAL  88          HG12      VAL  88  49.509  -0.628 -14.668
  620   HG13  VAL  88          HG13      VAL  88  48.937  -2.260 -14.322
  621   HG21  VAL  88          HG21      VAL  88  49.865  -3.009 -16.646
  622   HG22  VAL  88          HG22      VAL  88  50.453  -1.352 -16.748
  623   HG23  VAL  88          HG23      VAL  88  49.446  -2.010 -18.037
  624    H    ARG  89           HN       ARG  89  46.577  -3.385 -14.168
  625    HA   ARG  89           HA       ARG  89  43.861  -2.391 -14.188
  626    HB2  ARG  89           HB2      ARG  89  44.673  -4.678 -13.346
  627    HB3  ARG  89           HB1      ARG  89  45.236  -3.818 -11.926
  628    HG2  ARG  89           HG2      ARG  89  42.960  -3.050 -11.478
  629    HG3  ARG  89           HG1      ARG  89  42.386  -3.937 -12.894
  630    HD2  ARG  89           HD2      ARG  89  43.280  -6.022 -11.869
  631    HD3  ARG  89           HD1      ARG  89  43.674  -5.088 -10.424
  632    HE   ARG  89           HE       ARG  89  40.924  -4.825 -11.176
  633   HH11  ARG  89          HH11      ARG  89  43.229  -6.858  -9.474
  634   HH12  ARG  89          HH12      ARG  89  41.999  -7.628  -8.505
  635   HH21  ARG  89          HH21      ARG  89  39.327  -5.839  -9.867
  636   HH22  ARG  89          HH22      ARG  89  39.795  -7.050  -8.714
  637    H    TYR  90           HN       TYR  90  43.273  -0.467 -13.394
  638    HA   TYR  90           HA       TYR  90  44.671   0.497 -11.011
  639    HB2  TYR  90           HB2      TYR  90  44.721   2.785 -11.771
  640    HB3  TYR  90           HB1      TYR  90  45.493   1.786 -12.984
  641    HD1  TYR  90           HD1      TYR  90  44.305   1.316 -15.137
  642    HD2  TYR  90           HD2      TYR  90  42.801   4.074 -12.273
  643    HE1  TYR  90           HE1      TYR  90  42.809   2.263 -16.842
  644    HE2  TYR  90           HE2      TYR  90  41.300   5.031 -13.965
  645    HH   TYR  90           HH       TYR  90  41.000   5.185 -16.295
  646    H    PHE  91           HN       PHE  91  43.271   1.968  -9.681
  647    HA   PHE  91           HA       PHE  91  40.429   1.407 -10.182
  648    HB2  PHE  91           HB2      PHE  91  42.007   1.413  -7.624
  649    HB3  PHE  91           HB1      PHE  91  40.277   1.709  -7.612
  650    HD1  PHE  91           HD1      PHE  91  38.777  -0.113  -7.536
  651    HD2  PHE  91           HD2      PHE  91  42.803  -0.739  -8.783
  652    HE1  PHE  91           HE1      PHE  91  38.386  -2.532  -7.568
  653    HE2  PHE  91           HE2      PHE  91  42.412  -3.167  -8.810
  654    HZ   PHE  91           HZ       PHE  91  40.120  -4.053  -8.143
  655    H    VAL  92           HN       VAL  92  38.921   2.999  -9.644
  656    HA   VAL  92           HA       VAL  92  40.054   5.723  -9.477
  657    HB   VAL  92           HB       VAL  92  37.423   4.863 -10.685
  658   HG11  VAL  92          HG11      VAL  92  37.334   7.146 -11.601
  659   HG12  VAL  92          HG12      VAL  92  38.776   7.551 -10.666
  660   HG13  VAL  92          HG13      VAL  92  37.282   7.115  -9.838
  661   HG21  VAL  92          HG21      VAL  92  39.939   5.748 -12.068
  662   HG22  VAL  92          HG22      VAL  92  38.413   5.327 -12.844
  663   HG23  VAL  92          HG23      VAL  92  39.341   4.092 -11.993
  664    H    ASP  93           HN       ASP  93  39.874   6.388  -7.409
  665    HA   ASP  93           HA       ASP  93  37.626   5.618  -5.712
  666    HB2  ASP  93           HB2      ASP  93  40.125   7.260  -5.328
  667    HB3  ASP  93           HB1      ASP  93  38.737   7.656  -4.322
  668    H    HIS  94           HN       HIS  94  35.711   6.494  -6.652
  669    HA   HIS  94           HA       HIS  94  35.646   9.198  -7.606
  670    HB2  HIS  94           HB2      HIS  94  33.434   7.226  -7.017
  671    HB3  HIS  94           HB1      HIS  94  33.126   8.861  -7.569
  672    HD1  HIS  94           HD1      HIS  94  33.832   9.481  -9.973
  673    HD2  HIS  94           HD2      HIS  94  34.259   5.441  -9.051
  674    HE1  HIS  94           HE1      HIS  94  34.052   8.298 -12.177
  675    HE2  HIS  94           HE2      HIS  94  34.094   5.851 -11.600
  676    H    ASN  95           HN       ASN  95  35.537   7.843  -4.523
  677    HA   ASN  95           HA       ASN  95  33.768   9.726  -3.291
  678    HB2  ASN  95           HB2      ASN  95  34.574   8.745  -1.145
  679    HB3  ASN  95           HB1      ASN  95  34.058   7.509  -2.291
  680   HD21  ASN  95          HD21      ASN  95  35.549   6.109  -3.148
  681   HD22  ASN  95          HD22      ASN  95  37.186   6.001  -2.581
  682    H    THR  96           HN       THR  96  37.267   9.490  -3.714
  683    HA   THR  96           HA       THR  96  37.520  12.133  -2.449
  684    HB   THR  96           HB       THR  96  40.047  11.426  -2.417
  685    HG1  THR  96           HG1      THR  96  38.939   8.846  -2.147
  686   HG21  THR  96          HG21      THR  96  39.753  10.421  -0.204
  687   HG22  THR  96          HG22      THR  96  38.038  10.177  -0.536
  688   HG23  THR  96          HG23      THR  96  38.688  11.810  -0.408
  689    H    ARG  97           HN       ARG  97  37.324  10.675  -5.342
  690    HA   ARG  97           HA       ARG  97  37.739  11.233  -7.498
  691    HB2  ARG  97           HB2      ARG  97  38.218  13.962  -6.308
  692    HB3  ARG  97           HB1      ARG  97  38.093  13.624  -8.033
  693    HG2  ARG  97           HG2      ARG  97  35.849  12.686  -7.632
  694    HG3  ARG  97           HG1      ARG  97  35.967  13.214  -5.950
  695    HD2  ARG  97           HD2      ARG  97  35.975  14.951  -8.421
  696    HD3  ARG  97           HD1      ARG  97  34.745  14.890  -7.157
  697    HE   ARG  97           HE       ARG  97  37.347  15.591  -6.161
  698   HH11  ARG  97          HH11      ARG  97  34.400  16.853  -7.580
  699   HH12  ARG  97          HH12      ARG  97  34.688  18.483  -7.047
  700   HH21  ARG  97          HH21      ARG  97  37.744  17.704  -5.481
  701   HH22  ARG  97          HH22      ARG  97  36.616  18.974  -5.859
  702    H    THR  98           HN       THR  98  39.487   9.791  -7.283
  703    HA   THR  98           HA       THR  98  41.960  10.954  -8.224
  704    HB   THR  98           HB       THR  98  42.148  11.161  -5.706
  705    HG1  THR  98           HG1      THR  98  44.287  10.177  -5.706
  706   HG21  THR  98          HG21      THR  98  40.966   9.093  -5.079
  707   HG22  THR  98          HG22      THR  98  42.602   9.114  -4.412
  708   HG23  THR  98          HG23      THR  98  42.239   8.134  -5.833
  709    H    THR  99           HN       THR  99  43.659   9.082  -8.322
  710    HA   THR  99           HA       THR  99  42.293   6.575  -9.100
  711    HB   THR  99           HB       THR  99  44.286   6.374 -10.782
  712    HG1  THR  99           HG1      THR  99  44.221   9.181 -10.892
  713   HG21  THR  99          HG21      THR  99  42.046   8.395 -11.236
  714   HG22  THR  99          HG22      THR  99  41.975   6.666 -11.587
  715   HG23  THR  99          HG23      THR  99  43.048   7.716 -12.515
  716    H    THR 100           HN       THR 100  43.455   4.633  -8.555
  717    HA   THR 100           HA       THR 100  46.013   4.921  -7.216
  718    HB   THR 100           HB       THR 100  44.392   5.382  -5.428
  719    HG1  THR 100           HG1      THR 100  45.791   4.393  -4.214
  720   HG21  THR 100          HG21      THR 100  43.383   2.587  -5.972
  721   HG22  THR 100          HG22      THR 100  42.486   4.082  -6.252
  722   HG23  THR 100          HG23      THR 100  42.905   3.598  -4.608
  723    H    PHE 101           HN       PHE 101  46.991   2.871  -6.684
  724    HA   PHE 101           HA       PHE 101  46.044   0.717  -8.449
  725    HB2  PHE 101           HB2      PHE 101  48.815   1.608  -7.625
  726    HB3  PHE 101           HB1      PHE 101  48.502  -0.059  -8.265
  727    HD1  PHE 101           HD1      PHE 101  48.195  -0.419 -10.564
  728    HD2  PHE 101           HD2      PHE 101  48.353   3.569  -9.086
  729    HE1  PHE 101           HE1      PHE 101  48.341   0.417 -12.863
  730    HE2  PHE 101           HE2      PHE 101  48.507   4.416 -11.396
  731    HZ   PHE 101           HZ       PHE 101  48.503   2.842 -13.287
  732    H    LYS 102           HN       LYS 102  44.877  -0.597  -7.145
  733    HA   LYS 102           HA       LYS 102  46.325  -1.758  -4.882
  734    HB2  LYS 102           HB2      LYS 102  43.405  -1.002  -4.860
  735    HB3  LYS 102           HB1      LYS 102  44.224  -1.912  -3.611
  736    HG2  LYS 102           HG2      LYS 102  45.709   0.041  -3.225
  737    HG3  LYS 102           HG1      LYS 102  44.735   0.947  -4.381
  738    HD2  LYS 102           HD2      LYS 102  44.087   1.349  -2.018
  739    HD3  LYS 102           HD1      LYS 102  42.771   0.705  -3.007
  740    HE2  LYS 102           HE2      LYS 102  42.800  -0.440  -0.891
  741    HE3  LYS 102           HE1      LYS 102  43.288  -1.549  -2.170
  742    HZ1  LYS 102           HZ1      LYS 102  45.132  -0.128  -0.327
  743    HZ2  LYS 102           HZ2      LYS 102  45.593  -1.237  -1.528
  744    HZ3  LYS 102           HZ3      LYS 102  44.683  -1.755  -0.192
  745    H    ASP 103           HN       ASP 103  46.842  -3.612  -5.940
  746    HA   ASP 103           HA       ASP 103  44.562  -5.311  -6.713
  747    HB2  ASP 103           HB2      ASP 103  45.997  -4.662  -8.674
  748    HB3  ASP 103           HB1      ASP 103  47.352  -5.478  -7.900
  749    HA   PRO 104           HA       PRO 104  45.857  -7.906  -3.394
  750    HB2  PRO 104           HB2      PRO 104  44.929 -10.318  -4.381
  751    HB3  PRO 104           HB1      PRO 104  43.896  -9.127  -3.579
  752    HG2  PRO 104           HG2      PRO 104  44.331  -9.603  -6.505
  753    HG3  PRO 104           HG1      PRO 104  42.825  -9.259  -5.633
  754    HD2  PRO 104           HD2      PRO 104  44.078  -7.358  -7.025
  755    HD3  PRO 104           HD1      PRO 104  43.289  -6.990  -5.475
  756    H    ARG 105           HN       ARG 105  47.011  -8.351  -6.631
  757    HA   ARG 105           HA       ARG 105  48.932 -10.385  -5.750
  758    HB2  ARG 105           HB2      ARG 105  48.028  -9.398  -8.424
  759    HB3  ARG 105           HB1      ARG 105  49.616 -10.126  -8.288
  760    HG2  ARG 105           HG2      ARG 105  47.951 -11.736  -9.025
  761    HG3  ARG 105           HG1      ARG 105  48.636 -12.188  -7.460
  762    HD2  ARG 105           HD2      ARG 105  46.644 -11.241  -6.357
  763    HD3  ARG 105           HD1      ARG 105  45.967 -10.862  -7.941
  764    HE   ARG 105           HE       ARG 105  46.437 -13.501  -8.136
  765   HH11  ARG 105          HH11      ARG 105  44.793 -11.596  -5.694
  766   HH12  ARG 105          HH12      ARG 105  43.712 -12.877  -5.240
  767   HH21  ARG 105          HH21      ARG 105  45.023 -15.179  -7.544
  768   HH22  ARG 105          HH22      ARG 105  43.822 -14.909  -6.315
  769    HA   PRO 106           HA       PRO 106  51.698  -6.810  -5.366
  770    HB2  PRO 106           HB2      PRO 106  53.585  -7.955  -3.795
  771    HB3  PRO 106           HB1      PRO 106  52.002  -7.392  -3.141
  772    HG2  PRO 106           HG2      PRO 106  52.938 -10.158  -3.792
  773    HG3  PRO 106           HG1      PRO 106  51.895  -9.595  -2.475
  774    HD2  PRO 106           HD2      PRO 106  51.028 -10.803  -4.827
  775    HD3  PRO 106           HD1      PRO 106  50.009  -9.803  -3.734
  776    H    GLY 107           HN       GLY 107  52.933  -6.320  -7.053
  777    HA2  GLY 107           HA2      GLY 107  54.708  -6.400  -8.524
  778    HA3  GLY 107           HA1      GLY 107  55.234  -7.923  -7.768
  779    H    PHE 108           HN       PHE 108  52.529  -9.113  -8.188
  780    HA   PHE 108           HA       PHE 108  51.366 -10.374  -9.742
  781    HB2  PHE 108           HB2      PHE 108  51.436  -7.922 -10.872
  782    HB3  PHE 108           HB1      PHE 108  52.411  -8.829 -12.081
  783    HD1  PHE 108           HD1      PHE 108  49.101  -8.627 -10.412
  784    HD2  PHE 108           HD2      PHE 108  51.386 -10.311 -13.599
  785    HE1  PHE 108           HE1      PHE 108  47.041  -9.440 -11.465
  786    HE2  PHE 108           HE2      PHE 108  49.316 -11.127 -14.652
  787    HZ   PHE 108           HZ       PHE 108  47.140 -10.685 -13.586
  788    H    GLU 109           HN       GLU 109  54.507 -10.362  -9.345
  789    HA   GLU 109           HA       GLU 109  54.971 -12.826 -10.685
  790    HB2  GLU 109           HB2      GLU 109  55.283 -11.317 -12.600
  791    HB3  GLU 109           HB1      GLU 109  56.437 -10.370 -11.675
  792    HG2  GLU 109           HG2      GLU 109  57.567 -11.806 -13.250
  793    HG3  GLU 109           HG1      GLU 109  57.954 -12.282 -11.600
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1 -38.641   7.226  -4.680
    2    H2   GLY   1           HT2      GLY   1 -39.187   6.579  -6.151
    3    H3   GLY   1           HT3      GLY   1 -38.262   5.629  -5.096
    4    HA2  GLY   1           HA1      GLY   1 -40.971   6.685  -4.504
    5    HA3  GLY   1           HA2      GLY   1 -40.621   5.036  -5.007
    6    H    SER   2           HN       SER   2 -40.481   7.356  -2.426
    7    HA   SER   2           HA       SER   2 -40.336   7.145  -0.171
    8    HB2  SER   2           HB2      SER   2 -41.747   5.161  -0.328
    9    HB3  SER   2           HB1      SER   2 -40.349   4.168  -0.733
   10    HG   SER   2           HG       SER   2 -41.190   5.164   1.722
   11    H    HIS   3           HN       HIS   3 -38.258   4.630  -1.622
   12    HA   HIS   3           HA       HIS   3 -36.024   5.655   0.009
   13    HB2  HIS   3           HB2      HIS   3 -36.412   2.891  -1.175
   14    HB3  HIS   3           HB1      HIS   3 -34.974   3.429  -0.323
   15    HD1  HIS   3           HD1      HIS   3 -34.915   2.890   2.085
   16    HD2  HIS   3           HD2      HIS   3 -38.801   2.946   0.614
   17    HE1  HIS   3           HE1      HIS   3 -36.361   2.103   3.976
   18    HE2  HIS   3           HE2      HIS   3 -38.664   1.896   2.970
   19    H    MET   4           HN       MET   4 -33.862   5.295  -1.070
   20    HA   MET   4           HA       MET   4 -34.010   5.471  -3.995
   21    HB2  MET   4           HB2      MET   4 -32.084   7.104  -3.877
   22    HB3  MET   4           HB1      MET   4 -33.621   7.734  -3.308
   23    HG2  MET   4           HG2      MET   4 -32.902   7.321  -0.989
   24    HG3  MET   4           HG1      MET   4 -31.336   6.784  -1.593
   25    HE1  MET   4           HE1      MET   4 -33.510   9.657  -3.094
   26    HE2  MET   4           HE2      MET   4 -32.927  11.071  -2.215
   27    HE3  MET   4           HE3      MET   4 -33.840   9.822  -1.368
   28    H    GLN   5           HN       GLN   5 -32.490   4.242  -5.036
   29    HA   GLN   5           HA       GLN   5 -31.365   2.139  -3.495
   30    HB2  GLN   5           HB2      GLN   5 -32.233   1.752  -5.755
   31    HB3  GLN   5           HB1      GLN   5 -30.992   2.807  -6.421
   32    HG2  GLN   5           HG2      GLN   5 -29.272   1.256  -5.554
   33    HG3  GLN   5           HG1      GLN   5 -30.561   0.170  -5.040
   34   HE21  GLN   5          HE21      GLN   5 -31.759  -0.923  -6.567
   35   HE22  GLN   5          HE22      GLN   5 -31.217  -1.096  -8.228
   36    H    TYR   6           HN       TYR   6 -29.398   1.819  -2.753
   37    HA   TYR   6           HA       TYR   6 -27.194   3.473  -3.780
   38    HB2  TYR   6           HB2      TYR   6 -27.972   2.972  -0.915
   39    HB3  TYR   6           HB1      TYR   6 -26.266   3.165  -1.301
   40    HD1  TYR   6           HD1      TYR   6 -25.461   5.329  -2.211
   41    HD2  TYR   6           HD2      TYR   6 -29.474   4.823  -0.897
   42    HE1  TYR   6           HE1      TYR   6 -25.732   7.776  -2.112
   43    HE2  TYR   6           HE2      TYR   6 -29.757   7.262  -0.791
   44    HH   TYR   6           HH       TYR   6 -27.520   9.429  -2.176
   45    H    LYS   7           HN       LYS   7 -25.215   2.366  -3.976
   46    HA   LYS   7           HA       LYS   7 -25.270  -0.468  -3.245
   47    HB2  LYS   7           HB2      LYS   7 -24.054  -0.920  -5.468
   48    HB3  LYS   7           HB1      LYS   7 -25.813  -0.645  -5.535
   49    HG2  LYS   7           HG2      LYS   7 -25.524   1.531  -6.388
   50    HG3  LYS   7           HG1      LYS   7 -23.795   1.534  -6.037
   51    HD2  LYS   7           HD2      LYS   7 -24.192   1.180  -8.416
   52    HD3  LYS   7           HD1      LYS   7 -23.464  -0.253  -7.690
   53    HE2  LYS   7           HE2      LYS   7 -25.199  -0.971  -9.168
   54    HE3  LYS   7           HE1      LYS   7 -25.754  -1.234  -7.516
   55    HZ1  LYS   7           HZ1      LYS   7 -26.493   1.085  -9.226
   56    HZ2  LYS   7           HZ2      LYS   7 -27.076   0.774  -7.665
   57    HZ3  LYS   7           HZ3      LYS   7 -27.474  -0.268  -8.940
   58    H    LEU   8           HN       LEU   8 -23.246  -1.500  -3.139
   59    HA   LEU   8           HA       LEU   8 -20.919   0.298  -2.868
   60    HB2  LEU   8           HB2      LEU   8 -21.845  -0.159  -0.585
   61    HB3  LEU   8           HB1      LEU   8 -21.724  -1.865  -0.915
   62    HG   LEU   8           HG       LEU   8 -19.196  -1.348  -1.301
   63   HD11  LEU   8          HD11      LEU   8 -19.988   0.907   0.535
   64   HD12  LEU   8          HD12      LEU   8 -19.372   1.079  -1.109
   65   HD13  LEU   8          HD13      LEU   8 -18.342   0.403   0.150
   66   HD21  LEU   8          HD21      LEU   8 -18.871  -1.670   1.170
   67   HD22  LEU   8          HD22      LEU   8 -19.884  -2.850   0.339
   68   HD23  LEU   8          HD23      LEU   8 -20.626  -1.577   1.300
   69    H    ILE   9           HN       ILE   9 -19.043  -0.544  -3.609
   70    HA   ILE   9           HA       ILE   9 -19.128  -3.326  -4.577
   71    HB   ILE   9           HB       ILE   9 -17.694  -0.956  -5.826
   72   HG12  ILE   9          HG12      ILE   9 -19.823  -2.809  -6.996
   73   HG13  ILE   9          HG11      ILE   9 -20.177  -1.164  -6.346
   74   HG21  ILE   9          HG21      ILE   9 -16.271  -2.918  -5.904
   75   HG22  ILE   9          HG22      ILE   9 -16.900  -2.556  -7.513
   76   HG23  ILE   9          HG23      ILE   9 -17.595  -3.877  -6.573
   77   HD11  ILE   9          HD11      ILE   9 -19.994  -1.136  -8.769
   78   HD12  ILE   9          HD12      ILE   9 -18.378  -1.838  -8.690
   79   HD13  ILE   9          HD13      ILE   9 -18.671  -0.221  -8.046
   80    H    LEU  10           HN       LEU  10 -17.684  -4.620  -3.621
   81    HA   LEU  10           HA       LEU  10 -15.684  -3.356  -1.915
   82    HB2  LEU  10           HB2      LEU  10 -16.428  -6.273  -2.092
   83    HB3  LEU  10           HB1      LEU  10 -15.250  -5.595  -1.005
   84    HG   LEU  10           HG       LEU  10 -17.060  -5.919   0.365
   85   HD11  LEU  10          HD11      LEU  10 -16.255  -3.597   0.484
   86   HD12  LEU  10          HD12      LEU  10 -17.910  -3.840   1.038
   87   HD13  LEU  10          HD13      LEU  10 -17.612  -3.128  -0.547
   88   HD21  LEU  10          HD21      LEU  10 -18.957  -4.822  -1.705
   89   HD22  LEU  10          HD22      LEU  10 -19.370  -5.589  -0.174
   90   HD23  LEU  10          HD23      LEU  10 -18.631  -6.539  -1.460
   91    H    ASN  11           HN       ASN  11 -13.899  -2.873  -2.869
   92    HA   ASN  11           HA       ASN  11 -12.827  -4.660  -4.952
   93    HB2  ASN  11           HB2      ASN  11 -12.313  -1.763  -4.273
   94    HB3  ASN  11           HB1      ASN  11 -11.187  -2.691  -5.240
   95   HD21  ASN  11          HD21      ASN  11 -11.517  -2.831  -7.326
   96   HD22  ASN  11          HD22      ASN  11 -12.899  -2.207  -8.136
   97    H    GLY  12           HN       GLY  12 -12.091  -6.209  -3.402
   98    HA2  GLY  12           HA2      GLY  12  -9.464  -5.464  -2.400
   99    HA3  GLY  12           HA1      GLY  12 -10.629  -5.988  -1.181
  100    H    LYS  13           HN       LYS  13  -8.102  -7.130  -2.256
  101    HA   LYS  13           HA       LYS  13  -8.356  -9.368  -3.812
  102    HB2  LYS  13           HB2      LYS  13  -6.527  -8.973  -1.432
  103    HB3  LYS  13           HB1      LYS  13  -6.302 -10.161  -2.711
  104    HG2  LYS  13           HG2      LYS  13  -5.820  -8.524  -4.310
  105    HG3  LYS  13           HG1      LYS  13  -6.485  -7.229  -3.315
  106    HD2  LYS  13           HD2      LYS  13  -4.074  -7.096  -3.298
  107    HD3  LYS  13           HD1      LYS  13  -4.646  -7.576  -1.701
  108    HE2  LYS  13           HE2      LYS  13  -2.739  -8.905  -2.240
  109    HE3  LYS  13           HE1      LYS  13  -4.166  -9.935  -2.307
  110    HZ1  LYS  13           HZ1      LYS  13  -2.828  -8.709  -4.662
  111    HZ2  LYS  13           HZ2      LYS  13  -4.167  -9.753  -4.701
  112    HZ3  LYS  13           HZ3      LYS  13  -2.663 -10.324  -4.167
  113    H    THR  14           HN       THR  14  -9.309  -8.970  -0.472
  114    HA   THR  14           HA       THR  14  -9.623 -11.859  -0.105
  115    HB   THR  14           HB       THR  14 -10.259  -9.593   1.798
  116    HG1  THR  14           HG1      THR  14  -8.100  -9.528   1.684
  117   HG21  THR  14          HG21      THR  14 -10.221 -11.331   3.529
  118   HG22  THR  14          HG22      THR  14  -9.943 -12.559   2.297
  119   HG23  THR  14          HG23      THR  14 -11.467 -11.671   2.326
  120    H    LEU  15           HN       LEU  15 -11.535  -9.101  -0.966
  121    HA   LEU  15           HA       LEU  15 -13.931 -10.721  -1.121
  122    HB2  LEU  15           HB2      LEU  15 -13.516  -8.964   1.063
  123    HB3  LEU  15           HB1      LEU  15 -14.707  -8.210   0.032
  124    HG   LEU  15           HG       LEU  15 -15.946  -9.417   1.601
  125   HD11  LEU  15          HD11      LEU  15 -17.002 -11.226   0.321
  126   HD12  LEU  15          HD12      LEU  15 -15.688 -11.119  -0.851
  127   HD13  LEU  15          HD13      LEU  15 -16.774  -9.752  -0.619
  128   HD21  LEU  15          HD21      LEU  15 -15.533 -11.713   2.243
  129   HD22  LEU  15          HD22      LEU  15 -14.086 -10.740   2.508
  130   HD23  LEU  15          HD23      LEU  15 -14.184 -11.809   1.109
  131    H    LYS  16           HN       LYS  16 -14.142 -10.431  -3.299
  132    HA   LYS  16           HA       LYS  16 -14.463  -7.631  -4.185
  133    HB2  LYS  16           HB2      LYS  16 -13.942  -9.992  -6.004
  134    HB3  LYS  16           HB1      LYS  16 -13.923  -8.295  -6.437
  135    HG2  LYS  16           HG2      LYS  16 -11.735  -8.343  -6.179
  136    HG3  LYS  16           HG1      LYS  16 -11.942  -8.590  -4.434
  137    HD2  LYS  16           HD2      LYS  16 -12.149 -11.033  -4.929
  138    HD3  LYS  16           HD1      LYS  16 -11.761 -10.645  -6.606
  139    HE2  LYS  16           HE2      LYS  16  -9.606  -9.823  -5.990
  140    HE3  LYS  16           HE1      LYS  16  -9.984 -10.009  -4.275
  141    HZ1  LYS  16           HZ1      LYS  16  -9.959 -12.340  -4.469
  142    HZ2  LYS  16           HZ2      LYS  16  -8.588 -11.815  -5.315
  143    HZ3  LYS  16           HZ3      LYS  16  -9.972 -12.299  -6.161
  144    H    GLY  17           HN       GLY  17 -16.466  -7.053  -4.659
  145    HA2  GLY  17           HA2      GLY  17 -18.443  -8.521  -5.928
  146    HA3  GLY  17           HA1      GLY  17 -18.641  -8.832  -4.205
  147    H    GLU  18           HN       GLU  18 -20.739  -7.799  -4.725
  148    HA   GLU  18           HA       GLU  18 -20.678  -5.080  -3.859
  149    HB2  GLU  18           HB2      GLU  18 -21.866  -4.161  -5.846
  150    HB3  GLU  18           HB1      GLU  18 -20.213  -4.644  -6.194
  151    HG2  GLU  18           HG2      GLU  18 -22.364  -6.615  -6.682
  152    HG3  GLU  18           HG1      GLU  18 -22.228  -5.249  -7.792
  153    H    THR  19           HN       THR  19 -22.800  -4.254  -3.418
  154    HA   THR  19           HA       THR  19 -25.052  -6.050  -3.695
  155    HB   THR  19           HB       THR  19 -23.918  -6.835  -1.603
  156    HG1  THR  19           HG1      THR  19 -25.869  -6.812  -0.398
  157   HG21  THR  19          HG21      THR  19 -23.001  -4.725  -0.764
  158   HG22  THR  19          HG22      THR  19 -24.132  -5.380   0.422
  159   HG23  THR  19          HG23      THR  19 -24.627  -4.049  -0.622
  160    H    THR  20           HN       THR  20 -27.019  -4.948  -2.508
  161    HA   THR  20           HA       THR  20 -26.805  -2.044  -2.835
  162    HB   THR  20           HB       THR  20 -29.102  -2.127  -3.922
  163    HG1  THR  20           HG1      THR  20 -29.882  -4.125  -3.814
  164   HG21  THR  20          HG21      THR  20 -27.142  -1.587  -5.266
  165   HG22  THR  20          HG22      THR  20 -28.202  -2.655  -6.185
  166   HG23  THR  20          HG23      THR  20 -26.745  -3.299  -5.427
  167    H    THR  21           HN       THR  21 -28.497  -0.814  -1.845
  168    HA   THR  21           HA       THR  21 -30.326  -2.185  -0.069
  169    HB   THR  21           HB       THR  21 -28.173  -1.884   1.280
  170    HG1  THR  21           HG1      THR  21 -29.362  -1.406   3.092
  171   HG21  THR  21          HG21      THR  21 -27.848   0.409   2.258
  172   HG22  THR  21          HG22      THR  21 -29.010   1.034   1.087
  173   HG23  THR  21          HG23      THR  21 -27.481   0.348   0.533
  174    H    GLU  22           HN       GLU  22 -32.063  -0.840   0.590
  175    HA   GLU  22           HA       GLU  22 -32.368   1.525  -1.125
  176    HB2  GLU  22           HB2      GLU  22 -34.404  -0.038   0.487
  177    HB3  GLU  22           HB1      GLU  22 -34.769   1.324  -0.563
  178    HG2  GLU  22           HG2      GLU  22 -33.479  -1.229  -1.517
  179    HG3  GLU  22           HG1      GLU  22 -35.250  -0.919  -1.546
  180    H    ALA  23           HN       ALA  23 -31.662   3.370  -0.127
  181    HA   ALA  23           HA       ALA  23 -32.176   3.582   2.796
  182    HB1  ALA  23           HB1      ALA  23 -30.266   5.036   3.003
  183    HB2  ALA  23           HB2      ALA  23 -30.040   5.082   1.258
  184    HB3  ALA  23           HB3      ALA  23 -29.756   3.581   2.143
  185    H    VAL  24           HN       VAL  24 -32.781   5.736   3.602
  186    HA   VAL  24           HA       VAL  24 -34.247   7.289   1.587
  187    HB   VAL  24           HB       VAL  24 -35.499   8.241   3.499
  188   HG11  VAL  24          HG11      VAL  24 -36.753   6.177   4.052
  189   HG12  VAL  24          HG12      VAL  24 -35.465   5.235   3.300
  190   HG13  VAL  24          HG13      VAL  24 -36.422   6.350   2.328
  191   HG21  VAL  24          HG21      VAL  24 -33.930   6.245   5.130
  192   HG22  VAL  24          HG22      VAL  24 -35.295   7.197   5.712
  193   HG23  VAL  24          HG23      VAL  24 -33.801   8.002   5.230
  194    H    ASP  25           HN       ASP  25 -31.289   7.419   2.731
  195    HA   ASP  25           HA       ASP  25 -31.018  10.239   2.438
  196    HB2  ASP  25           HB2      ASP  25 -31.597   9.529   5.010
  197    HB3  ASP  25           HB1      ASP  25 -29.840   9.426   5.025
  198    H    ALA  26           HN       ALA  26 -28.615  10.828   2.728
  199    HA   ALA  26           HA       ALA  26 -27.159   8.847   1.232
  200    HB1  ALA  26           HB1      ALA  26 -26.212  11.538   2.215
  201    HB2  ALA  26           HB2      ALA  26 -27.038  11.251   0.684
  202    HB3  ALA  26           HB3      ALA  26 -25.451  10.538   0.975
  203    H    ALA  27           HN       ALA  27 -26.469  10.601   4.271
  204    HA   ALA  27           HA       ALA  27 -24.174   9.146   4.948
  205    HB1  ALA  27           HB1      ALA  27 -24.761  11.293   5.967
  206    HB2  ALA  27           HB2      ALA  27 -24.444  10.059   7.188
  207    HB3  ALA  27           HB3      ALA  27 -26.103  10.521   6.813
  208    H    THR  28           HN       THR  28 -27.516   8.343   5.296
  209    HA   THR  28           HA       THR  28 -27.281   6.388   7.334
  210    HB   THR  28           HB       THR  28 -29.352   6.399   5.127
  211    HG1  THR  28           HG1      THR  28 -29.800   7.662   7.601
  212   HG21  THR  28          HG21      THR  28 -29.470   5.489   8.013
  213   HG22  THR  28          HG22      THR  28 -29.329   4.421   6.616
  214   HG23  THR  28          HG23      THR  28 -30.784   5.394   6.841
  215    H    ALA  29           HN       ALA  29 -26.569   6.348   3.926
  216    HA   ALA  29           HA       ALA  29 -26.714   3.484   3.625
  217    HB1  ALA  29           HB1      ALA  29 -25.812   3.852   1.415
  218    HB2  ALA  29           HB2      ALA  29 -25.383   5.511   1.827
  219    HB3  ALA  29           HB3      ALA  29 -27.080   5.038   1.730
  220    H    GLU  30           HN       GLU  30 -24.287   5.907   4.275
  221    HA   GLU  30           HA       GLU  30 -21.972   4.326   4.044
  222    HB2  GLU  30           HB2      GLU  30 -22.251   6.910   4.365
  223    HB3  GLU  30           HB1      GLU  30 -22.269   6.517   6.076
  224    HG2  GLU  30           HG2      GLU  30 -20.074   5.245   5.578
  225    HG3  GLU  30           HG1      GLU  30 -20.046   6.238   4.120
  226    H    LYS  31           HN       LYS  31 -23.694   5.345   6.967
  227    HA   LYS  31           HA       LYS  31 -22.347   3.967   8.876
  228    HB2  LYS  31           HB2      LYS  31 -25.329   4.423   8.849
  229    HB3  LYS  31           HB1      LYS  31 -24.337   4.129  10.267
  230    HG2  LYS  31           HG2      LYS  31 -24.110   6.518   8.444
  231    HG3  LYS  31           HG1      LYS  31 -24.923   6.490  10.010
  232    HD2  LYS  31           HD2      LYS  31 -22.002   5.854   9.591
  233    HD3  LYS  31           HD1      LYS  31 -22.615   7.433  10.078
  234    HE2  LYS  31           HE2      LYS  31 -22.988   4.855  11.601
  235    HE3  LYS  31           HE1      LYS  31 -21.819   6.114  11.993
  236    HZ1  LYS  31           HZ1      LYS  31 -24.771   6.443  11.978
  237    HZ2  LYS  31           HZ2      LYS  31 -23.651   7.657  12.344
  238    HZ3  LYS  31           HZ3      LYS  31 -23.800   6.302  13.356
  239    H    VAL  32           HN       VAL  32 -24.975   2.648   6.879
  240    HA   VAL  32           HA       VAL  32 -25.090   0.200   8.386
  241    HB   VAL  32           HB       VAL  32 -26.263   0.851   5.672
  242   HG11  VAL  32          HG11      VAL  32 -26.915  -1.426   7.538
  243   HG12  VAL  32          HG12      VAL  32 -25.971  -1.564   6.056
  244   HG13  VAL  32          HG13      VAL  32 -27.671  -1.096   5.978
  245   HG21  VAL  32          HG21      VAL  32 -28.369   1.128   6.899
  246   HG22  VAL  32          HG22      VAL  32 -27.147   2.292   7.411
  247   HG23  VAL  32          HG23      VAL  32 -27.506   0.889   8.419
  248    H    PHE  33           HN       PHE  33 -23.872   1.071   5.146
  249    HA   PHE  33           HA       PHE  33 -22.917  -1.519   4.532
  250    HB2  PHE  33           HB2      PHE  33 -22.398   1.204   3.422
  251    HB3  PHE  33           HB1      PHE  33 -21.358  -0.120   2.948
  252    HD1  PHE  33           HD1      PHE  33 -23.587   1.698   1.485
  253    HD2  PHE  33           HD2      PHE  33 -23.337  -2.340   2.818
  254    HE1  PHE  33           HE1      PHE  33 -25.212   1.035  -0.238
  255    HE2  PHE  33           HE2      PHE  33 -24.961  -3.011   1.089
  256    HZ   PHE  33           HZ       PHE  33 -25.905  -1.329  -0.446
  257    H    LYS  34           HN       LYS  34 -21.620   0.975   6.543
  258    HA   LYS  34           HA       LYS  34 -18.899   0.166   6.399
  259    HB2  LYS  34           HB2      LYS  34 -20.484   1.818   8.358
  260    HB3  LYS  34           HB1      LYS  34 -18.796   1.478   8.628
  261    HG2  LYS  34           HG2      LYS  34 -18.507   2.419   6.209
  262    HG3  LYS  34           HG1      LYS  34 -20.077   3.160   6.532
  263    HD2  LYS  34           HD2      LYS  34 -18.432   4.767   7.168
  264    HD3  LYS  34           HD1      LYS  34 -19.105   4.085   8.645
  265    HE2  LYS  34           HE2      LYS  34 -17.190   2.542   8.780
  266    HE3  LYS  34           HE1      LYS  34 -16.496   3.322   7.357
  267    HZ1  LYS  34           HZ1      LYS  34 -16.530   5.429   8.622
  268    HZ2  LYS  34           HZ2      LYS  34 -15.518   4.256   9.306
  269    HZ3  LYS  34           HZ3      LYS  34 -17.031   4.569   9.997
  270    H    GLN  35           HN       GLN  35 -21.584  -0.563   8.562
  271    HA   GLN  35           HA       GLN  35 -20.207  -2.348  10.245
  272    HB2  GLN  35           HB2      GLN  35 -22.320  -1.540  11.012
  273    HB3  GLN  35           HB1      GLN  35 -23.123  -1.985   9.536
  274    HG2  GLN  35           HG2      GLN  35 -22.289  -4.411  10.425
  275    HG3  GLN  35           HG1      GLN  35 -22.626  -3.534  11.912
  276   HE21  GLN  35          HE21      GLN  35 -24.708  -2.943  12.412
  277   HE22  GLN  35          HE22      GLN  35 -26.084  -3.523  11.527
  278    H    TYR  36           HN       TYR  36 -21.788  -2.623   7.158
  279    HA   TYR  36           HA       TYR  36 -21.837  -5.432   6.882
  280    HB2  TYR  36           HB2      TYR  36 -23.225  -4.155   5.451
  281    HB3  TYR  36           HB1      TYR  36 -21.908  -3.093   4.993
  282    HD1  TYR  36           HD1      TYR  36 -20.887  -3.377   3.005
  283    HD2  TYR  36           HD2      TYR  36 -22.965  -6.675   4.666
  284    HE1  TYR  36           HE1      TYR  36 -20.509  -4.623   0.927
  285    HE2  TYR  36           HE2      TYR  36 -22.584  -7.964   2.603
  286    HH   TYR  36           HH       TYR  36 -20.387  -6.987   0.206
  287    H    ALA  37           HN       ALA  37 -19.553  -2.990   5.619
  288    HA   ALA  37           HA       ALA  37 -17.740  -4.874   4.520
  289    HB1  ALA  37           HB1      ALA  37 -16.206  -2.994   4.312
  290    HB2  ALA  37           HB2      ALA  37 -17.217  -2.033   5.390
  291    HB3  ALA  37           HB3      ALA  37 -17.832  -2.526   3.815
  292    H    ASN  38           HN       ASN  38 -18.126  -3.449   7.665
  293    HA   ASN  38           HA       ASN  38 -15.594  -4.071   8.751
  294    HB2  ASN  38           HB2      ASN  38 -17.191  -2.459   9.791
  295    HB3  ASN  38           HB1      ASN  38 -18.246  -3.807  10.221
  296   HD21  ASN  38          HD21      ASN  38 -17.713  -5.123  11.962
  297   HD22  ASN  38          HD22      ASN  38 -16.382  -4.738  13.080
  298    H    ASP  39           HN       ASP  39 -18.397  -6.003   8.163
  299    HA   ASP  39           HA       ASP  39 -17.649  -8.118   9.958
  300    HB2  ASP  39           HB2      ASP  39 -19.924  -7.546   8.220
  301    HB3  ASP  39           HB1      ASP  39 -19.467  -9.247   8.231
  302    H    ASN  40           HN       ASN  40 -17.058  -7.412   6.564
  303    HA   ASN  40           HA       ASN  40 -16.066 -10.136   6.205
  304    HB2  ASN  40           HB2      ASN  40 -15.606  -9.236   3.794
  305    HB3  ASN  40           HB1      ASN  40 -17.235  -9.679   4.272
  306   HD21  ASN  40          HD21      ASN  40 -18.811  -8.146   4.353
  307   HD22  ASN  40          HD22      ASN  40 -18.545  -6.475   3.842
  308    H    GLY  41           HN       GLY  41 -14.964  -7.208   7.242
  309    HA2  GLY  41           HA2      GLY  41 -12.848  -6.675   7.989
  310    HA3  GLY  41           HA1      GLY  41 -12.266  -8.180   7.302
  311    H    VAL  42           HN       VAL  42 -13.962  -5.715   5.440
  312    HA   VAL  42           HA       VAL  42 -11.479  -5.289   3.958
  313    HB   VAL  42           HB       VAL  42 -14.342  -4.838   3.102
  314   HG11  VAL  42          HG11      VAL  42 -13.352  -4.327   0.879
  315   HG12  VAL  42          HG12      VAL  42 -11.747  -4.396   1.608
  316   HG13  VAL  42          HG13      VAL  42 -12.891  -3.157   2.117
  317   HG21  VAL  42          HG21      VAL  42 -12.274  -6.894   2.349
  318   HG22  VAL  42          HG22      VAL  42 -13.769  -6.630   1.448
  319   HG23  VAL  42          HG23      VAL  42 -13.833  -7.168   3.133
  320    H    ASP  43           HN       ASP  43 -10.471  -3.444   4.213
  321    HA   ASP  43           HA       ASP  43 -12.040  -1.066   4.886
  322    HB2  ASP  43           HB2      ASP  43 -10.976  -1.982   6.989
  323    HB3  ASP  43           HB1      ASP  43  -9.402  -1.700   6.246
  324    H    GLY  44           HN       GLY  44 -11.322   0.819   3.908
  325    HA2  GLY  44           HA2      GLY  44  -8.814   1.240   2.779
  326    HA3  GLY  44           HA1      GLY  44  -9.832   0.529   1.532
  327    H    GLU  45           HN       GLU  45  -9.315   2.713   0.576
  328    HA   GLU  45           HA       GLU  45 -10.369   5.109   1.616
  329    HB2  GLU  45           HB2      GLU  45  -8.832   4.398  -0.539
  330    HB3  GLU  45           HB1      GLU  45 -10.346   4.836  -1.320
  331    HG2  GLU  45           HG2      GLU  45  -8.843   6.597   0.607
  332    HG3  GLU  45           HG1      GLU  45  -8.701   6.688  -1.146
  333    H    TRP  46           HN       TRP  46 -12.303   6.206   1.176
  334    HA   TRP  46           HA       TRP  46 -14.509   4.457   0.287
  335    HB2  TRP  46           HB2      TRP  46 -14.330   6.331   2.598
  336    HB3  TRP  46           HB1      TRP  46 -15.858   6.276   1.742
  337    HD1  TRP  46           HD1      TRP  46 -13.375   3.784   3.366
  338    HE1  TRP  46           HE1      TRP  46 -14.714   1.878   4.457
  339    HE3  TRP  46           HE3      TRP  46 -18.135   5.202   1.991
  340    HZ2  TRP  46           HZ2      TRP  46 -17.409   1.102   4.722
  341    HZ3  TRP  46           HZ3      TRP  46 -20.019   3.824   2.727
  342    HH2  TRP  46           HH2      TRP  46 -19.661   1.804   4.054
  343    H    THR  47           HN       THR  47 -14.845   5.025  -1.735
  344    HA   THR  47           HA       THR  47 -14.887   7.866  -2.463
  345    HB   THR  47           HB       THR  47 -14.828   6.906  -4.850
  346    HG1  THR  47           HG1      THR  47 -13.967   4.605  -3.400
  347   HG21  THR  47          HG21      THR  47 -12.395   6.635  -4.778
  348   HG22  THR  47          HG22      THR  47 -12.465   6.479  -3.022
  349   HG23  THR  47          HG23      THR  47 -12.917   8.000  -3.792
  350    H    TYR  48           HN       TYR  48 -16.565   8.505  -4.106
  351    HA   TYR  48           HA       TYR  48 -18.975   6.893  -4.071
  352    HB2  TYR  48           HB2      TYR  48 -19.446   7.996  -2.045
  353    HB3  TYR  48           HB1      TYR  48 -18.836   9.533  -2.596
  354    HD1  TYR  48           HD1      TYR  48 -21.714   7.184  -2.725
  355    HD2  TYR  48           HD2      TYR  48 -20.244  11.025  -3.879
  356    HE1  TYR  48           HE1      TYR  48 -23.980   7.878  -3.324
  357    HE2  TYR  48           HE2      TYR  48 -22.529  11.714  -4.479
  358    HH   TYR  48           HH       TYR  48 -25.272   9.928  -3.568
  359    H    ASP  49           HN       ASP  49 -20.393   7.364  -5.736
  360    HA   ASP  49           HA       ASP  49 -19.645   9.638  -7.484
  361    HB2  ASP  49           HB2      ASP  49 -18.883   7.352  -8.432
  362    HB3  ASP  49           HB1      ASP  49 -20.591   6.996  -8.635
  363    H    ASP  50           HN       ASP  50 -21.456  10.591  -8.587
  364    HA   ASP  50           HA       ASP  50 -23.898  10.200  -6.989
  365    HB2  ASP  50           HB2      ASP  50 -22.952  12.517  -7.208
  366    HB3  ASP  50           HB1      ASP  50 -23.258  12.435  -8.940
  367    H    ALA  51           HN       ALA  51 -22.642   9.550 -10.110
  368    HA   ALA  51           HA       ALA  51 -25.112   9.678 -11.541
  369    HB1  ALA  51           HB1      ALA  51 -23.932   8.578 -13.341
  370    HB2  ALA  51           HB2      ALA  51 -22.603   8.166 -12.254
  371    HB3  ALA  51           HB3      ALA  51 -22.931   9.853 -12.647
  372    H    THR  52           HN       THR  52 -23.394   7.120  -9.831
  373    HA   THR  52           HA       THR  52 -25.647   5.338 -10.438
  374    HB   THR  52           HB       THR  52 -23.996   3.485  -9.952
  375    HG1  THR  52           HG1      THR  52 -22.120   4.107  -9.227
  376   HG21  THR  52          HG21      THR  52 -24.647   4.141 -12.247
  377   HG22  THR  52          HG22      THR  52 -22.976   3.585 -12.158
  378   HG23  THR  52          HG23      THR  52 -23.325   5.310 -12.270
  379    H    LYS  53           HN       LYS  53 -24.674   7.220  -7.989
  380    HA   LYS  53           HA       LYS  53 -24.805   7.176  -5.667
  381    HB2  LYS  53           HB2      LYS  53 -27.108   5.594  -6.680
  382    HB3  LYS  53           HB1      LYS  53 -26.757   5.469  -4.964
  383    HG2  LYS  53           HG2      LYS  53 -28.457   7.190  -5.577
  384    HG3  LYS  53           HG1      LYS  53 -27.096   7.791  -4.632
  385    HD2  LYS  53           HD2      LYS  53 -26.091   8.752  -6.591
  386    HD3  LYS  53           HD1      LYS  53 -27.303   8.004  -7.635
  387    HE2  LYS  53           HE2      LYS  53 -27.985   9.962  -5.456
  388    HE3  LYS  53           HE1      LYS  53 -27.632  10.453  -7.114
  389    HZ1  LYS  53           HZ1      LYS  53 -30.041  10.135  -6.560
  390    HZ2  LYS  53           HZ2      LYS  53 -29.731   8.469  -6.440
  391    HZ3  LYS  53           HZ3      LYS  53 -29.483   9.278  -7.913
  392    H    THR  54           HN       THR  54 -22.720   5.738  -6.427
  393    HA   THR  54           HA       THR  54 -22.935   3.161  -5.061
  394    HB   THR  54           HB       THR  54 -20.858   3.902  -7.124
  395    HG1  THR  54           HG1      THR  54 -23.483   3.320  -7.442
  396   HG21  THR  54          HG21      THR  54 -21.796   1.215  -6.056
  397   HG22  THR  54          HG22      THR  54 -20.291   2.019  -5.602
  398   HG23  THR  54          HG23      THR  54 -20.532   1.467  -7.261
  399    H    TYR  55           HN       TYR  55 -21.936   3.041  -3.188
  400    HA   TYR  55           HA       TYR  55 -19.681   4.792  -2.557
  401    HB2  TYR  55           HB2      TYR  55 -21.268   2.796  -0.890
  402    HB3  TYR  55           HB1      TYR  55 -19.714   3.419  -0.350
  403    HD1  TYR  55           HD1      TYR  55 -23.198   4.323  -1.098
  404    HD2  TYR  55           HD2      TYR  55 -19.490   5.682   0.499
  405    HE1  TYR  55           HE1      TYR  55 -24.334   6.278  -0.124
  406    HE2  TYR  55           HE2      TYR  55 -20.615   7.626   1.471
  407    HH   TYR  55           HH       TYR  55 -23.987   7.893   1.714
  408    H    THR  56           HN       THR  56 -17.586   4.078  -2.709
  409    HA   THR  56           HA       THR  56 -17.251   1.213  -3.323
  410    HB   THR  56           HB       THR  56 -15.731   3.470  -4.646
  411    HG1  THR  56           HG1      THR  56 -18.158   2.546  -5.138
  412   HG21  THR  56          HG21      THR  56 -15.739   0.481  -5.116
  413   HG22  THR  56          HG22      THR  56 -14.389   1.452  -4.524
  414   HG23  THR  56          HG23      THR  56 -14.967   1.656  -6.181
  415    H    VAL  57           HN       VAL  57 -15.822   0.176  -2.131
  416    HA   VAL  57           HA       VAL  57 -13.822   1.746  -0.646
  417    HB   VAL  57           HB       VAL  57 -15.482   0.732   0.929
  418   HG11  VAL  57          HG11      VAL  57 -16.167  -1.273  -0.164
  419   HG12  VAL  57          HG12      VAL  57 -15.350  -1.743   1.324
  420   HG13  VAL  57          HG13      VAL  57 -14.512  -1.878  -0.219
  421   HG21  VAL  57          HG21      VAL  57 -12.725  -0.466   1.124
  422   HG22  VAL  57          HG22      VAL  57 -13.862  -0.243   2.454
  423   HG23  VAL  57          HG23      VAL  57 -13.181   1.160   1.631
  424    H    THR  58           HN       THR  58 -11.874   1.444  -1.410
  425    HA   THR  58           HA       THR  58 -11.327  -1.075  -2.825
  426    HB   THR  58           HB       THR  58  -9.933   1.481  -3.534
  427    HG1  THR  58           HG1      THR  58 -12.601   0.743  -4.084
  428   HG21  THR  58          HG21      THR  58 -10.871  -0.778  -5.328
  429   HG22  THR  58          HG22      THR  58  -9.302  -0.786  -4.507
  430   HG23  THR  58          HG23      THR  58  -9.672   0.478  -5.677
  431    H    GLU  59           HN       GLU  59  -9.673  -2.233  -2.186
  432    HA   GLU  59           HA       GLU  59  -7.970  -1.289  -0.045
  433    HB2  GLU  59           HB2      GLU  59  -7.927  -3.924  -1.563
  434    HB3  GLU  59           HB1      GLU  59  -6.904  -3.560  -0.211
  435    HG2  GLU  59           HG2      GLU  59  -9.062  -3.255   1.142
  436    HG3  GLU  59           HG1      GLU  59  -9.856  -4.069  -0.207
  437    H    GLY  60           HN       GLY  60  -5.596  -1.225  -0.195
  438    HA2  GLY  60           HA2      GLY  60  -3.871  -1.663  -2.128
  439    HA3  GLY  60           HA1      GLY  60  -4.746  -0.322  -2.857
  440    H    SER  61           HN       SER  61  -2.110   0.020  -2.486
  441    HA   SER  61           HA       SER  61  -1.848   1.556   0.012
  442    HB2  SER  61           HB2      SER  61  -0.165  -0.223  -0.406
  443    HB3  SER  61           HB1      SER  61   0.322   0.613  -1.881
  444    HG   SER  61           HG       SER  61   1.243   0.994   0.537
  445    H    GLY  62           HN       GLY  62  -1.593   1.742  -3.481
  446    HA2  GLY  62           HA2      GLY  62  -1.916   3.601  -4.827
  447    HA3  GLY  62           HA1      GLY  62  -2.005   4.597  -3.383
  448    H    GLY  63           HN       GLY  63   0.283   4.527  -2.160
  449    HA2  GLY  63           HA2      GLY  63   2.097   5.823  -3.952
  450    HA3  GLY  63           HA1      GLY  63   2.389   5.477  -2.252
  451    H    ALA  64           HN       ALA  64   2.113   2.711  -2.272
  452    HA   ALA  64           HA       ALA  64   4.589   1.927  -3.544
  453    HB1  ALA  64           HB1      ALA  64   2.686   0.335  -1.816
  454    HB2  ALA  64           HB2      ALA  64   4.129   1.186  -1.261
  455    HB3  ALA  64           HB3      ALA  64   4.282  -0.191  -2.350
  456    H    GLY  65           HN       GLY  65   4.356   1.678  -5.709
  457    HA2  GLY  65           HA2      GLY  65   2.624  -0.478  -6.617
  458    HA3  GLY  65           HA1      GLY  65   2.271   1.116  -7.274
  459    H    GLY  66           HN       GLY  66   5.446  -0.210  -6.494
  460    HA2  GLY  66           HA2      GLY  66   6.317   0.404  -9.205
  461    HA3  GLY  66           HA1      GLY  66   7.343  -0.082  -7.863
  462    H    GLN  67           HN       GLN  67   5.418  -2.331  -7.319
  463    HA   GLN  67           HA       GLN  67   5.124  -4.520  -7.823
  464    HB2  GLN  67           HB2      GLN  67   5.609  -3.567 -10.665
  465    HB3  GLN  67           HB1      GLN  67   5.096  -5.213 -10.225
  466    HG2  GLN  67           HG2      GLN  67   3.073  -4.264  -9.185
  467    HG3  GLN  67           HG1      GLN  67   3.562  -2.659  -9.731
  468   HE21  GLN  67          HE21      GLN  67   1.200  -4.291 -10.391
  469   HE22  GLN  67          HE22      GLN  67   1.204  -4.436 -12.114
  470    H    GLY  68           HN       GLY  68   6.402  -6.216  -9.619
  471    HA2  GLY  68           HA2      GLY  68   8.958  -6.280 -10.165
  472    HA3  GLY  68           HA1      GLY  68   9.062  -6.258  -8.409
  473    H    MET  69           HN       MET  69   9.305  -8.256  -7.528
  474    HA   MET  69           HA       MET  69   7.629 -10.417  -8.496
  475    HB2  MET  69           HB2      MET  69   9.777 -10.469  -9.864
  476    HB3  MET  69           HB1      MET  69  10.631 -10.823  -8.367
  477    HG2  MET  69           HG2      MET  69   9.315 -12.876  -8.113
  478    HG3  MET  69           HG1      MET  69   8.467 -12.511  -9.615
  479    HE1  MET  69           HE1      MET  69  12.976 -13.473  -9.349
  480    HE2  MET  69           HE2      MET  69  11.882 -13.447  -7.964
  481    HE3  MET  69           HE3      MET  69  12.279 -11.948  -8.801
  482    H    ILE  70           HN       ILE  70   7.942 -12.384  -7.029
  483    HA   ILE  70           HA       ILE  70   8.790 -11.605  -4.356
  484    HB   ILE  70           HB       ILE  70   6.018 -12.694  -4.940
  485   HG12  ILE  70          HG12      ILE  70   6.879 -10.078  -3.685
  486   HG13  ILE  70          HG11      ILE  70   6.288 -10.269  -5.334
  487   HG21  ILE  70          HG21      ILE  70   7.052 -13.687  -2.890
  488   HG22  ILE  70          HG22      ILE  70   5.631 -12.702  -2.542
  489   HG23  ILE  70          HG23      ILE  70   7.242 -12.058  -2.239
  490   HD11  ILE  70          HD11      ILE  70   4.730 -10.817  -2.815
  491   HD12  ILE  70          HD12      ILE  70   4.137 -11.043  -4.462
  492   HD13  ILE  70          HD13      ILE  70   4.540  -9.426  -3.886
  493    H    GLN  71           HN       GLN  71  10.440 -13.136  -4.371
  494    HA   GLN  71           HA       GLN  71   9.590 -15.937  -4.690
  495    HB2  GLN  71           HB2      GLN  71  11.869 -16.448  -5.479
  496    HB3  GLN  71           HB1      GLN  71  11.040 -15.335  -6.550
  497    HG2  GLN  71           HG2      GLN  71  12.279 -13.482  -5.696
  498    HG3  GLN  71           HG1      GLN  71  13.002 -14.480  -4.436
  499   HE21  GLN  71          HE21      GLN  71  13.438 -16.749  -6.182
  500   HE22  GLN  71          HE22      GLN  71  14.757 -16.321  -7.214
  501    H    GLU  72           HN       GLU  72  10.193 -13.760  -2.569
  502    HA   GLU  72           HA       GLU  72  12.158 -14.979  -0.881
  503    HB2  GLU  72           HB2      GLU  72  10.158 -12.763  -0.340
  504    HB3  GLU  72           HB1      GLU  72  11.442 -13.241   0.758
  505    HG2  GLU  72           HG2      GLU  72  12.432 -11.463  -0.250
  506    HG3  GLU  72           HG1      GLU  72  12.971 -12.752  -1.318
  507    HA   PRO  73           HA       PRO  73   9.692 -17.920   1.273
  508    HB2  PRO  73           HB2      PRO  73  10.618 -17.564   3.854
  509    HB3  PRO  73           HB1      PRO  73  11.455 -18.524   2.596
  510    HG2  PRO  73           HG2      PRO  73  11.957 -15.696   3.479
  511    HG3  PRO  73           HG1      PRO  73  13.124 -16.968   3.065
  512    HD2  PRO  73           HD2      PRO  73  12.535 -14.990   1.358
  513    HD3  PRO  73           HD1      PRO  73  12.852 -16.662   0.788
  514    H    ALA  74           HN       ALA  74   8.530 -18.156   3.494
  515    HA   ALA  74           HA       ALA  74   7.046 -15.690   4.021
  516    HB1  ALA  74           HB1      ALA  74   5.806 -18.415   3.683
  517    HB2  ALA  74           HB2      ALA  74   5.730 -17.103   2.505
  518    HB3  ALA  74           HB3      ALA  74   4.948 -16.927   4.076
  519    H    LEU  75           HN       LEU  75   5.419 -16.342   5.985
  520    HA   LEU  75           HA       LEU  75   7.232 -16.845   8.174
  521    HB2  LEU  75           HB2      LEU  75   4.485 -15.769   7.894
  522    HB3  LEU  75           HB1      LEU  75   4.910 -16.488   9.428
  523    HG   LEU  75           HG       LEU  75   5.222 -14.069   9.468
  524   HD11  LEU  75          HD11      LEU  75   7.812 -15.609   9.522
  525   HD12  LEU  75          HD12      LEU  75   6.677 -15.411  10.860
  526   HD13  LEU  75          HD13      LEU  75   7.554 -14.016  10.230
  527   HD21  LEU  75          HD21      LEU  75   5.678 -13.706   7.106
  528   HD22  LEU  75          HD22      LEU  75   7.221 -14.548   7.268
  529   HD23  LEU  75          HD23      LEU  75   6.960 -13.018   8.107
  530    HA   PRO  76           HA       PRO  76   5.995 -21.143   8.650
  531    HB2  PRO  76           HB2      PRO  76   6.894 -20.713  11.470
  532    HB3  PRO  76           HB1      PRO  76   7.450 -21.937  10.321
  533    HG2  PRO  76           HG2      PRO  76   9.022 -19.896  10.961
  534    HG3  PRO  76           HG1      PRO  76   8.906 -20.468   9.257
  535    HD2  PRO  76           HD2      PRO  76   7.554 -18.050  10.526
  536    HD3  PRO  76           HD1      PRO  76   8.387 -18.194   8.965
  537    HA   PRO  77           HA       PRO  77   2.006 -20.856  10.589
  538    HB2  PRO  77           HB2      PRO  77   1.705 -23.265  11.820
  539    HB3  PRO  77           HB1      PRO  77   1.624 -23.079  10.064
  540    HG2  PRO  77           HG2      PRO  77   3.950 -23.862  11.774
  541    HG3  PRO  77           HG1      PRO  77   3.318 -24.687  10.327
  542    HD2  PRO  77           HD2      PRO  77   5.441 -23.066  10.088
  543    HD3  PRO  77           HD1      PRO  77   4.121 -23.016   8.863
  544    H    GLY  78           HN       GLY  78   1.375 -19.827  12.361
  545    HA2  GLY  78           HA2      GLY  78   1.228 -19.498  14.709
  546    HA3  GLY  78           HA1      GLY  78   2.739 -20.373  14.904
  547    H    TRP  79           HN       TRP  79   4.053 -18.784  12.726
  548    HA   TRP  79           HA       TRP  79   4.745 -16.468  14.392
  549    HB2  TRP  79           HB2      TRP  79   5.929 -17.555  11.814
  550    HB3  TRP  79           HB1      TRP  79   6.472 -16.069  12.577
  551    HD1  TRP  79           HD1      TRP  79   6.406 -19.872  13.204
  552    HE1  TRP  79           HE1      TRP  79   8.291 -20.445  14.859
  553    HE3  TRP  79           HE3      TRP  79   7.946 -15.129  14.345
  554    HZ2  TRP  79           HZ2      TRP  79  10.180 -19.062  16.442
  555    HZ3  TRP  79           HZ3      TRP  79   9.792 -14.840  15.937
  556    HH2  TRP  79           HH2      TRP  79  10.889 -16.768  16.964
  557    H    GLU  80           HN       GLU  80   3.774 -14.489  14.052
  558    HA   GLU  80           HA       GLU  80   2.506 -14.086  11.427
  559    HB2  GLU  80           HB2      GLU  80   1.843 -12.736  14.056
  560    HB3  GLU  80           HB1      GLU  80   0.979 -12.510  12.543
  561    HG2  GLU  80           HG2      GLU  80   0.620 -15.076  12.679
  562    HG3  GLU  80           HG1      GLU  80   1.006 -14.855  14.385
  563    H    MET  81           HN       MET  81   2.649 -12.067  10.426
  564    HA   MET  81           HA       MET  81   4.888 -10.401  11.356
  565    HB2  MET  81           HB2      MET  81   5.850 -11.350   9.511
  566    HB3  MET  81           HB1      MET  81   4.299 -11.561   8.677
  567    HG2  MET  81           HG2      MET  81   4.263  -9.219   8.133
  568    HG3  MET  81           HG1      MET  81   5.739  -8.938   9.049
  569    HE1  MET  81           HE1      MET  81   6.505  -8.604   5.089
  570    HE2  MET  81           HE2      MET  81   6.367  -7.683   6.589
  571    HE3  MET  81           HE3      MET  81   4.924  -8.355   5.830
  572    H    LYS  82           HN       LYS  82   4.451  -8.228  11.547
  573    HA   LYS  82           HA       LYS  82   2.134  -7.106  10.208
  574    HB2  LYS  82           HB2      LYS  82   2.305  -6.958  13.240
  575    HB3  LYS  82           HB1      LYS  82   1.051  -6.273  12.233
  576    HG2  LYS  82           HG2      LYS  82   0.399  -8.601  11.567
  577    HG3  LYS  82           HG1      LYS  82   1.571  -9.201  12.780
  578    HD2  LYS  82           HD2      LYS  82   0.344  -7.941  14.522
  579    HD3  LYS  82           HD1      LYS  82  -0.824  -7.419  13.308
  580    HE2  LYS  82           HE2      LYS  82  -1.901  -9.222  14.279
  581    HE3  LYS  82           HE1      LYS  82  -1.133  -9.956  12.876
  582    HZ1  LYS  82           HZ1      LYS  82  -0.758 -11.363  14.718
  583    HZ2  LYS  82           HZ2      LYS  82  -0.227 -10.073  15.687
  584    HZ3  LYS  82           HZ3      LYS  82   0.715 -10.594  14.382
  585    H    TYR  83           HN       TYR  83   2.104  -4.698  10.397
  586    HA   TYR  83           HA       TYR  83   4.868  -3.693  10.802
  587    HB2  TYR  83           HB2      TYR  83   2.644  -2.706   8.982
  588    HB3  TYR  83           HB1      TYR  83   4.158  -1.811   9.249
  589    HD1  TYR  83           HD1      TYR  83   6.241  -2.630   8.303
  590    HD2  TYR  83           HD2      TYR  83   2.575  -4.679   7.601
  591    HE1  TYR  83           HE1      TYR  83   7.263  -3.795   6.395
  592    HE2  TYR  83           HE2      TYR  83   3.593  -5.860   5.699
  593    HH   TYR  83           HH       TYR  83   5.426  -5.533   4.114
  594    H    THR  84           HN       THR  84   5.117  -1.482  11.547
  595    HA   THR  84           HA       THR  84   2.910  -0.563  13.256
  596    HB   THR  84           HB       THR  84   4.450   0.623  14.581
  597    HG1  THR  84           HG1      THR  84   6.243   1.522  13.817
  598   HG21  THR  84          HG21      THR  84   4.818  -1.727  14.943
  599   HG22  THR  84          HG22      THR  84   6.361  -0.885  15.042
  600   HG23  THR  84          HG23      THR  84   5.946  -1.805  13.593
  601    H    SER  85           HN       SER  85   3.022   2.078  13.321
  602    HA   SER  85           HA       SER  85   2.356   2.790  10.607
  603    HB2  SER  85           HB2      SER  85   1.814   5.041  11.772
  604    HB3  SER  85           HB1      SER  85   0.816   3.635  12.139
  605    HG   SER  85           HG       SER  85   3.090   4.159  13.721
  606    H    GLU  86           HN       GLU  86   5.247   2.541  11.889
  607    HA   GLU  86           HA       GLU  86   6.273   5.103  10.769
  608    HB2  GLU  86           HB2      GLU  86   7.720   3.177  12.630
  609    HB3  GLU  86           HB1      GLU  86   8.300   4.751  12.109
  610    HG2  GLU  86           HG2      GLU  86   7.562   5.116  14.275
  611    HG3  GLU  86           HG1      GLU  86   6.207   5.671  13.291
  612    H    GLY  87           HN       GLY  87   5.695   2.026   9.923
  613    HA2  GLY  87           HA2      GLY  87   6.395   0.955   7.970
  614    HA3  GLY  87           HA1      GLY  87   7.787   2.026   7.910
  615    H    VAL  88           HN       VAL  88   7.430   0.751  10.991
  616    HA   VAL  88           HA       VAL  88   9.774  -0.889  10.630
  617    HB   VAL  88           HB       VAL  88   8.176  -0.282  13.126
  618   HG11  VAL  88          HG11      VAL  88  10.872  -1.605  12.842
  619   HG12  VAL  88          HG12      VAL  88   9.376  -2.404  13.324
  620   HG13  VAL  88          HG13      VAL  88  10.089  -1.167  14.359
  621   HG21  VAL  88          HG21      VAL  88   9.981   1.244  13.680
  622   HG22  VAL  88          HG22      VAL  88   9.288   1.672  12.114
  623   HG23  VAL  88          HG23      VAL  88  10.827   0.815  12.193
  624    H    ARG  89           HN       ARG  89   9.922  -3.049  10.856
  625    HA   ARG  89           HA       ARG  89   7.437  -4.571  10.539
  626    HB2  ARG  89           HB2      ARG  89   9.264  -4.662   8.814
  627    HB3  ARG  89           HB1      ARG  89  10.306  -5.385  10.023
  628    HG2  ARG  89           HG2      ARG  89   8.791  -7.305  10.169
  629    HG3  ARG  89           HG1      ARG  89   7.772  -6.580   8.917
  630    HD2  ARG  89           HD2      ARG  89   9.801  -6.531   7.438
  631    HD3  ARG  89           HD1      ARG  89  10.640  -7.479   8.664
  632    HE   ARG  89           HE       ARG  89   8.169  -8.653   7.785
  633   HH11  ARG  89          HH11      ARG  89  11.622  -8.421   7.230
  634   HH12  ARG  89          HH12      ARG  89  11.684  -9.852   6.257
  635   HH21  ARG  89          HH21      ARG  89   8.256 -10.563   6.531
  636   HH22  ARG  89          HH22      ARG  89   9.770 -11.066   5.845
  637    H    TYR  90           HN       TYR  90   6.698  -5.622  12.335
  638    HA   TYR  90           HA       TYR  90   8.735  -6.692  14.169
  639    HB2  TYR  90           HB2      TYR  90   7.419  -6.243  16.121
  640    HB3  TYR  90           HB1      TYR  90   7.586  -4.750  15.236
  641    HD1  TYR  90           HD1      TYR  90   5.626  -3.915  13.887
  642    HD2  TYR  90           HD2      TYR  90   5.292  -7.115  16.669
  643    HE1  TYR  90           HE1      TYR  90   3.184  -3.634  13.904
  644    HE2  TYR  90           HE2      TYR  90   2.849  -6.837  16.701
  645    HH   TYR  90           HH       TYR  90   1.198  -4.987  14.393
  646    H    PHE  91           HN       PHE  91   7.979  -8.699  15.360
  647    HA   PHE  91           HA       PHE  91   5.994 -10.096  13.708
  648    HB2  PHE  91           HB2      PHE  91   8.637 -11.170  14.717
  649    HB3  PHE  91           HB1      PHE  91   7.352 -12.188  14.078
  650    HD1  PHE  91           HD1      PHE  91   6.920 -12.370  11.765
  651    HD2  PHE  91           HD2      PHE  91   9.768  -9.509  13.164
  652    HE1  PHE  91           HE1      PHE  91   7.695 -12.005   9.468
  653    HE2  PHE  91           HE2      PHE  91  10.517  -9.143  10.866
  654    HZ   PHE  91           HZ       PHE  91   9.492 -10.393   9.013
  655    H    VAL  92           HN       VAL  92   4.888 -11.804  14.668
  656    HA   VAL  92           HA       VAL  92   4.611 -11.492  17.590
  657    HB   VAL  92           HB       VAL  92   2.461 -12.184  15.574
  658   HG11  VAL  92          HG11      VAL  92   2.281 -11.636  18.529
  659   HG12  VAL  92          HG12      VAL  92   1.971 -13.170  17.712
  660   HG13  VAL  92          HG13      VAL  92   0.901 -11.794  17.440
  661   HG21  VAL  92          HG21      VAL  92   1.550  -9.983  15.985
  662   HG22  VAL  92          HG22      VAL  92   3.193  -9.859  15.360
  663   HG23  VAL  92          HG23      VAL  92   2.878  -9.611  17.077
  664    H    ASP  93           HN       ASP  93   5.659 -13.260  18.386
  665    HA   ASP  93           HA       ASP  93   5.398 -15.862  17.090
  666    HB2  ASP  93           HB2      ASP  93   7.494 -15.384  18.241
  667    HB3  ASP  93           HB1      ASP  93   6.649 -15.025  19.744
  668    H    HIS  94           HN       HIS  94   3.716 -17.296  17.555
  669    HA   HIS  94           HA       HIS  94   1.705 -16.231  19.334
  670    HB2  HIS  94           HB2      HIS  94   1.343 -17.142  16.953
  671    HB3  HIS  94           HB1      HIS  94   1.383 -18.729  17.713
  672    HD1  HIS  94           HD1      HIS  94  -0.960 -19.501  17.880
  673    HD2  HIS  94           HD2      HIS  94  -0.581 -15.467  18.805
  674    HE1  HIS  94           HE1      HIS  94  -3.257 -18.738  18.561
  675    HE2  HIS  94           HE2      HIS  94  -3.035 -16.247  18.906
  676    H    ASN  95           HN       ASN  95   4.179 -18.580  19.664
  677    HA   ASN  95           HA       ASN  95   2.569 -20.143  21.529
  678    HB2  ASN  95           HB2      ASN  95   4.400 -21.713  21.690
  679    HB3  ASN  95           HB1      ASN  95   4.153 -21.324  19.996
  680   HD21  ASN  95          HD21      ASN  95   5.760 -20.387  18.854
  681   HD22  ASN  95          HD22      ASN  95   7.338 -20.072  19.486
  682    H    THR  96           HN       THR  96   5.267 -17.838  21.652
  683    HA   THR  96           HA       THR  96   5.296 -18.047  24.557
  684    HB   THR  96           HB       THR  96   7.021 -16.212  24.422
  685    HG1  THR  96           HG1      THR  96   6.753 -16.709  21.611
  686   HG21  THR  96          HG21      THR  96   7.655 -18.696  22.816
  687   HG22  THR  96          HG22      THR  96   7.661 -18.580  24.576
  688   HG23  THR  96          HG23      THR  96   8.814 -17.644  23.626
  689    H    ARG  97           HN       ARG  97   3.833 -16.196  22.080
  690    HA   ARG  97           HA       ARG  97   2.281 -14.518  22.080
  691    HB2  ARG  97           HB2      ARG  97   2.060 -15.121  25.036
  692    HB3  ARG  97           HB1      ARG  97   0.924 -14.161  24.087
  693    HG2  ARG  97           HG2      ARG  97   0.363 -16.070  22.740
  694    HG3  ARG  97           HG1      ARG  97   1.587 -17.034  23.563
  695    HD2  ARG  97           HD2      ARG  97  -0.867 -15.830  24.820
  696    HD3  ARG  97           HD1      ARG  97  -0.665 -17.524  24.390
  697    HE   ARG  97           HE       ARG  97   1.355 -16.537  26.195
  698   HH11  ARG  97          HH11      ARG  97  -1.846 -17.939  25.935
  699   HH12  ARG  97          HH12      ARG  97  -1.845 -18.554  27.556
  700   HH21  ARG  97          HH21      ARG  97   1.383 -17.368  28.309
  701   HH22  ARG  97          HH22      ARG  97   0.009 -18.247  28.918
  702    H    THR  98           HN       THR  98   4.785 -13.888  22.066
  703    HA   THR  98           HA       THR  98   4.940 -11.351  23.553
  704    HB   THR  98           HB       THR  98   7.397 -13.102  23.138
  705    HG1  THR  98           HG1      THR  98   5.479 -13.706  24.732
  706   HG21  THR  98          HG21      THR  98   6.854 -10.646  24.831
  707   HG22  THR  98          HG22      THR  98   7.981 -10.776  23.478
  708   HG23  THR  98          HG23      THR  98   8.300 -11.640  24.981
  709    H    THR  99           HN       THR  99   5.852  -9.619  22.270
  710    HA   THR  99           HA       THR  99   6.037 -10.229  19.421
  711    HB   THR  99           HB       THR  99   6.429  -7.605  19.423
  712    HG1  THR  99           HG1      THR  99   4.855  -7.444  21.667
  713   HG21  THR  99          HG21      THR  99   4.386  -8.606  18.503
  714   HG22  THR  99          HG22      THR  99   3.932  -7.249  19.542
  715   HG23  THR  99          HG23      THR  99   3.766  -8.902  20.128
  716    H    THR 100           HN       THR 100   7.911  -9.898  18.156
  717    HA   THR 100           HA       THR 100  10.311  -8.920  19.437
  718    HB   THR 100           HB       THR 100  10.265 -11.335  20.039
  719    HG1  THR 100           HG1      THR 100  12.247  -9.976  19.321
  720   HG21  THR 100          HG21      THR 100   9.092 -12.198  18.073
  721   HG22  THR 100          HG22      THR 100  10.643 -13.008  18.283
  722   HG23  THR 100          HG23      THR 100  10.465 -11.757  17.056
  723    H    PHE 101           HN       PHE 101  12.011  -8.487  17.948
  724    HA   PHE 101           HA       PHE 101  11.070  -8.124  15.189
  725    HB2  PHE 101           HB2      PHE 101  13.434  -6.929  16.700
  726    HB3  PHE 101           HB1      PHE 101  13.048  -6.607  14.958
  727    HD1  PHE 101           HD1      PHE 101  11.611  -4.888  14.407
  728    HD2  PHE 101           HD2      PHE 101  11.647  -6.309  18.418
  729    HE1  PHE 101           HE1      PHE 101  10.156  -3.025  15.077
  730    HE2  PHE 101           HE2      PHE 101  10.184  -4.450  19.094
  731    HZ   PHE 101           HZ       PHE 101   9.437  -2.804  17.418
  732    H    LYS 102           HN       LYS 102  11.486  -9.983  14.083
  733    HA   LYS 102           HA       LYS 102  14.239 -10.998  14.161
  734    HB2  LYS 102           HB2      LYS 102  12.578 -12.355  15.554
  735    HB3  LYS 102           HB1      LYS 102  11.850 -12.827  14.023
  736    HG2  LYS 102           HG2      LYS 102  13.377 -14.534  14.786
  737    HG3  LYS 102           HG1      LYS 102  13.996 -13.785  13.312
  738    HD2  LYS 102           HD2      LYS 102  15.787 -14.095  14.946
  739    HD3  LYS 102           HD1      LYS 102  15.491 -12.382  14.653
  740    HE2  LYS 102           HE2      LYS 102  14.162 -12.269  16.708
  741    HE3  LYS 102           HE1      LYS 102  14.477 -13.977  17.003
  742    HZ1  LYS 102           HZ1      LYS 102  16.819 -13.509  17.209
  743    HZ2  LYS 102           HZ2      LYS 102  15.955 -12.503  18.269
  744    HZ3  LYS 102           HZ3      LYS 102  16.569 -11.874  16.827
  745    H    ASP 103           HN       ASP 103  14.943 -10.448  12.186
  746    HA   ASP 103           HA       ASP 103  13.211 -10.925   9.872
  747    HB2  ASP 103           HB2      ASP 103  14.309  -8.688  10.136
  748    HB3  ASP 103           HB1      ASP 103  15.870  -9.479   9.957
  749    HA   PRO 104           HA       PRO 104  15.358 -14.659   8.920
  750    HB2  PRO 104           HB2      PRO 104  14.761 -14.828   6.251
  751    HB3  PRO 104           HB1      PRO 104  13.588 -15.194   7.525
  752    HG2  PRO 104           HG2      PRO 104  13.953 -12.674   5.945
  753    HG3  PRO 104           HG1      PRO 104  12.452 -13.523   6.363
  754    HD2  PRO 104           HD2      PRO 104  13.268 -11.345   7.711
  755    HD3  PRO 104           HD1      PRO 104  12.447 -12.688   8.537
  756    H    ARG 105           HN       ARG 105  16.190 -11.666   7.292
  757    HA   ARG 105           HA       ARG 105  18.410 -12.933   5.888
  758    HB2  ARG 105           HB2      ARG 105  17.402 -10.095   5.959
  759    HB3  ARG 105           HB1      ARG 105  18.958 -10.498   5.260
  760    HG2  ARG 105           HG2      ARG 105  17.460 -10.344   3.466
  761    HG3  ARG 105           HG1      ARG 105  17.721 -12.074   3.711
  762    HD2  ARG 105           HD2      ARG 105  15.325 -11.519   3.305
  763    HD3  ARG 105           HD1      ARG 105  15.601 -12.257   4.887
  764    HE   ARG 105           HE       ARG 105  15.280 -10.144   5.916
  765   HH11  ARG 105          HH11      ARG 105  14.591 -10.146   2.464
  766   HH12  ARG 105          HH12      ARG 105  13.691  -8.660   2.533
  767   HH21  ARG 105          HH21      ARG 105  14.100  -8.228   6.009
  768   HH22  ARG 105          HH22      ARG 105  13.445  -7.530   4.548
  769    HA   PRO 106           HA       PRO 106  20.962 -12.189   9.467
  770    HB2  PRO 106           HB2      PRO 106  23.369 -12.947   8.479
  771    HB3  PRO 106           HB1      PRO 106  22.070 -14.138   8.874
  772    HG2  PRO 106           HG2      PRO 106  22.872 -12.982   6.217
  773    HG3  PRO 106           HG1      PRO 106  22.460 -14.657   6.638
  774    HD2  PRO 106           HD2      PRO 106  20.720 -12.923   5.438
  775    HD3  PRO 106           HD1      PRO 106  20.203 -14.272   6.507
  776    H    GLY 107           HN       GLY 107  21.441 -10.178  10.074
  777    HA2  GLY 107           HA2      GLY 107  22.615  -8.212  10.236
  778    HA3  GLY 107           HA1      GLY 107  23.606  -8.732   8.857
  779    H    PHE 108           HN       PHE 108  21.010  -9.101   7.270
  780    HA   PHE 108           HA       PHE 108  20.234  -7.875   5.442
  781    HB2  PHE 108           HB2      PHE 108  18.561  -6.125   6.148
  782    HB3  PHE 108           HB1      PHE 108  18.334  -7.725   6.929
  783    HD1  PHE 108           HD1      PHE 108  18.687  -7.967   9.321
  784    HD2  PHE 108           HD2      PHE 108  19.260  -4.210   7.393
  785    HE1  PHE 108           HE1      PHE 108  18.640  -6.834  11.503
  786    HE2  PHE 108           HE2      PHE 108  19.218  -3.083   9.570
  787    HZ   PHE 108           HZ       PHE 108  18.907  -4.392  11.630
  788    H    GLU 109           HN       GLU 109  22.851  -7.198   5.954
  789    HA   GLU 109           HA       GLU 109  22.975  -4.542   4.806
  790    HB2  GLU 109           HB2      GLU 109  23.160  -4.063   7.196
  791    HB3  GLU 109           HB1      GLU 109  24.416  -5.276   7.383
  792    HG2  GLU 109           HG2      GLU 109  25.479  -3.168   7.384
  793    HG3  GLU 109           HG1      GLU 109  25.830  -3.913   5.828
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 -42.483   9.679   1.569
    2    H2   GLY   1           HT2      GLY   1 -42.144  10.391   3.065
    3    H3   GLY   1           HT3      GLY   1 -42.164   8.703   2.920
    4    HA2  GLY   1           HA1      GLY   1 -40.237  10.548   1.631
    5    HA3  GLY   1           HA2      GLY   1 -39.901   9.521   3.020
    6    H    SER   2           HN       SER   2 -39.046   9.734   0.031
    7    HA   SER   2           HA       SER   2 -39.638   7.025  -0.860
    8    HB2  SER   2           HB2      SER   2 -38.043   9.249  -2.159
    9    HB3  SER   2           HB1      SER   2 -38.412   7.699  -2.910
   10    HG   SER   2           HG       SER   2 -40.212   9.771  -2.164
   11    H    HIS   3           HN       HIS   3 -38.028   5.463  -1.281
   12    HA   HIS   3           HA       HIS   3 -35.570   5.935   0.258
   13    HB2  HIS   3           HB2      HIS   3 -35.437   3.444   0.572
   14    HB3  HIS   3           HB1      HIS   3 -36.817   4.186   1.365
   15    HD1  HIS   3           HD1      HIS   3 -36.768   1.181   0.817
   16    HD2  HIS   3           HD2      HIS   3 -38.494   3.969  -1.752
   17    HE1  HIS   3           HE1      HIS   3 -38.481  -0.080  -0.518
   18    HE2  HIS   3           HE2      HIS   3 -39.695   1.679  -1.843
   19    H    MET   4           HN       MET   4 -33.593   5.640  -0.792
   20    HA   MET   4           HA       MET   4 -33.843   5.052  -3.665
   21    HB2  MET   4           HB2      MET   4 -31.637   6.592  -2.253
   22    HB3  MET   4           HB1      MET   4 -31.765   6.330  -3.982
   23    HG2  MET   4           HG2      MET   4 -33.936   7.566  -3.939
   24    HG3  MET   4           HG1      MET   4 -33.602   7.967  -2.257
   25    HE1  MET   4           HE1      MET   4 -31.103   7.670  -5.271
   26    HE2  MET   4           HE2      MET   4 -31.001   9.345  -5.812
   27    HE3  MET   4           HE3      MET   4 -32.507   8.448  -6.003
   28    H    GLN   5           HN       GLN   5 -32.628   3.467  -4.589
   29    HA   GLN   5           HA       GLN   5 -31.409   1.570  -2.809
   30    HB2  GLN   5           HB2      GLN   5 -32.880   0.885  -4.684
   31    HB3  GLN   5           HB1      GLN   5 -31.711   1.536  -5.817
   32    HG2  GLN   5           HG2      GLN   5 -30.080  -0.112  -5.139
   33    HG3  GLN   5           HG1      GLN   5 -31.188  -0.743  -3.922
   34   HE21  GLN   5          HE21      GLN   5 -30.484  -0.502  -7.312
   35   HE22  GLN   5          HE22      GLN   5 -31.609  -1.742  -7.841
   36    H    TYR   6           HN       TYR   6 -29.334   1.597  -2.273
   37    HA   TYR   6           HA       TYR   6 -27.470   3.131  -3.968
   38    HB2  TYR   6           HB2      TYR   6 -27.404   2.447  -1.007
   39    HB3  TYR   6           HB1      TYR   6 -25.927   2.887  -1.847
   40    HD1  TYR   6           HD1      TYR   6 -25.463   5.170  -2.379
   41    HD2  TYR   6           HD2      TYR   6 -29.283   4.084  -0.851
   42    HE1  TYR   6           HE1      TYR   6 -25.986   7.539  -2.026
   43    HE2  TYR   6           HE2      TYR   6 -29.819   6.460  -0.495
   44    HH   TYR   6           HH       TYR   6 -28.643   8.591  -0.182
   45    H    LYS   7           HN       LYS   7 -25.379   2.252  -4.382
   46    HA   LYS   7           HA       LYS   7 -25.357  -0.693  -4.392
   47    HB2  LYS   7           HB2      LYS   7 -25.624   0.134  -6.695
   48    HB3  LYS   7           HB1      LYS   7 -24.321   1.287  -6.444
   49    HG2  LYS   7           HG2      LYS   7 -22.692  -0.467  -6.427
   50    HG3  LYS   7           HG1      LYS   7 -23.943  -1.709  -6.408
   51    HD2  LYS   7           HD2      LYS   7 -24.678  -0.987  -8.630
   52    HD3  LYS   7           HD1      LYS   7 -23.394   0.230  -8.649
   53    HE2  LYS   7           HE2      LYS   7 -21.704  -1.437  -8.608
   54    HE3  LYS   7           HE1      LYS   7 -22.877  -2.702  -8.251
   55    HZ1  LYS   7           HZ1      LYS   7 -22.275  -2.865 -10.523
   56    HZ2  LYS   7           HZ2      LYS   7 -22.568  -1.221 -10.807
   57    HZ3  LYS   7           HZ3      LYS   7 -23.857  -2.263 -10.473
   58    H    LEU   8           HN       LEU   8 -23.563  -1.689  -3.580
   59    HA   LEU   8           HA       LEU   8 -21.239   0.055  -3.031
   60    HB2  LEU   8           HB2      LEU   8 -22.416  -0.829  -0.967
   61    HB3  LEU   8           HB1      LEU   8 -21.962  -2.432  -1.486
   62    HG   LEU   8           HG       LEU   8 -19.560  -1.722  -1.348
   63   HD11  LEU   8          HD11      LEU   8 -19.593   0.629  -1.411
   64   HD12  LEU   8          HD12      LEU   8 -19.193   0.227   0.256
   65   HD13  LEU   8          HD13      LEU   8 -20.831   0.733  -0.163
   66   HD21  LEU   8          HD21      LEU   8 -21.373  -1.784   1.032
   67   HD22  LEU   8          HD22      LEU   8 -19.615  -1.777   1.184
   68   HD23  LEU   8          HD23      LEU   8 -20.424  -3.099   0.339
   69    H    ILE   9           HN       ILE   9 -19.229  -0.656  -3.549
   70    HA   ILE   9           HA       ILE   9 -19.036  -3.275  -4.875
   71    HB   ILE   9           HB       ILE   9 -17.671  -0.698  -5.725
   72   HG12  ILE   9          HG12      ILE   9 -19.578  -2.517  -7.265
   73   HG13  ILE   9          HG11      ILE   9 -20.077  -0.978  -6.469
   74   HG21  ILE   9          HG21      ILE   9 -16.529  -1.962  -7.428
   75   HG22  ILE   9          HG22      ILE   9 -17.326  -3.452  -6.922
   76   HG23  ILE   9          HG23      ILE   9 -16.168  -2.664  -5.851
   77   HD11  ILE   9          HD11      ILE   9 -19.721  -0.693  -8.868
   78   HD12  ILE   9          HD12      ILE   9 -18.065  -1.275  -8.714
   79   HD13  ILE   9          HD13      ILE   9 -18.539   0.240  -7.946
   80    H    LEU  10           HN       LEU  10 -17.753  -4.561  -3.702
   81    HA   LEU  10           HA       LEU  10 -15.857  -3.307  -1.867
   82    HB2  LEU  10           HB2      LEU  10 -16.454  -6.253  -2.116
   83    HB3  LEU  10           HB1      LEU  10 -15.461  -5.506  -0.905
   84    HG   LEU  10           HG       LEU  10 -17.359  -5.942   0.280
   85   HD11  LEU  10          HD11      LEU  10 -16.846  -3.561   0.426
   86   HD12  LEU  10          HD12      LEU  10 -18.542  -3.937   0.722
   87   HD13  LEU  10          HD13      LEU  10 -18.054  -3.258  -0.832
   88   HD21  LEU  10          HD21      LEU  10 -19.168  -5.084  -1.955
   89   HD22  LEU  10          HD22      LEU  10 -19.589  -5.981  -0.496
   90   HD23  LEU  10          HD23      LEU  10 -18.614  -6.744  -1.752
   91    H    ASN  11           HN       ASN  11 -14.001  -2.782  -2.723
   92    HA   ASN  11           HA       ASN  11 -12.870  -4.534  -4.802
   93    HB2  ASN  11           HB2      ASN  11 -13.243  -2.017  -5.187
   94    HB3  ASN  11           HB1      ASN  11 -11.917  -1.763  -4.062
   95   HD21  ASN  11          HD21      ASN  11 -12.186  -1.116  -6.899
   96   HD22  ASN  11          HD22      ASN  11 -10.860  -1.880  -7.697
   97    H    GLY  12           HN       GLY  12 -12.107  -6.111  -3.402
   98    HA2  GLY  12           HA2      GLY  12  -9.854  -5.194  -1.725
   99    HA3  GLY  12           HA1      GLY  12 -10.947  -6.489  -1.199
  100    H    LYS  13           HN       LYS  13  -8.715  -7.391  -0.958
  101    HA   LYS  13           HA       LYS  13  -7.390  -8.271  -3.330
  102    HB2  LYS  13           HB2      LYS  13  -6.020  -9.609  -1.551
  103    HB3  LYS  13           HB1      LYS  13  -5.893  -7.856  -1.594
  104    HG2  LYS  13           HG2      LYS  13  -7.878  -7.985   0.071
  105    HG3  LYS  13           HG1      LYS  13  -7.236  -9.601   0.387
  106    HD2  LYS  13           HD2      LYS  13  -5.031  -8.615   0.856
  107    HD3  LYS  13           HD1      LYS  13  -5.700  -7.007   0.568
  108    HE2  LYS  13           HE2      LYS  13  -5.688  -7.267   2.906
  109    HE3  LYS  13           HE1      LYS  13  -7.360  -7.523   2.418
  110    HZ1  LYS  13           HZ1      LYS  13  -5.378  -9.626   3.118
  111    HZ2  LYS  13           HZ2      LYS  13  -6.930  -9.937   2.515
  112    HZ3  LYS  13           HZ3      LYS  13  -6.747  -9.178   4.017
  113    H    THR  14           HN       THR  14  -8.793 -10.132  -0.628
  114    HA   THR  14           HA       THR  14  -9.100 -12.422  -2.409
  115    HB   THR  14           HB       THR  14  -9.964 -12.312   0.476
  116    HG1  THR  14           HG1      THR  14  -7.644 -13.291   0.646
  117   HG21  THR  14          HG21      THR  14  -8.841 -14.549  -1.216
  118   HG22  THR  14          HG22      THR  14 -10.550 -14.299  -0.865
  119   HG23  THR  14          HG23      THR  14  -9.430 -14.678   0.442
  120    H    LEU  15           HN       LEU  15 -11.026  -9.887  -1.020
  121    HA   LEU  15           HA       LEU  15 -13.472 -11.272  -1.848
  122    HB2  LEU  15           HB2      LEU  15 -12.819  -9.637   0.541
  123    HB3  LEU  15           HB1      LEU  15 -14.458  -9.637  -0.050
  124    HG   LEU  15           HG       LEU  15 -12.928 -12.118   0.733
  125   HD11  LEU  15          HD11      LEU  15 -15.033 -10.602   2.250
  126   HD12  LEU  15          HD12      LEU  15 -13.310 -10.611   2.624
  127   HD13  LEU  15          HD13      LEU  15 -14.247 -12.098   2.746
  128   HD21  LEU  15          HD21      LEU  15 -14.718 -12.448  -0.912
  129   HD22  LEU  15          HD22      LEU  15 -15.854 -11.676   0.194
  130   HD23  LEU  15          HD23      LEU  15 -15.081 -13.198   0.642
  131    H    LYS  16           HN       LYS  16 -13.963 -10.349  -3.762
  132    HA   LYS  16           HA       LYS  16 -14.496  -7.469  -3.686
  133    HB2  LYS  16           HB2      LYS  16 -13.834  -8.464  -6.370
  134    HB3  LYS  16           HB1      LYS  16 -13.337  -6.971  -5.601
  135    HG2  LYS  16           HG2      LYS  16 -11.347  -8.042  -5.972
  136    HG3  LYS  16           HG1      LYS  16 -11.667  -8.517  -4.296
  137    HD2  LYS  16           HD2      LYS  16 -12.625 -10.612  -5.153
  138    HD3  LYS  16           HD1      LYS  16 -12.255 -10.064  -6.788
  139    HE2  LYS  16           HE2      LYS  16  -9.864 -10.003  -6.190
  140    HE3  LYS  16           HE1      LYS  16 -10.273 -10.678  -4.609
  141    HZ1  LYS  16           HZ1      LYS  16  -9.603 -12.469  -5.978
  142    HZ2  LYS  16           HZ2      LYS  16 -10.582 -11.957  -7.267
  143    HZ3  LYS  16           HZ3      LYS  16 -11.294 -12.577  -5.861
  144    H    GLY  17           HN       GLY  17 -16.386  -6.870  -4.715
  145    HA2  GLY  17           HA2      GLY  17 -17.983  -8.420  -6.335
  146    HA3  GLY  17           HA1      GLY  17 -18.411  -8.875  -4.691
  147    H    GLU  18           HN       GLU  18 -20.550  -8.001  -5.275
  148    HA   GLU  18           HA       GLU  18 -20.648  -5.124  -4.719
  149    HB2  GLU  18           HB2      GLU  18 -22.424  -6.462  -6.775
  150    HB3  GLU  18           HB1      GLU  18 -22.340  -4.749  -6.404
  151    HG2  GLU  18           HG2      GLU  18 -20.155  -4.587  -7.378
  152    HG3  GLU  18           HG1      GLU  18 -20.094  -6.334  -7.623
  153    H    THR  19           HN       THR  19 -22.805  -4.432  -4.020
  154    HA   THR  19           HA       THR  19 -24.780  -6.366  -3.300
  155    HB   THR  19           HB       THR  19 -23.233  -6.744  -1.424
  156    HG1  THR  19           HG1      THR  19 -25.005  -6.998  -0.301
  157   HG21  THR  19          HG21      THR  19 -22.134  -4.553  -1.354
  158   HG22  THR  19          HG22      THR  19 -22.828  -4.932   0.226
  159   HG23  THR  19          HG23      THR  19 -23.648  -3.799  -0.849
  160    H    THR  20           HN       THR  20 -26.555  -5.168  -1.961
  161    HA   THR  20           HA       THR  20 -26.701  -2.356  -2.773
  162    HB   THR  20           HB       THR  20 -29.080  -2.779  -3.562
  163    HG1  THR  20           HG1      THR  20 -28.718  -5.127  -2.639
  164   HG21  THR  20          HG21      THR  20 -26.790  -3.979  -5.136
  165   HG22  THR  20          HG22      THR  20 -27.360  -2.310  -5.211
  166   HG23  THR  20          HG23      THR  20 -28.377  -3.624  -5.813
  167    H    THR  21           HN       THR  21 -28.256  -1.112  -1.621
  168    HA   THR  21           HA       THR  21 -29.857  -2.376   0.429
  169    HB   THR  21           HB       THR  21 -27.503  -2.003   1.472
  170    HG1  THR  21           HG1      THR  21 -29.462  -0.629   2.951
  171   HG21  THR  21          HG21      THR  21 -27.195   0.298   2.421
  172   HG22  THR  21          HG22      THR  21 -28.568   0.847   1.461
  173   HG23  THR  21          HG23      THR  21 -27.102   0.295   0.652
  174    H    GLU  22           HN       GLU  22 -31.368  -0.875   1.387
  175    HA   GLU  22           HA       GLU  22 -31.861   1.426  -0.387
  176    HB2  GLU  22           HB2      GLU  22 -34.153   1.342   0.471
  177    HB3  GLU  22           HB1      GLU  22 -33.693  -0.264  -0.079
  178    HG2  GLU  22           HG2      GLU  22 -33.199  -0.911   2.236
  179    HG3  GLU  22           HG1      GLU  22 -33.769   0.708   2.778
  180    H    ALA  23           HN       ALA  23 -31.909   3.519   0.369
  181    HA   ALA  23           HA       ALA  23 -31.948   4.021   3.254
  182    HB1  ALA  23           HB1      ALA  23 -29.860   5.284   3.270
  183    HB2  ALA  23           HB2      ALA  23 -29.600   4.921   1.563
  184    HB3  ALA  23           HB3      ALA  23 -29.554   3.625   2.755
  185    H    VAL  24           HN       VAL  24 -32.521   6.223   3.737
  186    HA   VAL  24           HA       VAL  24 -33.610   7.697   1.472
  187    HB   VAL  24           HB       VAL  24 -34.697   9.106   3.233
  188   HG11  VAL  24          HG11      VAL  24 -35.858   7.203   2.225
  189   HG12  VAL  24          HG12      VAL  24 -36.318   7.405   3.912
  190   HG13  VAL  24          HG13      VAL  24 -35.188   6.134   3.456
  191   HG21  VAL  24          HG21      VAL  24 -34.673   8.306   5.552
  192   HG22  VAL  24          HG22      VAL  24 -33.057   8.770   5.014
  193   HG23  VAL  24          HG23      VAL  24 -33.499   7.067   5.114
  194    H    ASP  25           HN       ASP  25 -30.746   7.670   3.173
  195    HA   ASP  25           HA       ASP  25 -30.154  10.426   2.418
  196    HB2  ASP  25           HB2      ASP  25 -29.423   9.281   5.137
  197    HB3  ASP  25           HB1      ASP  25 -28.913  10.840   4.511
  198    H    ALA  26           HN       ALA  26 -27.828  10.801   2.211
  199    HA   ALA  26           HA       ALA  26 -26.468   8.510   1.145
  200    HB1  ALA  26           HB1      ALA  26 -26.208  10.776   0.186
  201    HB2  ALA  26           HB2      ALA  26 -24.658  10.071   0.656
  202    HB3  ALA  26           HB3      ALA  26 -25.420  11.291   1.678
  203    H    ALA  27           HN       ALA  27 -26.099  10.594   3.979
  204    HA   ALA  27           HA       ALA  27 -23.822   9.442   5.095
  205    HB1  ALA  27           HB1      ALA  27 -24.770  11.549   5.880
  206    HB2  ALA  27           HB2      ALA  27 -24.574  10.416   7.218
  207    HB3  ALA  27           HB3      ALA  27 -26.169  10.691   6.521
  208    H    THR  28           HN       THR  28 -27.225   8.572   5.452
  209    HA   THR  28           HA       THR  28 -26.851   6.573   7.417
  210    HB   THR  28           HB       THR  28 -29.106   6.623   5.408
  211    HG1  THR  28           HG1      THR  28 -30.039   8.025   7.196
  212   HG21  THR  28          HG21      THR  28 -28.967   5.822   8.328
  213   HG22  THR  28          HG22      THR  28 -29.031   4.705   6.965
  214   HG23  THR  28          HG23      THR  28 -30.407   5.759   7.312
  215    H    ALA  29           HN       ALA  29 -26.406   6.552   3.977
  216    HA   ALA  29           HA       ALA  29 -26.762   3.709   3.622
  217    HB1  ALA  29           HB1      ALA  29 -25.408   5.692   1.786
  218    HB2  ALA  29           HB2      ALA  29 -27.135   5.335   1.777
  219    HB3  ALA  29           HB3      ALA  29 -25.973   4.075   1.366
  220    H    GLU  30           HN       GLU  30 -24.156   5.997   4.059
  221    HA   GLU  30           HA       GLU  30 -21.947   4.314   3.743
  222    HB2  GLU  30           HB2      GLU  30 -22.060   6.888   4.053
  223    HB3  GLU  30           HB1      GLU  30 -22.125   6.524   5.767
  224    HG2  GLU  30           HG2      GLU  30 -19.987   5.288   5.541
  225    HG3  GLU  30           HG1      GLU  30 -19.909   5.861   3.877
  226    H    LYS  31           HN       LYS  31 -23.620   5.325   6.705
  227    HA   LYS  31           HA       LYS  31 -22.248   3.920   8.602
  228    HB2  LYS  31           HB2      LYS  31 -25.238   4.356   8.659
  229    HB3  LYS  31           HB1      LYS  31 -24.174   4.138  10.040
  230    HG2  LYS  31           HG2      LYS  31 -24.067   6.454   8.123
  231    HG3  LYS  31           HG1      LYS  31 -24.839   6.474   9.709
  232    HD2  LYS  31           HD2      LYS  31 -22.701   6.021  10.773
  233    HD3  LYS  31           HD1      LYS  31 -21.920   5.941   9.192
  234    HE2  LYS  31           HE2      LYS  31 -21.562   8.116  10.271
  235    HE3  LYS  31           HE1      LYS  31 -22.481   8.269   8.772
  236    HZ1  LYS  31           HZ1      LYS  31 -24.521   8.389  10.108
  237    HZ2  LYS  31           HZ2      LYS  31 -23.446   9.643  10.484
  238    HZ3  LYS  31           HZ3      LYS  31 -23.597   8.315  11.533
  239    H    VAL  32           HN       VAL  32 -24.978   2.681   6.658
  240    HA   VAL  32           HA       VAL  32 -25.153   0.228   8.117
  241    HB   VAL  32           HB       VAL  32 -26.246   0.898   5.371
  242   HG11  VAL  32          HG11      VAL  32 -26.121  -1.497   5.695
  243   HG12  VAL  32          HG12      VAL  32 -27.802  -0.975   5.785
  244   HG13  VAL  32          HG13      VAL  32 -26.917  -1.357   7.261
  245   HG21  VAL  32          HG21      VAL  32 -28.373   1.286   6.540
  246   HG22  VAL  32          HG22      VAL  32 -27.115   2.403   7.067
  247   HG23  VAL  32          HG23      VAL  32 -27.561   1.032   8.084
  248    H    PHE  33           HN       PHE  33 -23.839   1.129   4.957
  249    HA   PHE  33           HA       PHE  33 -22.923  -1.473   4.319
  250    HB2  PHE  33           HB2      PHE  33 -22.489   1.236   3.170
  251    HB3  PHE  33           HB1      PHE  33 -21.345  -0.019   2.751
  252    HD1  PHE  33           HD1      PHE  33 -23.369  -2.307   2.754
  253    HD2  PHE  33           HD2      PHE  33 -23.423   1.587   1.048
  254    HE1  PHE  33           HE1      PHE  33 -24.879  -3.109   0.990
  255    HE2  PHE  33           HE2      PHE  33 -24.940   0.795  -0.723
  256    HZ   PHE  33           HZ       PHE  33 -25.672  -1.554  -0.750
  257    H    LYS  34           HN       LYS  34 -21.587   1.007   6.333
  258    HA   LYS  34           HA       LYS  34 -18.884   0.153   6.122
  259    HB2  LYS  34           HB2      LYS  34 -20.373   1.843   8.118
  260    HB3  LYS  34           HB1      LYS  34 -18.680   1.485   8.320
  261    HG2  LYS  34           HG2      LYS  34 -18.456   2.427   5.902
  262    HG3  LYS  34           HG1      LYS  34 -20.022   3.155   6.248
  263    HD2  LYS  34           HD2      LYS  34 -18.425   4.801   6.826
  264    HD3  LYS  34           HD1      LYS  34 -18.998   4.103   8.341
  265    HE2  LYS  34           HE2      LYS  34 -16.560   4.372   8.321
  266    HE3  LYS  34           HE1      LYS  34 -17.043   2.678   8.477
  267    HZ1  LYS  34           HZ1      LYS  34 -16.259   3.978   5.924
  268    HZ2  LYS  34           HZ2      LYS  34 -16.501   2.322   6.203
  269    HZ3  LYS  34           HZ3      LYS  34 -15.180   3.110   6.908
  270    H    GLN  35           HN       GLN  35 -21.521  -0.500   8.395
  271    HA   GLN  35           HA       GLN  35 -20.100  -2.360   9.968
  272    HB2  GLN  35           HB2      GLN  35 -22.255  -1.372  10.675
  273    HB3  GLN  35           HB1      GLN  35 -23.077  -2.254   9.401
  274    HG2  GLN  35           HG2      GLN  35 -23.375  -3.342  11.544
  275    HG3  GLN  35           HG1      GLN  35 -22.467  -4.368  10.434
  276   HE21  GLN  35          HE21      GLN  35 -22.335  -2.440  13.318
  277   HE22  GLN  35          HE22      GLN  35 -20.811  -3.026  13.887
  278    H    TYR  36           HN       TYR  36 -21.819  -2.589   6.937
  279    HA   TYR  36           HA       TYR  36 -21.930  -5.400   6.700
  280    HB2  TYR  36           HB2      TYR  36 -23.315  -4.089   5.257
  281    HB3  TYR  36           HB1      TYR  36 -21.943  -3.150   4.686
  282    HD1  TYR  36           HD1      TYR  36 -23.633  -6.424   4.450
  283    HD2  TYR  36           HD2      TYR  36 -20.548  -3.929   2.941
  284    HE1  TYR  36           HE1      TYR  36 -23.346  -7.941   2.535
  285    HE2  TYR  36           HE2      TYR  36 -20.259  -5.417   1.019
  286    HH   TYR  36           HH       TYR  36 -20.673  -7.771   0.449
  287    H    ALA  37           HN       ALA  37 -19.618  -3.005   5.442
  288    HA   ALA  37           HA       ALA  37 -17.868  -4.919   4.273
  289    HB1  ALA  37           HB1      ALA  37 -16.291  -3.050   4.071
  290    HB2  ALA  37           HB2      ALA  37 -17.302  -2.077   5.139
  291    HB3  ALA  37           HB3      ALA  37 -17.913  -2.572   3.560
  292    H    ASN  38           HN       ASN  38 -18.119  -3.389   7.396
  293    HA   ASN  38           HA       ASN  38 -15.669  -4.102   8.549
  294    HB2  ASN  38           HB2      ASN  38 -17.204  -2.504   9.635
  295    HB3  ASN  38           HB1      ASN  38 -18.392  -3.786   9.875
  296   HD21  ASN  38          HD21      ASN  38 -18.173  -5.191  11.580
  297   HD22  ASN  38          HD22      ASN  38 -16.909  -5.022  12.821
  298    H    ASP  39           HN       ASP  39 -18.757  -5.852   8.489
  299    HA   ASP  39           HA       ASP  39 -17.853  -8.061  10.015
  300    HB2  ASP  39           HB2      ASP  39 -20.240  -7.456   9.693
  301    HB3  ASP  39           HB1      ASP  39 -20.121  -7.972   8.013
  302    H    ASN  40           HN       ASN  40 -17.438  -7.207   6.702
  303    HA   ASN  40           HA       ASN  40 -16.827  -9.928   5.888
  304    HB2  ASN  40           HB2      ASN  40 -17.181  -7.323   4.469
  305    HB3  ASN  40           HB1      ASN  40 -16.244  -8.592   3.689
  306   HD21  ASN  40          HD21      ASN  40 -19.398  -7.539   4.692
  307   HD22  ASN  40          HD22      ASN  40 -20.284  -8.854   3.910
  308    H    GLY  41           HN       GLY  41 -15.250  -7.153   7.100
  309    HA2  GLY  41           HA2      GLY  41 -13.019  -7.102   7.841
  310    HA3  GLY  41           HA1      GLY  41 -12.671  -8.490   6.823
  311    H    VAL  42           HN       VAL  42 -14.377  -5.957   5.269
  312    HA   VAL  42           HA       VAL  42 -11.926  -5.223   3.872
  313    HB   VAL  42           HB       VAL  42 -14.792  -4.757   3.010
  314   HG11  VAL  42          HG11      VAL  42 -12.143  -4.484   1.576
  315   HG12  VAL  42          HG12      VAL  42 -13.220  -3.173   2.048
  316   HG13  VAL  42          HG13      VAL  42 -13.722  -4.323   0.806
  317   HG21  VAL  42          HG21      VAL  42 -12.816  -6.925   2.318
  318   HG22  VAL  42          HG22      VAL  42 -14.259  -6.584   1.359
  319   HG23  VAL  42          HG23      VAL  42 -14.420  -7.108   3.042
  320    H    ASP  43           HN       ASP  43 -11.073  -3.322   4.250
  321    HA   ASP  43           HA       ASP  43 -12.776  -1.052   4.888
  322    HB2  ASP  43           HB2      ASP  43 -12.009  -2.135   7.075
  323    HB3  ASP  43           HB1      ASP  43 -10.382  -1.630   6.634
  324    H    GLY  44           HN       GLY  44 -11.923   0.903   4.185
  325    HA2  GLY  44           HA2      GLY  44  -9.285   1.412   3.461
  326    HA3  GLY  44           HA1      GLY  44 -10.103   0.752   2.046
  327    H    GLU  45           HN       GLU  45  -9.484   3.022   1.296
  328    HA   GLU  45           HA       GLU  45 -10.835   5.283   2.303
  329    HB2  GLU  45           HB2      GLU  45  -9.766   4.718  -0.469
  330    HB3  GLU  45           HB1      GLU  45 -10.367   6.286   0.061
  331    HG2  GLU  45           HG2      GLU  45  -8.651   6.231   1.875
  332    HG3  GLU  45           HG1      GLU  45  -7.980   4.792   1.113
  333    H    TRP  46           HN       TRP  46 -12.642   6.410   1.388
  334    HA   TRP  46           HA       TRP  46 -14.632   4.525   0.296
  335    HB2  TRP  46           HB2      TRP  46 -14.825   6.429   2.582
  336    HB3  TRP  46           HB1      TRP  46 -16.241   6.289   1.554
  337    HD1  TRP  46           HD1      TRP  46 -13.828   3.902   3.439
  338    HE1  TRP  46           HE1      TRP  46 -15.163   1.912   4.327
  339    HE3  TRP  46           HE3      TRP  46 -18.503   5.154   1.658
  340    HZ2  TRP  46           HZ2      TRP  46 -17.794   1.015   4.317
  341    HZ3  TRP  46           HZ3      TRP  46 -20.373   3.664   2.207
  342    HH2  TRP  46           HH2      TRP  46 -20.020   1.629   3.508
  343    H    THR  47           HN       THR  47 -14.922   5.015  -1.764
  344    HA   THR  47           HA       THR  47 -14.973   7.832  -2.576
  345    HB   THR  47           HB       THR  47 -14.984   6.772  -4.927
  346    HG1  THR  47           HG1      THR  47 -13.739   4.603  -4.565
  347   HG21  THR  47          HG21      THR  47 -13.028   7.905  -3.991
  348   HG22  THR  47          HG22      THR  47 -12.545   6.482  -4.914
  349   HG23  THR  47          HG23      THR  47 -12.560   6.425  -3.153
  350    H    TYR  48           HN       TYR  48 -16.686   8.554  -4.018
  351    HA   TYR  48           HA       TYR  48 -19.061   6.934  -4.231
  352    HB2  TYR  48           HB2      TYR  48 -19.351   7.736  -1.972
  353    HB3  TYR  48           HB1      TYR  48 -18.997   9.362  -2.432
  354    HD1  TYR  48           HD1      TYR  48 -20.797  10.817  -2.641
  355    HD2  TYR  48           HD2      TYR  48 -21.412   6.661  -3.330
  356    HE1  TYR  48           HE1      TYR  48 -23.191  11.234  -2.978
  357    HE2  TYR  48           HE2      TYR  48 -23.813   7.073  -3.667
  358    HH   TYR  48           HH       TYR  48 -25.099  10.058  -4.242
  359    H    ASP  49           HN       ASP  49 -20.675   7.897  -5.572
  360    HA   ASP  49           HA       ASP  49 -19.868  10.401  -6.915
  361    HB2  ASP  49           HB2      ASP  49 -19.270   8.301  -8.308
  362    HB3  ASP  49           HB1      ASP  49 -21.009   8.130  -8.554
  363    H    ASP  50           HN       ASP  50 -21.642  11.706  -7.522
  364    HA   ASP  50           HA       ASP  50 -24.094  10.917  -6.097
  365    HB2  ASP  50           HB2      ASP  50 -23.019  13.144  -5.597
  366    HB3  ASP  50           HB1      ASP  50 -23.393  13.638  -7.244
  367    H    ALA  51           HN       ALA  51 -22.984  10.556  -9.149
  368    HA   ALA  51           HA       ALA  51 -25.505  11.163 -10.433
  369    HB1  ALA  51           HB1      ALA  51 -24.467  10.362 -12.480
  370    HB2  ALA  51           HB2      ALA  51 -23.070   9.791 -11.568
  371    HB3  ALA  51           HB3      ALA  51 -23.424  11.516 -11.655
  372    H    THR  52           HN       THR  52 -23.754   8.216  -9.441
  373    HA   THR  52           HA       THR  52 -26.122   6.690 -10.252
  374    HB   THR  52           HB       THR  52 -24.544   4.713 -10.194
  375    HG1  THR  52           HG1      THR  52 -22.601   5.082  -9.462
  376   HG21  THR  52          HG21      THR  52 -25.195   5.808 -12.299
  377   HG22  THR  52          HG22      THR  52 -23.523   5.252 -12.360
  378   HG23  THR  52          HG23      THR  52 -23.873   6.962 -12.108
  379    H    LYS  53           HN       LYS  53 -24.755   7.883  -7.474
  380    HA   LYS  53           HA       LYS  53 -25.031   7.444  -5.221
  381    HB2  LYS  53           HB2      LYS  53 -27.291   5.837  -6.384
  382    HB3  LYS  53           HB1      LYS  53 -26.928   5.741  -4.672
  383    HG2  LYS  53           HG2      LYS  53 -28.727   7.328  -5.156
  384    HG3  LYS  53           HG1      LYS  53 -27.336   8.107  -4.410
  385    HD2  LYS  53           HD2      LYS  53 -27.281   8.080  -7.336
  386    HD3  LYS  53           HD1      LYS  53 -28.618   8.998  -6.640
  387    HE2  LYS  53           HE2      LYS  53 -25.782   9.348  -5.724
  388    HE3  LYS  53           HE1      LYS  53 -26.451  10.257  -7.076
  389    HZ1  LYS  53           HZ1      LYS  53 -26.604  11.524  -5.043
  390    HZ2  LYS  53           HZ2      LYS  53 -27.468  10.278  -4.285
  391    HZ3  LYS  53           HZ3      LYS  53 -28.164  11.121  -5.582
  392    H    THR  54           HN       THR  54 -23.163   5.871  -6.841
  393    HA   THR  54           HA       THR  54 -23.234   3.255  -5.550
  394    HB   THR  54           HB       THR  54 -21.172   4.135  -7.559
  395    HG1  THR  54           HG1      THR  54 -23.907   3.594  -7.922
  396   HG21  THR  54          HG21      THR  54 -20.995   1.802  -8.061
  397   HG22  THR  54          HG22      THR  54 -22.504   1.433  -7.228
  398   HG23  THR  54          HG23      THR  54 -21.070   1.883  -6.297
  399    H    TYR  55           HN       TYR  55 -22.043   2.854  -3.796
  400    HA   TYR  55           HA       TYR  55 -19.814   4.650  -3.125
  401    HB2  TYR  55           HB2      TYR  55 -21.500   2.803  -1.431
  402    HB3  TYR  55           HB1      TYR  55 -19.891   3.263  -0.901
  403    HD1  TYR  55           HD1      TYR  55 -23.311   4.405  -1.494
  404    HD2  TYR  55           HD2      TYR  55 -19.426   5.552  -0.199
  405    HE1  TYR  55           HE1      TYR  55 -24.241   6.476  -0.559
  406    HE2  TYR  55           HE2      TYR  55 -20.347   7.628   0.740
  407    HH   TYR  55           HH       TYR  55 -23.733   8.164   1.048
  408    H    THR  56           HN       THR  56 -17.760   3.792  -2.632
  409    HA   THR  56           HA       THR  56 -17.361   0.962  -3.257
  410    HB   THR  56           HB       THR  56 -15.859   3.209  -4.616
  411    HG1  THR  56           HG1      THR  56 -18.118   1.974  -5.215
  412   HG21  THR  56          HG21      THR  56 -14.335   1.381  -4.182
  413   HG22  THR  56          HG22      THR  56 -14.787   1.338  -5.889
  414   HG23  THR  56          HG23      THR  56 -15.521   0.206  -4.752
  415    H    VAL  57           HN       VAL  57 -16.018   0.020  -1.892
  416    HA   VAL  57           HA       VAL  57 -14.243   1.742  -0.287
  417    HB   VAL  57           HB       VAL  57 -15.850   0.523   1.171
  418   HG11  VAL  57          HG11      VAL  57 -14.645  -1.943  -0.055
  419   HG12  VAL  57          HG12      VAL  57 -16.350  -1.488   0.029
  420   HG13  VAL  57          HG13      VAL  57 -15.485  -1.954   1.489
  421   HG21  VAL  57          HG21      VAL  57 -13.644   1.108   2.020
  422   HG22  VAL  57          HG22      VAL  57 -13.010  -0.437   1.459
  423   HG23  VAL  57          HG23      VAL  57 -14.224  -0.396   2.736
  424    H    THR  58           HN       THR  58 -12.238   1.687  -0.935
  425    HA   THR  58           HA       THR  58 -11.361  -0.596  -2.565
  426    HB   THR  58           HB       THR  58 -10.146   2.162  -2.456
  427    HG1  THR  58           HG1      THR  58 -12.485   1.689  -3.308
  428   HG21  THR  58          HG21      THR  58  -8.677   0.389  -3.335
  429   HG22  THR  58          HG22      THR  58  -9.142   1.536  -4.589
  430   HG23  THR  58          HG23      THR  58  -9.920  -0.044  -4.509
  431    H    GLU  59           HN       GLU  59  -9.881  -1.917  -1.814
  432    HA   GLU  59           HA       GLU  59  -8.323  -1.203   0.554
  433    HB2  GLU  59           HB2      GLU  59  -9.629  -3.446   0.090
  434    HB3  GLU  59           HB1      GLU  59  -8.196  -3.860  -0.837
  435    HG2  GLU  59           HG2      GLU  59  -8.380  -3.301   2.102
  436    HG3  GLU  59           HG1      GLU  59  -8.020  -4.831   1.317
  437    H    GLY  60           HN       GLY  60  -6.313  -0.239   0.106
  438    HA2  GLY  60           HA2      GLY  60  -4.095  -0.631  -0.838
  439    HA3  GLY  60           HA1      GLY  60  -4.891  -1.212  -2.299
  440    H    SER  61           HN       SER  61  -3.442   1.417  -0.833
  441    HA   SER  61           HA       SER  61  -4.673   3.270  -2.753
  442    HB2  SER  61           HB2      SER  61  -3.776   3.911   0.065
  443    HB3  SER  61           HB1      SER  61  -4.488   5.048  -1.081
  444    HG   SER  61           HG       SER  61  -6.369   4.387  -0.481
  445    H    GLY  62           HN       GLY  62  -3.266   5.241  -3.089
  446    HA2  GLY  62           HA2      GLY  62  -1.128   6.262  -3.066
  447    HA3  GLY  62           HA1      GLY  62  -0.411   4.693  -2.732
  448    H    GLY  63           HN       GLY  63   0.683   6.268  -4.651
  449    HA2  GLY  63           HA2      GLY  63   0.007   4.761  -7.095
  450    HA3  GLY  63           HA1      GLY  63   0.322   6.491  -7.147
  451    H    ALA  64           HN       ALA  64   2.193   5.127  -4.785
  452    HA   ALA  64           HA       ALA  64   4.344   4.477  -4.549
  453    HB1  ALA  64           HB1      ALA  64   5.598   3.487  -6.394
  454    HB2  ALA  64           HB2      ALA  64   4.331   3.964  -7.522
  455    HB3  ALA  64           HB3      ALA  64   3.989   2.784  -6.255
  456    H    GLY  65           HN       GLY  65   4.277   6.183  -7.698
  457    HA2  GLY  65           HA2      GLY  65   5.080   8.657  -7.025
  458    HA3  GLY  65           HA1      GLY  65   6.585   7.753  -6.903
  459    H    GLY  66           HN       GLY  66   7.007   9.492  -8.660
  460    HA2  GLY  66           HA2      GLY  66   6.101   8.497 -11.287
  461    HA3  GLY  66           HA1      GLY  66   6.621  10.144 -10.966
  462    H    GLN  67           HN       GLN  67   8.968   9.585  -9.509
  463    HA   GLN  67           HA       GLN  67  10.606   8.069 -11.426
  464    HB2  GLN  67           HB2      GLN  67  10.789  10.485 -11.969
  465    HB3  GLN  67           HB1      GLN  67  11.336  10.798 -10.302
  466    HG2  GLN  67           HG2      GLN  67  13.269   9.313 -10.725
  467    HG3  GLN  67           HG1      GLN  67  12.751   9.152 -12.401
  468   HE21  GLN  67          HE21      GLN  67  15.229  10.229 -11.333
  469   HE22  GLN  67          HE22      GLN  67  15.348  11.852 -11.917
  470    H    GLY  68           HN       GLY  68  11.269   6.418 -10.224
  471    HA2  GLY  68           HA2      GLY  68  13.033   6.913  -8.008
  472    HA3  GLY  68           HA1      GLY  68  11.509   6.185  -7.524
  473    H    MET  69           HN       MET  69  13.649   5.697 -10.316
  474    HA   MET  69           HA       MET  69  14.209   2.991  -9.430
  475    HB2  MET  69           HB2      MET  69  12.140   2.695 -10.698
  476    HB3  MET  69           HB1      MET  69  12.839   3.541 -12.072
  477    HG2  MET  69           HG2      MET  69  12.830   1.149 -12.435
  478    HG3  MET  69           HG1      MET  69  14.478   1.769 -12.351
  479    HE1  MET  69           HE1      MET  69  13.651  -1.292 -12.155
  480    HE2  MET  69           HE2      MET  69  14.696  -1.856 -10.853
  481    HE3  MET  69           HE3      MET  69  15.330  -0.754 -12.079
  482    H    ILE  70           HN       ILE  70  16.310   3.838  -9.235
  483    HA   ILE  70           HA       ILE  70  17.786   3.803 -11.749
  484    HB   ILE  70           HB       ILE  70  18.139   6.010  -9.684
  485   HG12  ILE  70          HG12      ILE  70  17.333   6.173 -12.595
  486   HG13  ILE  70          HG11      ILE  70  16.237   6.341 -11.230
  487   HG21  ILE  70          HG21      ILE  70  19.703   5.580 -12.251
  488   HG22  ILE  70          HG22      ILE  70  20.293   5.176 -10.640
  489   HG23  ILE  70          HG23      ILE  70  19.951   6.856 -11.057
  490   HD11  ILE  70          HD11      ILE  70  17.447   8.343 -10.513
  491   HD12  ILE  70          HD12      ILE  70  16.826   8.508 -12.154
  492   HD13  ILE  70          HD13      ILE  70  18.538   8.178 -11.889
  493    H    GLN  71           HN       GLN  71  18.746   1.810 -11.170
  494    HA   GLN  71           HA       GLN  71  20.438   1.922  -8.772
  495    HB2  GLN  71           HB2      GLN  71  20.014  -0.398  -8.321
  496    HB3  GLN  71           HB1      GLN  71  18.466   0.419  -8.484
  497    HG2  GLN  71           HG2      GLN  71  18.308  -0.430 -10.802
  498    HG3  GLN  71           HG1      GLN  71  19.809  -1.320 -10.545
  499   HE21  GLN  71          HE21      GLN  71  17.226  -2.398 -11.208
  500   HE22  GLN  71          HE22      GLN  71  16.755  -3.443  -9.902
  501    H    GLU  72           HN       GLU  72  20.681   2.240 -11.829
  502    HA   GLU  72           HA       GLU  72  22.683   0.192 -12.391
  503    HB2  GLU  72           HB2      GLU  72  21.511   2.305 -14.204
  504    HB3  GLU  72           HB1      GLU  72  22.622   1.036 -14.702
  505    HG2  GLU  72           HG2      GLU  72  20.899  -0.626 -13.920
  506    HG3  GLU  72           HG1      GLU  72  19.789   0.730 -13.735
  507    HA   PRO  73           HA       PRO  73  26.032   2.871 -11.436
  508    HB2  PRO  73           HB2      PRO  73  27.968   1.873 -13.074
  509    HB3  PRO  73           HB1      PRO  73  27.392   1.012 -11.597
  510    HG2  PRO  73           HG2      PRO  73  26.596   0.598 -14.473
  511    HG3  PRO  73           HG1      PRO  73  26.993  -0.612 -13.235
  512    HD2  PRO  73           HD2      PRO  73  24.447  -0.006 -13.896
  513    HD3  PRO  73           HD1      PRO  73  24.917  -0.438 -12.220
  514    H    ALA  74           HN       ALA  74  27.806   4.141 -12.514
  515    HA   ALA  74           HA       ALA  74  27.334   5.044 -15.193
  516    HB1  ALA  74           HB1      ALA  74  25.639   6.352 -14.017
  517    HB2  ALA  74           HB2      ALA  74  26.932   7.398 -14.598
  518    HB3  ALA  74           HB3      ALA  74  26.860   6.949 -12.894
  519    H    LEU  75           HN       LEU  75  28.846   7.143 -15.482
  520    HA   LEU  75           HA       LEU  75  31.448   6.303 -14.462
  521    HB2  LEU  75           HB2      LEU  75  30.674   8.139 -16.729
  522    HB3  LEU  75           HB1      LEU  75  32.322   7.939 -16.186
  523    HG   LEU  75           HG       LEU  75  32.072   6.599 -18.110
  524   HD11  LEU  75          HD11      LEU  75  31.868   4.805 -15.698
  525   HD12  LEU  75          HD12      LEU  75  33.343   5.541 -16.328
  526   HD13  LEU  75          HD13      LEU  75  32.481   4.335 -17.284
  527   HD21  LEU  75          HD21      LEU  75  29.637   6.497 -18.190
  528   HD22  LEU  75          HD22      LEU  75  29.635   5.365 -16.837
  529   HD23  LEU  75          HD23      LEU  75  30.351   4.895 -18.380
  530    HA   PRO  76           HA       PRO  76  31.633   9.812 -11.716
  531    HB2  PRO  76           HB2      PRO  76  34.556   9.933 -12.139
  532    HB3  PRO  76           HB1      PRO  76  33.689   9.548 -10.648
  533    HG2  PRO  76           HG2      PRO  76  35.054   7.661 -11.964
  534    HG3  PRO  76           HG1      PRO  76  33.453   7.298 -11.215
  535    HD2  PRO  76           HD2      PRO  76  34.050   7.946 -14.133
  536    HD3  PRO  76           HD1      PRO  76  33.097   6.610 -13.453
  537    HA   PRO  77           HA       PRO  77  31.657  13.564 -14.075
  538    HB2  PRO  77           HB2      PRO  77  33.224  14.598 -11.718
  539    HB3  PRO  77           HB1      PRO  77  31.858  15.356 -12.558
  540    HG2  PRO  77           HG2      PRO  77  31.368  14.148 -10.301
  541    HG3  PRO  77           HG1      PRO  77  30.330  13.801 -11.700
  542    HD2  PRO  77           HD2      PRO  77  32.566  12.117 -10.560
  543    HD3  PRO  77           HD1      PRO  77  30.928  11.618 -11.131
  544    H    GLY  78           HN       GLY  78  32.907  14.023 -15.736
  545    HA2  GLY  78           HA2      GLY  78  34.861  14.840 -16.772
  546    HA3  GLY  78           HA1      GLY  78  35.781  14.375 -15.353
  547    H    TRP  79           HN       TRP  79  34.517  11.589 -15.480
  548    HA   TRP  79           HA       TRP  79  36.492  10.523 -17.375
  549    HB2  TRP  79           HB2      TRP  79  34.679   9.169 -15.352
  550    HB3  TRP  79           HB1      TRP  79  35.718   8.285 -16.455
  551    HD1  TRP  79           HD1      TRP  79  35.943  10.689 -13.441
  552    HE1  TRP  79           HE1      TRP  79  38.255  10.366 -12.344
  553    HE3  TRP  79           HE3      TRP  79  38.005   7.435 -16.810
  554    HZ2  TRP  79           HZ2      TRP  79  40.637   8.904 -12.844
  555    HZ3  TRP  79           HZ3      TRP  79  40.280   6.622 -16.428
  556    HH2  TRP  79           HH2      TRP  79  41.572   7.338 -14.489
  557    H    GLU  80           HN       GLU  80  35.974   9.489 -19.293
  558    HA   GLU  80           HA       GLU  80  33.130   9.096 -19.893
  559    HB2  GLU  80           HB2      GLU  80  35.211  10.304 -21.731
  560    HB3  GLU  80           HB1      GLU  80  33.576   9.879 -22.220
  561    HG2  GLU  80           HG2      GLU  80  32.679  11.522 -20.668
  562    HG3  GLU  80           HG1      GLU  80  34.311  11.926 -20.131
  563    H    MET  81           HN       MET  81  32.680   7.153 -20.686
  564    HA   MET  81           HA       MET  81  34.873   5.370 -21.425
  565    HB2  MET  81           HB2      MET  81  33.442   4.341 -19.849
  566    HB3  MET  81           HB1      MET  81  31.979   4.909 -20.688
  567    HG2  MET  81           HG2      MET  81  32.292   3.348 -22.447
  568    HG3  MET  81           HG1      MET  81  33.897   2.912 -21.868
  569    HE1  MET  81           HE1      MET  81  32.744   0.352 -22.314
  570    HE2  MET  81           HE2      MET  81  31.154   1.076 -22.569
  571    HE3  MET  81           HE3      MET  81  31.358  -0.208 -21.375
  572    H    LYS  82           HN       LYS  82  35.163   4.638 -23.534
  573    HA   LYS  82           HA       LYS  82  33.165   5.343 -25.538
  574    HB2  LYS  82           HB2      LYS  82  35.991   6.398 -25.830
  575    HB3  LYS  82           HB1      LYS  82  34.644   6.680 -26.915
  576    HG2  LYS  82           HG2      LYS  82  34.171   7.601 -24.164
  577    HG3  LYS  82           HG1      LYS  82  35.518   8.416 -25.008
  578    HD2  LYS  82           HD2      LYS  82  33.944   8.863 -26.891
  579    HD3  LYS  82           HD1      LYS  82  32.637   8.196 -25.903
  580    HE2  LYS  82           HE2      LYS  82  32.641  10.604 -25.698
  581    HE3  LYS  82           HE1      LYS  82  33.135   9.888 -24.170
  582    HZ1  LYS  82           HZ1      LYS  82  34.774  11.329 -26.154
  583    HZ2  LYS  82           HZ2      LYS  82  35.492  10.270 -25.052
  584    HZ3  LYS  82           HZ3      LYS  82  34.627  11.612 -24.487
  585    H    TYR  83           HN       TYR  83  33.623   4.333 -27.621
  586    HA   TYR  83           HA       TYR  83  35.494   2.046 -27.403
  587    HB2  TYR  83           HB2      TYR  83  32.839   2.283 -28.875
  588    HB3  TYR  83           HB1      TYR  83  33.985   0.949 -29.152
  589    HD1  TYR  83           HD1      TYR  83  34.428  -0.662 -27.290
  590    HD2  TYR  83           HD2      TYR  83  31.362   2.282 -27.046
  591    HE1  TYR  83           HE1      TYR  83  33.320  -1.971 -25.524
  592    HE2  TYR  83           HE2      TYR  83  30.254   0.988 -25.273
  593    HH   TYR  83           HH       TYR  83  31.743  -1.644 -23.680
  594    H    THR  84           HN       THR  84  36.854   1.638 -29.170
  595    HA   THR  84           HA       THR  84  37.113   3.742 -31.135
  596    HB   THR  84           HB       THR  84  38.990   2.456 -32.038
  597    HG1  THR  84           HG1      THR  84  39.519   0.471 -30.747
  598   HG21  THR  84          HG21      THR  84  39.437   3.856 -30.089
  599   HG22  THR  84          HG22      THR  84  40.460   2.424 -30.090
  600   HG23  THR  84          HG23      THR  84  39.062   2.506 -29.022
  601    H    SER  85           HN       SER  85  37.666   2.608 -33.485
  602    HA   SER  85           HA       SER  85  35.208   2.069 -34.641
  603    HB2  SER  85           HB2      SER  85  36.717   1.233 -36.578
  604    HB3  SER  85           HB1      SER  85  36.862   2.913 -36.057
  605    HG   SER  85           HG       SER  85  38.919   2.027 -36.208
  606    H    GLU  86           HN       GLU  86  37.813  -0.226 -33.845
  607    HA   GLU  86           HA       GLU  86  36.160  -2.508 -34.663
  608    HB2  GLU  86           HB2      GLU  86  38.915  -2.317 -33.415
  609    HB3  GLU  86           HB1      GLU  86  38.129  -3.844 -33.802
  610    HG2  GLU  86           HG2      GLU  86  37.997  -3.112 -36.163
  611    HG3  GLU  86           HG1      GLU  86  38.926  -1.675 -35.726
  612    H    GLY  87           HN       GLY  87  35.794  -0.638 -32.109
  613    HA2  GLY  87           HA2      GLY  87  34.456  -1.063 -30.260
  614    HA3  GLY  87           HA1      GLY  87  34.605  -2.780 -30.580
  615    H    VAL  88           HN       VAL  88  37.499  -0.847 -30.287
  616    HA   VAL  88           HA       VAL  88  38.259  -2.372 -27.948
  617    HB   VAL  88           HB       VAL  88  39.724  -0.176 -29.427
  618   HG11  VAL  88          HG11      VAL  88  40.699  -1.984 -27.227
  619   HG12  VAL  88          HG12      VAL  88  40.427  -0.247 -27.109
  620   HG13  VAL  88          HG13      VAL  88  41.696  -0.870 -28.162
  621   HG21  VAL  88          HG21      VAL  88  41.085  -1.939 -30.354
  622   HG22  VAL  88          HG22      VAL  88  39.388  -2.291 -30.681
  623   HG23  VAL  88          HG23      VAL  88  40.232  -3.149 -29.395
  624    H    ARG  89           HN       ARG  89  37.961  -1.766 -25.929
  625    HA   ARG  89           HA       ARG  89  36.532   0.635 -25.311
  626    HB2  ARG  89           HB2      ARG  89  36.231  -1.596 -24.188
  627    HB3  ARG  89           HB1      ARG  89  37.784  -1.356 -23.414
  628    HG2  ARG  89           HG2      ARG  89  36.887   0.697 -22.350
  629    HG3  ARG  89           HG1      ARG  89  35.312   0.322 -23.051
  630    HD2  ARG  89           HD2      ARG  89  35.628  -1.976 -21.892
  631    HD3  ARG  89           HD1      ARG  89  36.834  -1.132 -20.923
  632    HE   ARG  89           HE       ARG  89  34.522   0.401 -20.874
  633   HH11  ARG  89          HH11      ARG  89  35.659  -2.705 -19.697
  634   HH12  ARG  89          HH12      ARG  89  34.400  -2.833 -18.504
  635   HH21  ARG  89          HH21      ARG  89  32.885   0.215 -19.278
  636   HH22  ARG  89          HH22      ARG  89  32.859  -1.188 -18.246
  637    H    TYR  90           HN       TYR  90  37.447   2.582 -24.996
  638    HA   TYR  90           HA       TYR  90  39.977   2.633 -23.532
  639    HB2  TYR  90           HB2      TYR  90  40.931   4.368 -24.881
  640    HB3  TYR  90           HB1      TYR  90  40.457   3.057 -25.934
  641    HD1  TYR  90           HD1      TYR  90  38.323   3.318 -27.281
  642    HD2  TYR  90           HD2      TYR  90  40.192   6.563 -25.280
  643    HE1  TYR  90           HE1      TYR  90  37.028   4.893 -28.653
  644    HE2  TYR  90           HE2      TYR  90  38.914   8.159 -26.649
  645    HH   TYR  90           HH       TYR  90  36.234   7.291 -28.439
  646    H    PHE  91           HN       PHE  91  40.289   4.691 -22.306
  647    HA   PHE  91           HA       PHE  91  37.664   5.864 -21.687
  648    HB2  PHE  91           HB2      PHE  91  39.915   5.068 -19.874
  649    HB3  PHE  91           HB1      PHE  91  38.833   6.370 -19.407
  650    HD1  PHE  91           HD1      PHE  91  36.933   5.827 -18.180
  651    HD2  PHE  91           HD2      PHE  91  38.687   2.874 -20.698
  652    HE1  PHE  91           HE1      PHE  91  35.326   4.177 -17.360
  653    HE2  PHE  91           HE2      PHE  91  37.063   1.215 -19.882
  654    HZ   PHE  91           HZ       PHE  91  35.346   1.907 -18.192
  655    H    VAL  92           HN       VAL  92  37.517   8.031 -21.275
  656    HA   VAL  92           HA       VAL  92  39.762   9.613 -22.332
  657    HB   VAL  92           HB       VAL  92  36.798  10.196 -22.474
  658   HG11  VAL  92          HG11      VAL  92  38.171  12.230 -22.312
  659   HG12  VAL  92          HG12      VAL  92  37.384  12.079 -23.884
  660   HG13  VAL  92          HG13      VAL  92  39.101  11.700 -23.715
  661   HG21  VAL  92          HG21      VAL  92  36.976   9.783 -24.847
  662   HG22  VAL  92          HG22      VAL  92  37.515   8.361 -23.953
  663   HG23  VAL  92          HG23      VAL  92  38.697   9.441 -24.689
  664    H    ASP  93           HN       ASP  93  40.762  10.646 -20.705
  665    HA   ASP  93           HA       ASP  93  39.308  11.558 -18.341
  666    HB2  ASP  93           HB2      ASP  93  42.196  11.775 -19.244
  667    HB3  ASP  93           HB1      ASP  93  41.589  12.747 -17.915
  668    H    HIS  94           HN       HIS  94  37.803  13.096 -19.068
  669    HA   HIS  94           HA       HIS  94  38.536  15.079 -21.025
  670    HB2  HIS  94           HB2      HIS  94  36.180  13.953 -20.547
  671    HB3  HIS  94           HB1      HIS  94  36.026  15.280 -19.402
  672    HD1  HIS  94           HD1      HIS  94  34.294  14.882 -22.056
  673    HD2  HIS  94           HD2      HIS  94  37.559  17.420 -21.592
  674    HE1  HIS  94           HE1      HIS  94  34.028  16.667 -23.810
  675    HE2  HIS  94           HE2      HIS  94  36.108  18.080 -23.634
  676    H    ASN  95           HN       ASN  95  39.496  14.815 -18.014
  677    HA   ASN  95           HA       ASN  95  38.968  17.542 -17.134
  678    HB2  ASN  95           HB2      ASN  95  40.205  16.880 -15.049
  679    HB3  ASN  95           HB1      ASN  95  38.800  15.868 -15.374
  680   HD21  ASN  95          HD21      ASN  95  39.089  13.721 -15.926
  681   HD22  ASN  95          HD22      ASN  95  40.614  12.915 -15.764
  682    H    THR  96           HN       THR  96  41.848  15.486 -17.761
  683    HA   THR  96           HA       THR  96  43.408  17.938 -18.059
  684    HB   THR  96           HB       THR  96  45.364  16.279 -18.029
  685    HG1  THR  96           HG1      THR  96  44.347  14.338 -18.372
  686   HG21  THR  96          HG21      THR  96  43.586  16.525 -15.588
  687   HG22  THR  96          HG22      THR  96  44.793  17.698 -16.112
  688   HG23  THR  96          HG23      THR  96  45.302  16.101 -15.570
  689    H    ARG  97           HN       ARG  97  41.666  16.093 -20.032
  690    HA   ARG  97           HA       ARG  97  41.612  15.680 -22.273
  691    HB2  ARG  97           HB2      ARG  97  43.592  17.915 -22.164
  692    HB3  ARG  97           HB1      ARG  97  43.268  17.090 -23.686
  693    HG2  ARG  97           HG2      ARG  97  40.912  17.621 -23.490
  694    HG3  ARG  97           HG1      ARG  97  41.202  18.412 -21.942
  695    HD2  ARG  97           HD2      ARG  97  41.007  19.997 -23.832
  696    HD3  ARG  97           HD1      ARG  97  42.559  20.089 -23.005
  697    HE   ARG  97           HE       ARG  97  42.809  18.310 -25.154
  698   HH11  ARG  97          HH11      ARG  97  42.288  21.707 -24.572
  699   HH12  ARG  97          HH12      ARG  97  43.067  22.227 -26.034
  700   HH21  ARG  97          HH21      ARG  97  43.817  18.946 -27.090
  701   HH22  ARG  97          HH22      ARG  97  43.914  20.641 -27.504
  702    H    THR  98           HN       THR  98  42.285  13.609 -21.783
  703    HA   THR  98           HA       THR  98  44.749  12.814 -23.072
  704    HB   THR  98           HB       THR  98  45.182  11.332 -20.870
  705    HG1  THR  98           HG1      THR  98  43.716  12.131 -19.471
  706   HG21  THR  98          HG21      THR  98  46.884  12.764 -21.919
  707   HG22  THR  98          HG22      THR  98  46.899  12.978 -20.165
  708   HG23  THR  98          HG23      THR  98  46.146  14.195 -21.197
  709    H    THR  99           HN       THR  99  44.833  10.442 -23.374
  710    HA   THR  99           HA       THR  99  42.214   9.138 -22.920
  711    HB   THR  99           HB       THR  99  42.873   7.791 -25.066
  712    HG1  THR  99           HG1      THR  99  44.133   9.224 -26.517
  713   HG21  THR  99          HG21      THR  99  42.056  10.726 -25.255
  714   HG22  THR  99          HG22      THR  99  40.958   9.360 -25.052
  715   HG23  THR  99          HG23      THR  99  41.864   9.551 -26.557
  716    H    THR 100           HN       THR 100  42.328   7.065 -21.984
  717    HA   THR 100           HA       THR 100  44.961   5.810 -21.846
  718    HB   THR 100           HB       THR 100  44.808   7.199 -19.816
  719    HG1  THR 100           HG1      THR 100  45.923   5.611 -19.008
  720   HG21  THR 100          HG21      THR 100  43.185   6.530 -18.042
  721   HG22  THR 100          HG22      THR 100  42.370   5.515 -19.235
  722   HG23  THR 100          HG23      THR 100  42.428   7.263 -19.457
  723    H    PHE 101           HN       PHE 101  44.894   3.591 -21.091
  724    HA   PHE 101           HA       PHE 101  42.330   2.315 -21.737
  725    HB2  PHE 101           HB2      PHE 101  45.189   1.451 -22.169
  726    HB3  PHE 101           HB1      PHE 101  43.841   0.239 -22.111
  727    HD1  PHE 101           HD1      PHE 101  42.441  -0.061 -23.949
  728    HD2  PHE 101           HD2      PHE 101  45.142   3.219 -23.916
  729    HE1  PHE 101           HE1      PHE 101  41.959   0.350 -26.318
  730    HE2  PHE 101           HE2      PHE 101  44.665   3.649 -26.294
  731    HZ   PHE 101           HZ       PHE 101  43.072   2.211 -27.497
  732    H    LYS 102           HN       LYS 102  41.370   2.091 -19.776
  733    HA   LYS 102           HA       LYS 102  42.758   0.376 -17.861
  734    HB2  LYS 102           HB2      LYS 102  42.609   3.077 -17.431
  735    HB3  LYS 102           HB1      LYS 102  41.151   2.514 -16.626
  736    HG2  LYS 102           HG2      LYS 102  43.927   1.479 -16.091
  737    HG3  LYS 102           HG1      LYS 102  43.086   2.687 -15.122
  738    HD2  LYS 102           HD2      LYS 102  42.073  -0.111 -15.609
  739    HD3  LYS 102           HD1      LYS 102  42.991   0.376 -14.185
  740    HE2  LYS 102           HE2      LYS 102  41.260   1.956 -13.571
  741    HE3  LYS 102           HE1      LYS 102  40.356   1.576 -15.036
  742    HZ1  LYS 102           HZ1      LYS 102  39.459   0.416 -13.122
  743    HZ2  LYS 102           HZ2      LYS 102  40.958  -0.323 -12.829
  744    HZ3  LYS 102           HZ3      LYS 102  40.092  -0.689 -14.238
  745    H    ASP 103           HN       ASP 103  41.511  -1.342 -17.729
  746    HA   ASP 103           HA       ASP 103  38.592  -1.027 -17.787
  747    HB2  ASP 103           HB2      ASP 103  39.592  -2.583 -19.456
  748    HB3  ASP 103           HB1      ASP 103  40.252  -3.544 -18.137
  749    HA   PRO 104           HA       PRO 104  38.195  -1.739 -13.438
  750    HB2  PRO 104           HB2      PRO 104  36.145  -3.719 -13.687
  751    HB3  PRO 104           HB1      PRO 104  35.932  -2.007 -13.320
  752    HG2  PRO 104           HG2      PRO 104  35.660  -3.440 -15.888
  753    HG3  PRO 104           HG1      PRO 104  34.886  -1.940 -15.347
  754    HD2  PRO 104           HD2      PRO 104  36.839  -1.957 -17.196
  755    HD3  PRO 104           HD1      PRO 104  36.678  -0.636 -16.020
  756    H    ARG 105           HN       ARG 105  38.268  -4.576 -15.577
  757    HA   ARG 105           HA       ARG 105  39.623  -6.045 -13.428
  758    HB2  ARG 105           HB2      ARG 105  37.795  -6.926 -15.612
  759    HB3  ARG 105           HB1      ARG 105  39.038  -8.041 -15.068
  760    HG2  ARG 105           HG2      ARG 105  36.922  -8.444 -13.937
  761    HG3  ARG 105           HG1      ARG 105  38.173  -7.931 -12.796
  762    HD2  ARG 105           HD2      ARG 105  37.225  -5.577 -13.088
  763    HD3  ARG 105           HD1      ARG 105  35.843  -6.356 -13.863
  764    HE   ARG 105           HE       ARG 105  35.911  -7.712 -11.598
  765   HH11  ARG 105          HH11      ARG 105  36.370  -4.290 -12.095
  766   HH12  ARG 105          HH12      ARG 105  35.711  -3.828 -10.556
  767   HH21  ARG 105          HH21      ARG 105  35.065  -7.146  -9.559
  768   HH22  ARG 105          HH22      ARG 105  34.936  -5.466  -9.118
  769    HA   PRO 106           HA       PRO 106  43.054  -5.424 -16.289
  770    HB2  PRO 106           HB2      PRO 106  45.076  -6.006 -14.616
  771    HB3  PRO 106           HB1      PRO 106  44.125  -4.477 -14.452
  772    HG2  PRO 106           HG2      PRO 106  43.913  -7.040 -12.897
  773    HG3  PRO 106           HG1      PRO 106  43.861  -5.366 -12.318
  774    HD2  PRO 106           HD2      PRO 106  41.644  -6.934 -12.755
  775    HD3  PRO 106           HD1      PRO 106  41.648  -5.135 -12.786
  776    H    GLY 107           HN       GLY 107  43.806  -6.797 -17.755
  777    HA2  GLY 107           HA2      GLY 107  44.959  -8.632 -18.571
  778    HA3  GLY 107           HA1      GLY 107  44.858  -9.396 -16.970
  779    H    PHE 108           HN       PHE 108  41.912  -8.996 -16.857
  780    HA   PHE 108           HA       PHE 108  40.144 -10.491 -17.066
  781    HB2  PHE 108           HB2      PHE 108  39.158 -10.465 -19.373
  782    HB3  PHE 108           HB1      PHE 108  39.559  -8.839 -18.724
  783    HD1  PHE 108           HD1      PHE 108  41.214  -7.482 -19.795
  784    HD2  PHE 108           HD2      PHE 108  40.483 -11.444 -21.199
  785    HE1  PHE 108           HE1      PHE 108  42.499  -6.997 -21.834
  786    HE2  PHE 108           HE2      PHE 108  41.771 -10.959 -23.231
  787    HZ   PHE 108           HZ       PHE 108  42.741  -8.753 -23.578
  788    H    GLU 109           HN       GLU 109  42.701 -11.844 -17.085
  789    HA   GLU 109           HA       GLU 109  43.573 -13.907 -17.310
  790    HB2  GLU 109           HB2      GLU 109  41.576 -14.752 -16.284
  791    HB3  GLU 109           HB1      GLU 109  40.659 -14.578 -17.770
  792    HG2  GLU 109           HG2      GLU 109  42.098 -16.379 -18.771
  793    HG3  GLU 109           HG1      GLU 109  42.788 -16.637 -17.165
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1 -39.973   7.682   4.338
    2    H2   GLY   1           HT2      GLY   1 -40.230   9.204   5.036
    3    H3   GLY   1           HT3      GLY   1 -38.723   8.831   4.355
    4    HA2  GLY   1           HA1      GLY   1 -41.298   9.140   2.916
    5    HA3  GLY   1           HA2      GLY   1 -39.943  10.259   2.870
    6    H    SER   2           HN       SER   2 -40.858   6.915   2.131
    7    HA   SER   2           HA       SER   2 -40.382   5.567   0.373
    8    HB2  SER   2           HB2      SER   2 -40.811   7.631  -0.990
    9    HB3  SER   2           HB1      SER   2 -39.084   7.968  -0.943
   10    HG   SER   2           HG       SER   2 -38.824   6.585  -2.496
   11    H    HIS   3           HN       HIS   3 -38.378   4.886  -1.080
   12    HA   HIS   3           HA       HIS   3 -35.989   4.926   0.652
   13    HB2  HIS   3           HB2      HIS   3 -37.068   2.642  -1.027
   14    HB3  HIS   3           HB1      HIS   3 -35.492   2.642  -0.252
   15    HD1  HIS   3           HD1      HIS   3 -37.206   0.386   0.522
   16    HD2  HIS   3           HD2      HIS   3 -37.455   4.070   2.452
   17    HE1  HIS   3           HE1      HIS   3 -38.218  -0.085   2.779
   18    HE2  HIS   3           HE2      HIS   3 -38.550   2.177   3.831
   19    H    MET   4           HN       MET   4 -33.938   4.578  -0.543
   20    HA   MET   4           HA       MET   4 -34.067   5.103  -3.419
   21    HB2  MET   4           HB2      MET   4 -32.278   6.552  -1.449
   22    HB3  MET   4           HB1      MET   4 -32.081   6.617  -3.191
   23    HG2  MET   4           HG2      MET   4 -34.373   7.566  -3.347
   24    HG3  MET   4           HG1      MET   4 -34.412   7.632  -1.588
   25    HE1  MET   4           HE1      MET   4 -31.307   8.287  -3.924
   26    HE2  MET   4           HE2      MET   4 -31.456  10.023  -4.203
   27    HE3  MET   4           HE3      MET   4 -32.674   8.917  -4.840
   28    H    GLN   5           HN       GLN   5 -32.611   3.883  -4.574
   29    HA   GLN   5           HA       GLN   5 -31.377   1.731  -3.125
   30    HB2  GLN   5           HB2      GLN   5 -32.566   1.414  -5.289
   31    HB3  GLN   5           HB1      GLN   5 -31.285   2.318  -6.083
   32    HG2  GLN   5           HG2      GLN   5 -30.906  -0.028  -6.394
   33    HG3  GLN   5           HG1      GLN   5 -29.663   0.620  -5.331
   34   HE21  GLN   5          HE21      GLN   5 -32.553  -1.310  -5.532
   35   HE22  GLN   5          HE22      GLN   5 -32.335  -2.138  -4.003
   36    H    TYR   6           HN       TYR   6 -29.308   1.426  -2.698
   37    HA   TYR   6           HA       TYR   6 -27.307   3.218  -3.898
   38    HB2  TYR   6           HB2      TYR   6 -27.723   2.534  -0.993
   39    HB3  TYR   6           HB1      TYR   6 -26.075   2.782  -1.560
   40    HD1  TYR   6           HD1      TYR   6 -29.320   4.372  -0.911
   41    HD2  TYR   6           HD2      TYR   6 -25.328   4.991  -2.244
   42    HE1  TYR   6           HE1      TYR   6 -29.603   6.797  -0.633
   43    HE2  TYR   6           HE2      TYR   6 -25.601   7.415  -1.964
   44    HH   TYR   6           HH       TYR   6 -27.362   9.068  -1.861
   45    H    LYS   7           HN       LYS   7 -25.161   2.260  -4.042
   46    HA   LYS   7           HA       LYS   7 -25.163  -0.677  -3.896
   47    HB2  LYS   7           HB2      LYS   7 -25.684  -0.303  -6.231
   48    HB3  LYS   7           HB1      LYS   7 -24.398   0.910  -6.385
   49    HG2  LYS   7           HG2      LYS   7 -22.790  -0.970  -5.804
   50    HG3  LYS   7           HG1      LYS   7 -24.144  -2.070  -6.074
   51    HD2  LYS   7           HD2      LYS   7 -23.349  -0.050  -8.140
   52    HD3  LYS   7           HD1      LYS   7 -22.517  -1.601  -8.013
   53    HE2  LYS   7           HE2      LYS   7 -24.884  -2.626  -8.089
   54    HE3  LYS   7           HE1      LYS   7 -25.384  -1.049  -8.707
   55    HZ1  LYS   7           HZ1      LYS   7 -23.222  -2.706  -9.893
   56    HZ2  LYS   7           HZ2      LYS   7 -23.879  -1.274 -10.540
   57    HZ3  LYS   7           HZ3      LYS   7 -24.820  -2.677 -10.456
   58    H    LEU   8           HN       LEU   8 -23.321  -1.474  -3.040
   59    HA   LEU   8           HA       LEU   8 -20.947   0.294  -3.023
   60    HB2  LEU   8           HB2      LEU   8 -21.870  -0.218  -0.744
   61    HB3  LEU   8           HB1      LEU   8 -21.664  -1.907  -1.082
   62    HG   LEU   8           HG       LEU   8 -19.165  -1.334  -1.410
   63   HD11  LEU   8          HD11      LEU   8 -19.326   1.067  -1.379
   64   HD12  LEU   8          HD12      LEU   8 -18.414   0.517   0.024
   65   HD13  LEU   8          HD13      LEU   8 -20.089   1.032   0.211
   66   HD21  LEU   8          HD21      LEU   8 -18.945  -1.370   1.166
   67   HD22  LEU   8          HD22      LEU   8 -19.660  -2.746   0.324
   68   HD23  LEU   8          HD23      LEU   8 -20.695  -1.565   1.121
   69    H    ILE   9           HN       ILE   9 -18.999  -0.511  -3.633
   70    HA   ILE   9           HA       ILE   9 -18.989  -3.252  -4.709
   71    HB   ILE   9           HB       ILE   9 -17.559  -0.809  -5.806
   72   HG12  ILE   9          HG12      ILE   9 -19.580  -2.696  -7.104
   73   HG13  ILE   9          HG11      ILE   9 -19.984  -1.053  -6.476
   74   HG21  ILE   9          HG21      ILE   9 -16.060  -2.696  -5.879
   75   HG22  ILE   9          HG22      ILE   9 -16.645  -2.351  -7.508
   76   HG23  ILE   9          HG23      ILE   9 -17.312  -3.710  -6.601
   77   HD11  ILE   9          HD11      ILE   9 -19.703  -0.975  -8.875
   78   HD12  ILE   9          HD12      ILE   9 -18.122  -1.751  -8.763
   79   HD13  ILE   9          HD13      ILE   9 -18.352  -0.126  -8.118
   80    H    LEU  10           HN       LEU  10 -17.549  -4.559  -3.775
   81    HA   LEU  10           HA       LEU  10 -15.659  -3.333  -1.926
   82    HB2  LEU  10           HB2      LEU  10 -16.351  -6.255  -2.195
   83    HB3  LEU  10           HB1      LEU  10 -15.276  -5.569  -1.009
   84    HG   LEU  10           HG       LEU  10 -17.149  -5.910   0.237
   85   HD11  LEU  10          HD11      LEU  10 -17.824  -3.201  -0.805
   86   HD12  LEU  10          HD12      LEU  10 -16.493  -3.535   0.313
   87   HD13  LEU  10          HD13      LEU  10 -18.157  -3.867   0.795
   88   HD21  LEU  10          HD21      LEU  10 -18.538  -6.663  -1.693
   89   HD22  LEU  10          HD22      LEU  10 -18.955  -4.972  -1.975
   90   HD23  LEU  10          HD23      LEU  10 -19.417  -5.752  -0.467
   91    H    ASN  11           HN       ASN  11 -13.865  -2.758  -2.888
   92    HA   ASN  11           HA       ASN  11 -12.648  -4.569  -4.842
   93    HB2  ASN  11           HB2      ASN  11 -12.079  -1.691  -4.096
   94    HB3  ASN  11           HB1      ASN  11 -10.949  -2.644  -5.029
   95   HD21  ASN  11          HD21      ASN  11 -11.111  -1.369  -6.836
   96   HD22  ASN  11          HD22      ASN  11 -12.532  -1.320  -7.812
   97    H    GLY  12           HN       GLY  12 -12.066  -6.163  -3.394
   98    HA2  GLY  12           HA2      GLY  12  -9.729  -5.451  -1.735
   99    HA3  GLY  12           HA1      GLY  12 -10.979  -6.549  -1.118
  100    H    LYS  13           HN       LYS  13  -8.979  -7.847  -0.895
  101    HA   LYS  13           HA       LYS  13  -8.051  -9.109  -3.322
  102    HB2  LYS  13           HB2      LYS  13  -7.261  -9.596  -0.437
  103    HB3  LYS  13           HB1      LYS  13  -6.546 -10.410  -1.820
  104    HG2  LYS  13           HG2      LYS  13  -5.701  -8.326  -2.676
  105    HG3  LYS  13           HG1      LYS  13  -6.523  -7.427  -1.399
  106    HD2  LYS  13           HD2      LYS  13  -5.146  -8.520   0.287
  107    HD3  LYS  13           HD1      LYS  13  -4.368  -9.491  -0.962
  108    HE2  LYS  13           HE2      LYS  13  -3.000  -7.564  -0.218
  109    HE3  LYS  13           HE1      LYS  13  -3.364  -7.542  -1.941
  110    HZ1  LYS  13           HZ1      LYS  13  -5.132  -6.076  -0.100
  111    HZ2  LYS  13           HZ2      LYS  13  -4.731  -5.754  -1.721
  112    HZ3  LYS  13           HZ3      LYS  13  -3.617  -5.413  -0.495
  113    H    THR  14           HN       THR  14  -9.591 -10.417  -0.292
  114    HA   THR  14           HA       THR  14 -10.409 -12.749  -1.870
  115    HB   THR  14           HB       THR  14 -11.056 -13.616   0.465
  116    HG1  THR  14           HG1      THR  14  -9.935 -12.547   2.171
  117   HG21  THR  14          HG21      THR  14  -8.154 -13.041  -0.154
  118   HG22  THR  14          HG22      THR  14  -9.088 -14.419  -0.735
  119   HG23  THR  14          HG23      THR  14  -8.740 -14.256   0.985
  120    H    LEU  15           HN       LEU  15 -11.585  -9.840  -1.321
  121    HA   LEU  15           HA       LEU  15 -14.352 -10.758  -1.340
  122    HB2  LEU  15           HB2      LEU  15 -13.271  -9.524   0.855
  123    HB3  LEU  15           HB1      LEU  15 -13.917  -8.160  -0.020
  124    HG   LEU  15           HG       LEU  15 -15.566  -8.806   1.540
  125   HD11  LEU  15          HD11      LEU  15 -16.282  -9.931  -1.149
  126   HD12  LEU  15          HD12      LEU  15 -16.477  -8.264  -0.612
  127   HD13  LEU  15          HD13      LEU  15 -17.432  -9.549   0.130
  128   HD21  LEU  15          HD21      LEU  15 -14.616 -11.053   1.988
  129   HD22  LEU  15          HD22      LEU  15 -15.391 -11.637   0.516
  130   HD23  LEU  15          HD23      LEU  15 -16.374 -11.036   1.849
  131    H    LYS  16           HN       LYS  16 -14.623 -10.412  -3.463
  132    HA   LYS  16           HA       LYS  16 -14.508  -7.619  -4.367
  133    HB2  LYS  16           HB2      LYS  16 -13.662 -10.091  -5.902
  134    HB3  LYS  16           HB1      LYS  16 -13.811  -8.488  -6.605
  135    HG2  LYS  16           HG2      LYS  16 -11.924  -7.704  -5.540
  136    HG3  LYS  16           HG1      LYS  16 -12.006  -8.895  -4.238
  137    HD2  LYS  16           HD2      LYS  16 -10.179  -9.187  -5.910
  138    HD3  LYS  16           HD1      LYS  16 -11.205 -10.604  -5.685
  139    HE2  LYS  16           HE2      LYS  16 -10.878 -10.405  -8.020
  140    HE3  LYS  16           HE1      LYS  16 -12.498  -9.782  -7.714
  141    HZ1  LYS  16           HZ1      LYS  16 -10.037  -8.238  -8.263
  142    HZ2  LYS  16           HZ2      LYS  16 -11.449  -7.513  -7.670
  143    HZ3  LYS  16           HZ3      LYS  16 -11.461  -8.284  -9.182
  144    H    GLY  17           HN       GLY  17 -16.551  -7.009  -4.766
  145    HA2  GLY  17           HA2      GLY  17 -18.342  -8.275  -6.435
  146    HA3  GLY  17           HA1      GLY  17 -18.718  -8.860  -4.820
  147    H    GLU  18           HN       GLU  18 -20.810  -7.772  -5.264
  148    HA   GLU  18           HA       GLU  18 -20.706  -4.956  -4.471
  149    HB2  GLU  18           HB2      GLU  18 -22.480  -6.007  -6.689
  150    HB3  GLU  18           HB1      GLU  18 -22.408  -4.351  -6.112
  151    HG2  GLU  18           HG2      GLU  18 -20.275  -4.014  -7.062
  152    HG3  GLU  18           HG1      GLU  18 -20.060  -5.741  -7.368
  153    H    THR  19           HN       THR  19 -22.866  -4.158  -3.790
  154    HA   THR  19           HA       THR  19 -24.982  -6.025  -3.319
  155    HB   THR  19           HB       THR  19 -23.530  -6.656  -1.437
  156    HG1  THR  19           HG1      THR  19 -25.679  -5.158  -0.344
  157   HG21  THR  19          HG21      THR  19 -23.074  -5.043   0.371
  158   HG22  THR  19          HG22      THR  19 -23.846  -3.769  -0.572
  159   HG23  THR  19          HG23      THR  19 -22.349  -4.507  -1.148
  160    H    THR  20           HN       THR  20 -26.910  -4.973  -2.649
  161    HA   THR  20           HA       THR  20 -26.781  -2.030  -2.850
  162    HB   THR  20           HB       THR  20 -29.119  -2.209  -3.804
  163    HG1  THR  20           HG1      THR  20 -28.430  -4.990  -3.872
  164   HG21  THR  20          HG21      THR  20 -26.895  -3.605  -5.314
  165   HG22  THR  20          HG22      THR  20 -27.229  -1.872  -5.311
  166   HG23  THR  20          HG23      THR  20 -28.378  -2.994  -6.046
  167    H    THR  21           HN       THR  21 -28.635  -0.904  -1.778
  168    HA   THR  21           HA       THR  21 -30.097  -2.300   0.267
  169    HB   THR  21           HB       THR  21 -27.821  -1.914   1.343
  170    HG1  THR  21           HG1      THR  21 -29.186  -2.134   2.956
  171   HG21  THR  21          HG21      THR  21 -27.314   0.331   0.456
  172   HG22  THR  21          HG22      THR  21 -27.421   0.408   2.219
  173   HG23  THR  21          HG23      THR  21 -28.764   0.974   1.226
  174    H    GLU  22           HN       GLU  22 -31.696  -0.918   1.269
  175    HA   GLU  22           HA       GLU  22 -32.383   1.338  -0.487
  176    HB2  GLU  22           HB2      GLU  22 -34.124  -0.063   1.563
  177    HB3  GLU  22           HB1      GLU  22 -34.650   1.065   0.332
  178    HG2  GLU  22           HG2      GLU  22 -34.196  -0.535  -1.428
  179    HG3  GLU  22           HG1      GLU  22 -33.476  -1.667  -0.221
  180    H    ALA  23           HN       ALA  23 -31.554   3.213   0.286
  181    HA   ALA  23           HA       ALA  23 -32.083   3.788   3.146
  182    HB1  ALA  23           HB1      ALA  23 -29.971   5.001   3.329
  183    HB2  ALA  23           HB2      ALA  23 -29.574   4.619   1.656
  184    HB3  ALA  23           HB3      ALA  23 -29.662   3.328   2.854
  185    H    VAL  24           HN       VAL  24 -32.575   6.066   3.587
  186    HA   VAL  24           HA       VAL  24 -33.502   7.465   1.237
  187    HB   VAL  24           HB       VAL  24 -35.113   6.961   2.997
  188   HG11  VAL  24          HG11      VAL  24 -34.899   7.958   5.231
  189   HG12  VAL  24          HG12      VAL  24 -33.301   8.569   4.804
  190   HG13  VAL  24          HG13      VAL  24 -33.586   6.830   4.893
  191   HG21  VAL  24          HG21      VAL  24 -35.950   9.196   3.409
  192   HG22  VAL  24          HG22      VAL  24 -35.396   8.989   1.747
  193   HG23  VAL  24          HG23      VAL  24 -34.397   9.853   2.910
  194    H    ASP  25           HN       ASP  25 -30.704   7.396   2.847
  195    HA   ASP  25           HA       ASP  25 -30.135  10.196   2.440
  196    HB2  ASP  25           HB2      ASP  25 -30.879  10.355   4.706
  197    HB3  ASP  25           HB1      ASP  25 -29.959   8.940   5.183
  198    H    ALA  26           HN       ALA  26 -27.848  10.686   2.604
  199    HA   ALA  26           HA       ALA  26 -26.341   8.574   1.348
  200    HB1  ALA  26           HB1      ALA  26 -25.476  11.370   2.085
  201    HB2  ALA  26           HB2      ALA  26 -26.201  10.897   0.546
  202    HB3  ALA  26           HB3      ALA  26 -24.623  10.260   1.015
  203    H    ALA  27           HN       ALA  27 -26.243  10.328   4.427
  204    HA   ALA  27           HA       ALA  27 -23.797   9.102   5.311
  205    HB1  ALA  27           HB1      ALA  27 -24.345  10.075   7.498
  206    HB2  ALA  27           HB2      ALA  27 -25.938  10.528   6.894
  207    HB3  ALA  27           HB3      ALA  27 -24.490  11.266   6.205
  208    H    THR  28           HN       THR  28 -27.232   8.506   5.677
  209    HA   THR  28           HA       THR  28 -27.063   6.364   7.512
  210    HB   THR  28           HB       THR  28 -29.160   6.691   5.347
  211    HG1  THR  28           HG1      THR  28 -28.693   8.518   6.960
  212   HG21  THR  28          HG21      THR  28 -29.245   5.315   8.042
  213   HG22  THR  28          HG22      THR  28 -29.206   4.510   6.475
  214   HG23  THR  28          HG23      THR  28 -30.608   5.481   6.934
  215    H    ALA  29           HN       ALA  29 -26.443   6.557   4.081
  216    HA   ALA  29           HA       ALA  29 -26.683   3.727   3.591
  217    HB1  ALA  29           HB1      ALA  29 -25.767   4.238   1.393
  218    HB2  ALA  29           HB2      ALA  29 -25.372   5.873   1.923
  219    HB3  ALA  29           HB3      ALA  29 -27.057   5.371   1.801
  220    H    GLU  30           HN       GLU  30 -24.151   6.064   4.260
  221    HA   GLU  30           HA       GLU  30 -21.903   4.408   3.916
  222    HB2  GLU  30           HB2      GLU  30 -22.069   6.986   4.351
  223    HB3  GLU  30           HB1      GLU  30 -22.079   6.519   6.044
  224    HG2  GLU  30           HG2      GLU  30 -19.942   5.274   5.612
  225    HG3  GLU  30           HG1      GLU  30 -19.924   6.060   4.031
  226    H    LYS  31           HN       LYS  31 -23.747   5.232   6.839
  227    HA   LYS  31           HA       LYS  31 -22.311   3.720   8.651
  228    HB2  LYS  31           HB2      LYS  31 -25.193   4.563   8.654
  229    HB3  LYS  31           HB1      LYS  31 -24.458   3.710  10.005
  230    HG2  LYS  31           HG2      LYS  31 -23.662   6.398   8.905
  231    HG3  LYS  31           HG1      LYS  31 -24.423   6.061  10.458
  232    HD2  LYS  31           HD2      LYS  31 -21.659   5.198   9.605
  233    HD3  LYS  31           HD1      LYS  31 -22.045   6.478  10.758
  234    HE2  LYS  31           HE2      LYS  31 -23.031   4.853  12.263
  235    HE3  LYS  31           HE1      LYS  31 -22.757   3.564  11.092
  236    HZ1  LYS  31           HZ1      LYS  31 -20.368   3.972  11.303
  237    HZ2  LYS  31           HZ2      LYS  31 -21.058   3.541  12.786
  238    HZ3  LYS  31           HZ3      LYS  31 -20.663   5.162  12.472
  239    H    VAL  32           HN       VAL  32 -25.112   2.659   6.720
  240    HA   VAL  32           HA       VAL  32 -25.320   0.115   7.962
  241    HB   VAL  32           HB       VAL  32 -26.281   0.994   5.231
  242   HG11  VAL  32          HG11      VAL  32 -27.001  -1.442   6.868
  243   HG12  VAL  32          HG12      VAL  32 -26.142  -1.422   5.328
  244   HG13  VAL  32          HG13      VAL  32 -27.834  -0.926   5.399
  245   HG21  VAL  32          HG21      VAL  32 -28.453   1.251   6.327
  246   HG22  VAL  32          HG22      VAL  32 -27.231   2.308   7.038
  247   HG23  VAL  32          HG23      VAL  32 -27.716   0.833   7.874
  248    H    PHE  33           HN       PHE  33 -23.819   1.178   4.919
  249    HA   PHE  33           HA       PHE  33 -22.902  -1.424   4.203
  250    HB2  PHE  33           HB2      PHE  33 -22.424   1.334   3.172
  251    HB3  PHE  33           HB1      PHE  33 -21.323   0.067   2.693
  252    HD1  PHE  33           HD1      PHE  33 -23.470   1.829   1.137
  253    HD2  PHE  33           HD2      PHE  33 -23.311  -2.181   2.539
  254    HE1  PHE  33           HE1      PHE  33 -25.075   1.160  -0.605
  255    HE2  PHE  33           HE2      PHE  33 -24.920  -2.858   0.808
  256    HZ   PHE  33           HZ       PHE  33 -25.724  -1.144  -0.855
  257    H    LYS  34           HN       LYS  34 -21.584   1.001   6.318
  258    HA   LYS  34           HA       LYS  34 -18.887   0.064   6.087
  259    HB2  LYS  34           HB2      LYS  34 -20.295   1.874   8.039
  260    HB3  LYS  34           HB1      LYS  34 -18.611   1.481   8.220
  261    HG2  LYS  34           HG2      LYS  34 -18.330   2.361   5.834
  262    HG3  LYS  34           HG1      LYS  34 -19.944   3.032   6.027
  263    HD2  LYS  34           HD2      LYS  34 -18.342   4.755   6.575
  264    HD3  LYS  34           HD1      LYS  34 -19.165   4.237   8.043
  265    HE2  LYS  34           HE2      LYS  34 -17.292   2.844   8.658
  266    HE3  LYS  34           HE1      LYS  34 -16.466   3.258   7.155
  267    HZ1  LYS  34           HZ1      LYS  34 -16.159   5.451   7.854
  268    HZ2  LYS  34           HZ2      LYS  34 -15.793   4.520   9.225
  269    HZ3  LYS  34           HZ3      LYS  34 -17.286   5.315   9.111
  270    H    GLN  35           HN       GLN  35 -21.585  -0.396   8.297
  271    HA   GLN  35           HA       GLN  35 -20.382  -2.180  10.096
  272    HB2  GLN  35           HB2      GLN  35 -22.839  -0.976   9.823
  273    HB3  GLN  35           HB1      GLN  35 -23.223  -2.608   9.339
  274    HG2  GLN  35           HG2      GLN  35 -22.237  -1.680  12.036
  275    HG3  GLN  35           HG1      GLN  35 -23.777  -2.419  11.626
  276   HE21  GLN  35          HE21      GLN  35 -20.430  -2.977  12.287
  277   HE22  GLN  35          HE22      GLN  35 -20.526  -4.704  12.387
  278    H    TYR  36           HN       TYR  36 -22.063  -2.507   7.056
  279    HA   TYR  36           HA       TYR  36 -22.022  -5.287   6.727
  280    HB2  TYR  36           HB2      TYR  36 -23.360  -4.019   5.221
  281    HB3  TYR  36           HB1      TYR  36 -22.015  -2.974   4.797
  282    HD1  TYR  36           HD1      TYR  36 -20.899  -3.308   2.891
  283    HD2  TYR  36           HD2      TYR  36 -23.032  -6.570   4.536
  284    HE1  TYR  36           HE1      TYR  36 -20.344  -4.623   0.903
  285    HE2  TYR  36           HE2      TYR  36 -22.483  -7.938   2.565
  286    HH   TYR  36           HH       TYR  36 -20.134  -7.027   0.299
  287    H    ALA  37           HN       ALA  37 -19.725  -2.866   5.445
  288    HA   ALA  37           HA       ALA  37 -17.884  -4.691   4.374
  289    HB1  ALA  37           HB1      ALA  37 -17.323  -1.921   5.443
  290    HB2  ALA  37           HB2      ALA  37 -17.920  -2.294   3.825
  291    HB3  ALA  37           HB3      ALA  37 -16.314  -2.832   4.318
  292    H    ASN  38           HN       ASN  38 -18.397  -3.546   7.586
  293    HA   ASN  38           HA       ASN  38 -15.907  -4.307   8.710
  294    HB2  ASN  38           HB2      ASN  38 -17.439  -2.677   9.824
  295    HB3  ASN  38           HB1      ASN  38 -18.627  -3.953  10.057
  296   HD21  ASN  38          HD21      ASN  38 -15.774  -2.451  11.294
  297   HD22  ASN  38          HD22      ASN  38 -15.565  -3.519  12.696
  298    H    ASP  39           HN       ASP  39 -18.790  -6.047   7.902
  299    HA   ASP  39           HA       ASP  39 -18.271  -8.322   9.566
  300    HB2  ASP  39           HB2      ASP  39 -20.542  -7.922   8.909
  301    HB3  ASP  39           HB1      ASP  39 -20.104  -7.883   7.205
  302    H    ASN  40           HN       ASN  40 -17.325  -7.310   6.355
  303    HA   ASN  40           HA       ASN  40 -16.240  -9.981   5.834
  304    HB2  ASN  40           HB2      ASN  40 -15.821  -8.975   3.480
  305    HB3  ASN  40           HB1      ASN  40 -17.458  -9.422   3.932
  306   HD21  ASN  40          HD21      ASN  40 -19.023  -7.901   4.070
  307   HD22  ASN  40          HD22      ASN  40 -18.747  -6.212   3.617
  308    H    GLY  41           HN       GLY  41 -15.314  -7.276   7.280
  309    HA2  GLY  41           HA2      GLY  41 -13.279  -6.505   7.986
  310    HA3  GLY  41           HA1      GLY  41 -12.590  -7.978   7.328
  311    H    VAL  42           HN       VAL  42 -14.305  -5.504   5.463
  312    HA   VAL  42           HA       VAL  42 -11.775  -4.950   4.094
  313    HB   VAL  42           HB       VAL  42 -14.614  -4.711   3.071
  314   HG11  VAL  42          HG11      VAL  42 -13.599  -4.061   0.938
  315   HG12  VAL  42          HG12      VAL  42 -11.999  -4.122   1.676
  316   HG13  VAL  42          HG13      VAL  42 -13.165  -2.917   2.213
  317   HG21  VAL  42          HG21      VAL  42 -12.333  -6.573   2.430
  318   HG22  VAL  42          HG22      VAL  42 -13.798  -6.440   1.455
  319   HG23  VAL  42          HG23      VAL  42 -13.904  -6.991   3.130
  320    H    ASP  43           HN       ASP  43 -10.909  -3.169   4.835
  321    HA   ASP  43           HA       ASP  43 -12.625  -0.800   5.036
  322    HB2  ASP  43           HB2      ASP  43 -11.441  -0.001   7.033
  323    HB3  ASP  43           HB1      ASP  43 -12.046  -1.625   7.360
  324    H    GLY  44           HN       GLY  44 -11.732   1.092   4.202
  325    HA2  GLY  44           HA2      GLY  44  -9.066   1.520   3.512
  326    HA3  GLY  44           HA1      GLY  44  -9.853   0.753   2.136
  327    H    GLU  45           HN       GLU  45  -9.174   2.958   1.255
  328    HA   GLU  45           HA       GLU  45 -10.528   5.312   1.990
  329    HB2  GLU  45           HB2      GLU  45  -8.994   4.392  -0.377
  330    HB3  GLU  45           HB1      GLU  45 -10.110   5.720  -0.648
  331    HG2  GLU  45           HG2      GLU  45  -7.956   6.626  -0.182
  332    HG3  GLU  45           HG1      GLU  45  -9.006   6.964   1.191
  333    H    TRP  46           HN       TRP  46 -12.357   6.299   1.200
  334    HA   TRP  46           HA       TRP  46 -14.269   4.500  -0.146
  335    HB2  TRP  46           HB2      TRP  46 -14.655   6.408   2.142
  336    HB3  TRP  46           HB1      TRP  46 -15.974   6.200   1.008
  337    HD1  TRP  46           HD1      TRP  46 -13.600   3.653   2.731
  338    HE1  TRP  46           HE1      TRP  46 -15.028   1.795   3.783
  339    HE3  TRP  46           HE3      TRP  46 -18.306   5.391   1.535
  340    HZ2  TRP  46           HZ2      TRP  46 -17.742   1.153   4.088
  341    HZ3  TRP  46           HZ3      TRP  46 -20.240   4.077   2.269
  342    HH2  TRP  46           HH2      TRP  46 -19.963   2.003   3.515
  343    H    THR  47           HN       THR  47 -15.434   5.244  -1.824
  344    HA   THR  47           HA       THR  47 -15.203   8.060  -2.621
  345    HB   THR  47           HB       THR  47 -15.136   7.101  -5.050
  346    HG1  THR  47           HG1      THR  47 -13.546   5.068  -4.486
  347   HG21  THR  47          HG21      THR  47 -12.709   7.201  -5.052
  348   HG22  THR  47          HG22      THR  47 -12.677   6.951  -3.308
  349   HG23  THR  47          HG23      THR  47 -13.355   8.437  -3.971
  350    H    TYR  48           HN       TYR  48 -16.935   8.703  -4.155
  351    HA   TYR  48           HA       TYR  48 -19.209   6.895  -4.221
  352    HB2  TYR  48           HB2      TYR  48 -19.696   8.027  -2.218
  353    HB3  TYR  48           HB1      TYR  48 -19.206   9.566  -2.848
  354    HD1  TYR  48           HD1      TYR  48 -21.770   6.900  -3.456
  355    HD2  TYR  48           HD2      TYR  48 -20.868  11.065  -3.493
  356    HE1  TYR  48           HE1      TYR  48 -24.110   7.400  -4.000
  357    HE2  TYR  48           HE2      TYR  48 -23.213  11.570  -4.033
  358    HH   TYR  48           HH       TYR  48 -25.151  10.538  -4.991
  359    H    ASP  49           HN       ASP  49 -20.349   7.010  -6.056
  360    HA   ASP  49           HA       ASP  49 -19.862   9.350  -7.827
  361    HB2  ASP  49           HB2      ASP  49 -19.126   7.213  -8.933
  362    HB3  ASP  49           HB1      ASP  49 -20.720   6.551  -8.714
  363    H    ASP  50           HN       ASP  50 -21.714  10.477  -8.496
  364    HA   ASP  50           HA       ASP  50 -23.997   9.905  -6.743
  365    HB2  ASP  50           HB2      ASP  50 -23.080  12.235  -6.829
  366    HB3  ASP  50           HB1      ASP  50 -23.564  12.319  -8.522
  367    H    ALA  51           HN       ALA  51 -23.141   9.743 -10.095
  368    HA   ALA  51           HA       ALA  51 -25.794   9.768 -11.124
  369    HB1  ALA  51           HB1      ALA  51 -23.343   8.541 -12.385
  370    HB2  ALA  51           HB2      ALA  51 -23.764  10.251 -12.470
  371    HB3  ALA  51           HB3      ALA  51 -24.825   9.049 -13.200
  372    H    THR  52           HN       THR  52 -23.703   7.272  -9.835
  373    HA   THR  52           HA       THR  52 -25.737   5.258 -10.508
  374    HB   THR  52           HB       THR  52 -23.863   3.630  -9.911
  375    HG1  THR  52           HG1      THR  52 -22.239   5.943 -10.324
  376   HG21  THR  52          HG21      THR  52 -22.758   3.944 -12.120
  377   HG22  THR  52          HG22      THR  52 -23.581   5.498 -12.266
  378   HG23  THR  52          HG23      THR  52 -24.519   4.006 -12.211
  379    H    LYS  53           HN       LYS  53 -24.749   7.093  -7.882
  380    HA   LYS  53           HA       LYS  53 -24.973   6.936  -5.591
  381    HB2  LYS  53           HB2      LYS  53 -27.137   5.046  -6.509
  382    HB3  LYS  53           HB1      LYS  53 -26.830   5.335  -4.805
  383    HG2  LYS  53           HG2      LYS  53 -28.609   6.749  -5.427
  384    HG3  LYS  53           HG1      LYS  53 -27.193   7.776  -5.222
  385    HD2  LYS  53           HD2      LYS  53 -26.867   7.731  -7.684
  386    HD3  LYS  53           HD1      LYS  53 -28.371   6.822  -7.836
  387    HE2  LYS  53           HE2      LYS  53 -28.813   9.151  -8.255
  388    HE3  LYS  53           HE1      LYS  53 -29.568   8.683  -6.730
  389    HZ1  LYS  53           HZ1      LYS  53 -27.011  10.165  -7.061
  390    HZ2  LYS  53           HZ2      LYS  53 -27.635   9.647  -5.581
  391    HZ3  LYS  53           HZ3      LYS  53 -28.478  10.800  -6.489
  392    H    THR  54           HN       THR  54 -23.010   5.400  -6.848
  393    HA   THR  54           HA       THR  54 -22.915   2.902  -5.347
  394    HB   THR  54           HB       THR  54 -21.209   3.773  -7.702
  395    HG1  THR  54           HG1      THR  54 -23.683   2.991  -7.694
  396   HG21  THR  54          HG21      THR  54 -20.002   2.188  -6.273
  397   HG22  THR  54          HG22      THR  54 -20.544   1.366  -7.740
  398   HG23  THR  54          HG23      THR  54 -21.410   1.127  -6.223
  399    H    TYR  55           HN       TYR  55 -21.913   3.011  -3.487
  400    HA   TYR  55           HA       TYR  55 -19.625   4.743  -3.029
  401    HB2  TYR  55           HB2      TYR  55 -21.117   2.801  -1.224
  402    HB3  TYR  55           HB1      TYR  55 -19.568   3.502  -0.762
  403    HD1  TYR  55           HD1      TYR  55 -19.373   5.950  -0.356
  404    HD2  TYR  55           HD2      TYR  55 -23.122   4.101  -1.165
  405    HE1  TYR  55           HE1      TYR  55 -20.534   7.932   0.513
  406    HE2  TYR  55           HE2      TYR  55 -24.288   6.083  -0.301
  407    HH   TYR  55           HH       TYR  55 -22.786   9.028   0.224
  408    H    THR  56           HN       THR  56 -17.508   4.033  -2.946
  409    HA   THR  56           HA       THR  56 -17.112   1.154  -3.428
  410    HB   THR  56           HB       THR  56 -15.511   3.389  -4.710
  411    HG1  THR  56           HG1      THR  56 -17.854   2.510  -5.369
  412   HG21  THR  56          HG21      THR  56 -14.169   1.356  -4.303
  413   HG22  THR  56          HG22      THR  56 -14.475   1.587  -6.025
  414   HG23  THR  56          HG23      THR  56 -15.397   0.387  -5.120
  415    H    VAL  57           HN       VAL  57 -15.647   0.158  -2.193
  416    HA   VAL  57           HA       VAL  57 -13.962   1.843  -0.462
  417    HB   VAL  57           HB       VAL  57 -15.625   0.678   0.951
  418   HG11  VAL  57          HG11      VAL  57 -15.444  -1.806   1.250
  419   HG12  VAL  57          HG12      VAL  57 -14.498  -1.851  -0.233
  420   HG13  VAL  57          HG13      VAL  57 -16.172  -1.295  -0.267
  421   HG21  VAL  57          HG21      VAL  57 -12.838  -0.428   1.280
  422   HG22  VAL  57          HG22      VAL  57 -14.072  -0.330   2.537
  423   HG23  VAL  57          HG23      VAL  57 -13.401   1.145   1.840
  424    H    THR  58           HN       THR  58 -11.916   1.720  -0.940
  425    HA   THR  58           HA       THR  58 -10.986  -0.557  -2.556
  426    HB   THR  58           HB       THR  58  -9.553   2.070  -2.193
  427    HG1  THR  58           HG1      THR  58 -11.917   1.704  -3.320
  428   HG21  THR  58          HG21      THR  58  -8.246   0.236  -3.165
  429   HG22  THR  58          HG22      THR  58  -8.566   1.487  -4.367
  430   HG23  THR  58          HG23      THR  58  -9.494  -0.013  -4.386
  431    H    GLU  59           HN       GLU  59  -9.811  -2.034  -1.590
  432    HA   GLU  59           HA       GLU  59  -8.693  -1.584   1.029
  433    HB2  GLU  59           HB2      GLU  59  -9.828  -3.726   0.213
  434    HB3  GLU  59           HB1      GLU  59  -8.375  -4.017  -0.726
  435    HG2  GLU  59           HG2      GLU  59  -8.183  -3.667   2.227
  436    HG3  GLU  59           HG1      GLU  59  -8.714  -5.191   1.548
  437    H    GLY  60           HN       GLY  60  -6.722  -0.475   1.118
  438    HA2  GLY  60           HA2      GLY  60  -4.465  -1.596  -0.297
  439    HA3  GLY  60           HA1      GLY  60  -4.939   0.004  -0.864
  440    H    SER  61           HN       SER  61  -2.555  -1.056   0.625
  441    HA   SER  61           HA       SER  61  -2.626   0.873   2.848
  442    HB2  SER  61           HB2      SER  61  -0.820  -0.699   3.850
  443    HB3  SER  61           HB1      SER  61  -2.498  -1.248   3.907
  444    HG   SER  61           HG       SER  61  -2.088  -2.752   2.429
  445    H    GLY  62           HN       GLY  62  -1.003   2.340   2.939
  446    HA2  GLY  62           HA2      GLY  62   1.045   2.164   0.808
  447    HA3  GLY  62           HA1      GLY  62   0.358   3.671   1.401
  448    H    GLY  63           HN       GLY  63   0.454   3.117   4.169
  449    HA2  GLY  63           HA2      GLY  63   3.329   3.458   4.615
  450    HA3  GLY  63           HA1      GLY  63   2.044   3.850   5.749
  451    H    ALA  64           HN       ALA  64   2.153   0.825   4.064
  452    HA   ALA  64           HA       ALA  64   2.560  -1.326   4.656
  453    HB1  ALA  64           HB1      ALA  64   4.105  -1.876   6.428
  454    HB2  ALA  64           HB2      ALA  64   4.023  -0.231   7.054
  455    HB3  ALA  64           HB3      ALA  64   4.745  -0.537   5.472
  456    H    GLY  65           HN       GLY  65   1.846  -2.992   6.171
  457    HA2  GLY  65           HA2      GLY  65   0.283  -2.228   8.458
  458    HA3  GLY  65           HA1      GLY  65  -0.722  -2.652   7.081
  459    H    GLY  66           HN       GLY  66   1.008  -3.808   9.733
  460    HA2  GLY  66           HA2      GLY  66   0.653  -6.586   8.776
  461    HA3  GLY  66           HA1      GLY  66   2.073  -6.096   9.687
  462    H    GLN  67           HN       GLN  67  -0.124  -4.279  11.070
  463    HA   GLN  67           HA       GLN  67  -1.301  -4.260  12.976
  464    HB2  GLN  67           HB2      GLN  67  -1.958  -7.048  12.014
  465    HB3  GLN  67           HB1      GLN  67  -2.572  -6.435  13.571
  466    HG2  GLN  67           HG2      GLN  67  -4.288  -6.020  12.047
  467    HG3  GLN  67           HG1      GLN  67  -3.482  -4.468  12.235
  468   HE21  GLN  67          HE21      GLN  67  -4.170  -3.661  10.292
  469   HE22  GLN  67          HE22      GLN  67  -3.597  -4.249   8.770
  470    H    GLY  68           HN       GLY  68  -0.025  -7.619  13.115
  471    HA2  GLY  68           HA2      GLY  68   2.091  -7.736  14.527
  472    HA3  GLY  68           HA1      GLY  68   1.144  -6.877  15.731
  473    H    MET  69           HN       MET  69  -1.296  -8.400  15.081
  474    HA   MET  69           HA       MET  69  -0.570 -10.780  16.619
  475    HB2  MET  69           HB2      MET  69  -2.985 -10.897  17.186
  476    HB3  MET  69           HB1      MET  69  -2.220  -9.396  17.692
  477    HG2  MET  69           HG2      MET  69  -3.168  -8.259  15.744
  478    HG3  MET  69           HG1      MET  69  -3.950  -9.763  15.255
  479    HE1  MET  69           HE1      MET  69  -6.291  -8.453  15.152
  480    HE2  MET  69           HE2      MET  69  -5.476  -6.974  15.659
  481    HE3  MET  69           HE3      MET  69  -6.933  -7.511  16.497
  482    H    ILE  70           HN       ILE  70  -0.881 -12.829  15.827
  483    HA   ILE  70           HA       ILE  70  -2.385 -13.122  13.326
  484    HB   ILE  70           HB       ILE  70   0.390 -14.290  13.754
  485   HG12  ILE  70          HG12      ILE  70   0.335 -11.873  13.137
  486   HG13  ILE  70          HG11      ILE  70   1.116 -12.891  11.932
  487   HG21  ILE  70          HG21      ILE  70   0.196 -15.285  11.550
  488   HG22  ILE  70          HG22      ILE  70  -1.394 -14.564  11.314
  489   HG23  ILE  70          HG23      ILE  70  -1.171 -15.826  12.526
  490   HD11  ILE  70          HD11      ILE  70  -0.936 -12.842  10.586
  491   HD12  ILE  70          HD12      ILE  70  -0.275 -11.231  10.861
  492   HD13  ILE  70          HD13      ILE  70  -1.680 -11.776  11.778
  493    H    GLN  71           HN       GLN  71  -0.619 -14.920  15.877
  494    HA   GLN  71           HA       GLN  71  -2.575 -17.096  15.571
  495    HB2  GLN  71           HB2      GLN  71   0.090 -17.022  16.994
  496    HB3  GLN  71           HB1      GLN  71  -0.983 -18.415  16.971
  497    HG2  GLN  71           HG2      GLN  71  -0.779 -18.423  14.481
  498    HG3  GLN  71           HG1      GLN  71   0.441 -17.159  14.639
  499   HE21  GLN  71          HE21      GLN  71  -0.316 -20.506  15.194
  500   HE22  GLN  71          HE22      GLN  71   1.309 -21.034  15.477
  501    H    GLU  72           HN       GLU  72  -2.933 -14.462  17.021
  502    HA   GLU  72           HA       GLU  72  -3.313 -15.428  19.754
  503    HB2  GLU  72           HB2      GLU  72  -3.341 -12.637  18.612
  504    HB3  GLU  72           HB1      GLU  72  -3.725 -13.016  20.287
  505    HG2  GLU  72           HG2      GLU  72  -1.501 -13.916  20.622
  506    HG3  GLU  72           HG1      GLU  72  -1.112 -13.631  18.927
  507    HA   PRO  73           HA       PRO  73  -7.658 -15.770  18.798
  508    HB2  PRO  73           HB2      PRO  73  -8.482 -16.609  21.249
  509    HB3  PRO  73           HB1      PRO  73  -7.639 -17.685  20.077
  510    HG2  PRO  73           HG2      PRO  73  -6.568 -16.310  22.510
  511    HG3  PRO  73           HG1      PRO  73  -6.173 -17.906  21.850
  512    HD2  PRO  73           HD2      PRO  73  -4.630 -15.635  21.542
  513    HD3  PRO  73           HD1      PRO  73  -4.568 -17.068  20.464
  514    H    ALA  74           HN       ALA  74  -9.730 -15.224  20.102
  515    HA   ALA  74           HA       ALA  74  -9.371 -12.748  21.588
  516    HB1  ALA  74           HB1      ALA  74 -11.084 -11.593  20.304
  517    HB2  ALA  74           HB2      ALA  74 -11.270 -13.003  19.264
  518    HB3  ALA  74           HB3      ALA  74  -9.759 -12.096  19.252
  519    H    LEU  75           HN       LEU  75 -10.657 -12.600  23.317
  520    HA   LEU  75           HA       LEU  75 -12.621 -14.708  23.734
  521    HB2  LEU  75           HB2      LEU  75 -11.298 -12.739  25.556
  522    HB3  LEU  75           HB1      LEU  75 -12.753 -13.558  26.061
  523    HG   LEU  75           HG       LEU  75 -10.879 -14.717  26.981
  524   HD11  LEU  75          HD11      LEU  75 -12.738 -16.107  26.219
  525   HD12  LEU  75          HD12      LEU  75 -11.197 -16.955  26.077
  526   HD13  LEU  75          HD13      LEU  75 -11.964 -16.273  24.643
  527   HD21  LEU  75          HD21      LEU  75  -9.119 -15.703  25.604
  528   HD22  LEU  75          HD22      LEU  75  -9.148 -13.947  25.449
  529   HD23  LEU  75          HD23      LEU  75  -9.825 -14.959  24.171
  530    HA   PRO  76           HA       PRO  76 -15.911 -11.937  22.518
  531    HB2  PRO  76           HB2      PRO  76 -17.651 -13.720  24.154
  532    HB3  PRO  76           HB1      PRO  76 -17.798 -13.314  22.442
  533    HG2  PRO  76           HG2      PRO  76 -16.992 -15.742  23.180
  534    HG3  PRO  76           HG1      PRO  76 -16.208 -14.892  21.795
  535    HD2  PRO  76           HD2      PRO  76 -15.203 -15.146  24.657
  536    HD3  PRO  76           HD1      PRO  76 -14.326 -15.378  23.129
  537    HA   PRO  77           HA       PRO  77 -16.335  -9.023  25.803
  538    HB2  PRO  77           HB2      PRO  77 -19.165  -9.014  24.762
  539    HB3  PRO  77           HB1      PRO  77 -18.164  -7.633  25.239
  540    HG2  PRO  77           HG2      PRO  77 -18.371  -8.163  22.691
  541    HG3  PRO  77           HG1      PRO  77 -16.755  -7.877  23.374
  542    HD2  PRO  77           HD2      PRO  77 -18.036 -10.497  22.605
  543    HD3  PRO  77           HD1      PRO  77 -16.335  -9.940  22.395
  544    H    GLY  78           HN       GLY  78 -16.629  -9.350  27.909
  545    HA2  GLY  78           HA2      GLY  78 -17.889  -9.965  29.822
  546    HA3  GLY  78           HA1      GLY  78 -18.911 -10.949  28.790
  547    H    TRP  79           HN       TRP  79 -16.460 -12.231  27.537
  548    HA   TRP  79           HA       TRP  79 -16.161 -14.285  29.617
  549    HB2  TRP  79           HB2      TRP  79 -15.367 -14.227  26.689
  550    HB3  TRP  79           HB1      TRP  79 -14.987 -15.566  27.764
  551    HD1  TRP  79           HD1      TRP  79 -17.995 -13.826  26.095
  552    HE1  TRP  79           HE1      TRP  79 -19.969 -15.469  26.053
  553    HE3  TRP  79           HE3      TRP  79 -15.942 -17.634  28.838
  554    HZ2  TRP  79           HZ2      TRP  79 -20.579 -18.044  27.056
  555    HZ3  TRP  79           HZ3      TRP  79 -17.285 -19.648  29.248
  556    HH2  TRP  79           HH2      TRP  79 -19.554 -19.856  28.379
  557    H    GLU  80           HN       GLU  80 -14.234 -14.812  30.631
  558    HA   GLU  80           HA       GLU  80 -11.816 -13.346  29.818
  559    HB2  GLU  80           HB2      GLU  80 -12.840 -13.947  32.592
  560    HB3  GLU  80           HB1      GLU  80 -11.157 -13.553  32.283
  561    HG2  GLU  80           HG2      GLU  80 -11.914 -11.399  31.287
  562    HG3  GLU  80           HG1      GLU  80 -13.556 -11.805  31.789
  563    H    MET  81           HN       MET  81  -9.846 -14.462  30.065
  564    HA   MET  81           HA       MET  81 -10.100 -17.361  30.523
  565    HB2  MET  81           HB2      MET  81  -9.977 -16.802  28.080
  566    HB3  MET  81           HB1      MET  81  -8.382 -16.066  28.387
  567    HG2  MET  81           HG2      MET  81  -8.960 -18.922  29.086
  568    HG3  MET  81           HG1      MET  81  -8.495 -18.452  27.454
  569    HE1  MET  81           HE1      MET  81  -6.468 -16.066  28.030
  570    HE2  MET  81           HE2      MET  81  -6.145 -17.339  26.854
  571    HE3  MET  81           HE3      MET  81  -4.930 -16.928  28.065
  572    H    LYS  82           HN       LYS  82  -8.456 -18.258  31.763
  573    HA   LYS  82           HA       LYS  82  -6.139 -16.646  32.428
  574    HB2  LYS  82           HB2      LYS  82  -8.089 -17.424  34.622
  575    HB3  LYS  82           HB1      LYS  82  -6.543 -16.645  34.861
  576    HG2  LYS  82           HG2      LYS  82  -7.302 -14.628  33.858
  577    HG3  LYS  82           HG1      LYS  82  -8.811 -15.409  33.301
  578    HD2  LYS  82           HD2      LYS  82  -9.247 -15.850  35.801
  579    HD3  LYS  82           HD1      LYS  82  -7.980 -14.655  36.102
  580    HE2  LYS  82           HE2      LYS  82 -10.436 -14.158  34.417
  581    HE3  LYS  82           HE1      LYS  82 -10.287 -13.718  36.115
  582    HZ1  LYS  82           HZ1      LYS  82  -8.354 -12.749  34.094
  583    HZ2  LYS  82           HZ2      LYS  82  -8.685 -12.115  35.632
  584    HZ3  LYS  82           HZ3      LYS  82  -9.820 -11.938  34.379
  585    H    TYR  83           HN       TYR  83  -4.543 -17.870  33.702
  586    HA   TYR  83           HA       TYR  83  -4.860 -20.786  33.290
  587    HB2  TYR  83           HB2      TYR  83  -2.424 -18.992  33.159
  588    HB3  TYR  83           HB1      TYR  83  -2.261 -20.741  33.461
  589    HD1  TYR  83           HD1      TYR  83  -1.919 -22.105  31.608
  590    HD2  TYR  83           HD2      TYR  83  -3.957 -18.404  31.082
  591    HE1  TYR  83           HE1      TYR  83  -2.038 -22.513  29.185
  592    HE2  TYR  83           HE2      TYR  83  -4.074 -18.801  28.661
  593    HH   TYR  83           HH       TYR  83  -2.979 -20.078  26.944
  594    H    THR  84           HN       THR  84  -4.058 -22.227  34.876
  595    HA   THR  84           HA       THR  84  -4.014 -21.142  37.577
  596    HB   THR  84           HB       THR  84  -4.019 -23.484  38.326
  597    HG1  THR  84           HG1      THR  84  -4.519 -24.736  36.024
  598   HG21  THR  84          HG21      THR  84  -6.176 -22.474  37.893
  599   HG22  THR  84          HG22      THR  84  -6.204 -24.174  37.430
  600   HG23  THR  84          HG23      THR  84  -6.076 -22.927  36.191
  601    H    SER  85           HN       SER  85  -2.367 -22.884  38.907
  602    HA   SER  85           HA       SER  85   0.159 -21.737  38.613
  603    HB2  SER  85           HB2      SER  85  -0.229 -24.346  39.939
  604    HB3  SER  85           HB1      SER  85   0.794 -23.011  40.430
  605    HG   SER  85           HG       SER  85  -1.141 -21.830  40.882
  606    H    GLU  86           HN       GLU  86  -0.957 -24.980  37.729
  607    HA   GLU  86           HA       GLU  86   1.664 -25.688  36.614
  608    HB2  GLU  86           HB2      GLU  86  -0.973 -27.202  36.551
  609    HB3  GLU  86           HB1      GLU  86   0.601 -27.866  36.141
  610    HG2  GLU  86           HG2      GLU  86  -0.346 -26.942  38.842
  611    HG3  GLU  86           HG1      GLU  86  -0.002 -28.593  38.331
  612    H    GLY  87           HN       GLY  87  -0.500 -23.667  35.438
  613    HA2  GLY  87           HA2      GLY  87  -0.593 -22.809  33.284
  614    HA3  GLY  87           HA1      GLY  87   0.265 -24.227  32.712
  615    H    VAL  88           HN       VAL  88  -2.550 -24.781  34.630
  616    HA   VAL  88           HA       VAL  88  -3.894 -25.941  32.348
  617    HB   VAL  88           HB       VAL  88  -4.769 -25.725  35.236
  618   HG11  VAL  88          HG11      VAL  88  -6.508 -27.340  34.668
  619   HG12  VAL  88          HG12      VAL  88  -6.005 -27.294  32.978
  620   HG13  VAL  88          HG13      VAL  88  -6.693 -25.855  33.732
  621   HG21  VAL  88          HG21      VAL  88  -4.199 -28.056  35.419
  622   HG22  VAL  88          HG22      VAL  88  -2.796 -27.181  34.800
  623   HG23  VAL  88          HG23      VAL  88  -3.796 -28.132  33.706
  624    H    ARG  89           HN       ARG  89  -5.306 -24.940  31.120
  625    HA   ARG  89           HA       ARG  89  -6.015 -22.197  31.709
  626    HB2  ARG  89           HB2      ARG  89  -5.243 -22.778  29.472
  627    HB3  ARG  89           HB1      ARG  89  -6.540 -23.950  29.304
  628    HG2  ARG  89           HG2      ARG  89  -8.187 -22.161  29.352
  629    HG3  ARG  89           HG1      ARG  89  -6.900 -20.971  29.576
  630    HD2  ARG  89           HD2      ARG  89  -5.981 -21.457  27.423
  631    HD3  ARG  89           HD1      ARG  89  -7.052 -22.841  27.219
  632    HE   ARG  89           HE       ARG  89  -8.686 -20.649  27.561
  633   HH11  ARG  89          HH11      ARG  89  -6.224 -21.639  25.274
  634   HH12  ARG  89          HH12      ARG  89  -6.966 -20.810  23.928
  635   HH21  ARG  89          HH21      ARG  89  -9.654 -19.560  25.794
  636   HH22  ARG  89          HH22      ARG  89  -8.898 -19.604  24.236
  637    H    TYR  90           HN       TYR  90  -7.924 -21.476  32.382
  638    HA   TYR  90           HA       TYR  90 -10.276 -23.207  32.150
  639    HB2  TYR  90           HB2      TYR  90 -10.943 -22.820  34.449
  640    HB3  TYR  90           HB1      TYR  90  -9.330 -23.505  34.434
  641    HD1  TYR  90           HD1      TYR  90  -7.353 -21.981  34.862
  642    HD2  TYR  90           HD2      TYR  90 -11.386 -20.761  35.489
  643    HE1  TYR  90           HE1      TYR  90  -6.576 -20.169  36.339
  644    HE2  TYR  90           HE2      TYR  90 -10.616 -18.947  36.955
  645    HH   TYR  90           HH       TYR  90  -7.331 -18.027  37.154
  646    H    PHE  91           HN       PHE  91 -12.355 -21.861  32.513
  647    HA   PHE  91           HA       PHE  91 -11.842 -19.205  31.369
  648    HB2  PHE  91           HB2      PHE  91 -14.246 -20.961  30.831
  649    HB3  PHE  91           HB1      PHE  91 -13.893 -19.417  30.071
  650    HD1  PHE  91           HD1      PHE  91 -11.857 -19.223  28.507
  651    HD2  PHE  91           HD2      PHE  91 -13.309 -22.948  30.014
  652    HE1  PHE  91           HE1      PHE  91 -10.648 -20.410  26.739
  653    HE2  PHE  91           HE2      PHE  91 -12.080 -24.132  28.250
  654    HZ   PHE  91           HZ       PHE  91 -10.634 -22.697  26.582
  655    H    VAL  92           HN       VAL  92 -13.301 -17.514  31.874
  656    HA   VAL  92           HA       VAL  92 -14.855 -17.893  34.347
  657    HB   VAL  92           HB       VAL  92 -12.955 -15.586  33.862
  658   HG11  VAL  92          HG11      VAL  92 -14.550 -16.347  36.305
  659   HG12  VAL  92          HG12      VAL  92 -14.835 -14.960  35.253
  660   HG13  VAL  92          HG13      VAL  92 -13.364 -15.047  36.220
  661   HG21  VAL  92          HG21      VAL  92 -11.617 -17.539  34.237
  662   HG22  VAL  92          HG22      VAL  92 -12.604 -18.006  35.619
  663   HG23  VAL  92          HG23      VAL  92 -11.601 -16.557  35.701
  664    H    ASP  93           HN       ASP  93 -16.840 -16.926  34.241
  665    HA   ASP  93           HA       ASP  93 -17.390 -15.096  32.003
  666    HB2  ASP  93           HB2      ASP  93 -19.064 -16.835  33.745
  667    HB3  ASP  93           HB1      ASP  93 -19.737 -15.228  33.475
  668    H    HIS  94           HN       HIS  94 -17.198 -12.881  32.338
  669    HA   HIS  94           HA       HIS  94 -16.602 -11.907  34.975
  670    HB2  HIS  94           HB2      HIS  94 -15.445 -11.084  32.942
  671    HB3  HIS  94           HB1      HIS  94 -16.962 -10.396  32.373
  672    HD1  HIS  94           HD1      HIS  94 -14.015  -9.687  34.372
  673    HD2  HIS  94           HD2      HIS  94 -17.879  -8.184  34.048
  674    HE1  HIS  94           HE1      HIS  94 -13.949  -7.416  35.470
  675    HE2  HIS  94           HE2      HIS  94 -16.333  -6.594  35.405
  676    H    ASN  95           HN       ASN  95 -19.436 -12.226  33.103
  677    HA   ASN  95           HA       ASN  95 -20.852  -9.983  34.228
  678    HB2  ASN  95           HB2      ASN  95 -22.823 -11.023  33.029
  679    HB3  ASN  95           HB1      ASN  95 -21.464 -10.617  31.982
  680   HD21  ASN  95          HD21      ASN  95 -20.229 -12.272  31.094
  681   HD22  ASN  95          HD22      ASN  95 -20.759 -13.927  31.091
  682    H    THR  96           HN       THR  96 -20.998 -13.525  34.585
  683    HA   THR  96           HA       THR  96 -22.779 -13.204  36.857
  684    HB   THR  96           HB       THR  96 -22.679 -15.760  36.889
  685    HG1  THR  96           HG1      THR  96 -21.865 -15.733  34.236
  686   HG21  THR  96          HG21      THR  96 -24.554 -14.519  35.904
  687   HG22  THR  96          HG22      THR  96 -24.203 -15.986  34.992
  688   HG23  THR  96          HG23      THR  96 -23.685 -14.419  34.371
  689    H    ARG  97           HN       ARG  97 -19.476 -13.418  36.206
  690    HA   ARG  97           HA       ARG  97 -17.607 -13.388  37.541
  691    HB2  ARG  97           HB2      ARG  97 -19.370 -13.316  39.975
  692    HB3  ARG  97           HB1      ARG  97 -17.766 -12.628  39.759
  693    HG2  ARG  97           HG2      ARG  97 -18.603 -10.865  38.428
  694    HG3  ARG  97           HG1      ARG  97 -20.179 -11.648  38.283
  695    HD2  ARG  97           HD2      ARG  97 -18.947 -10.462  40.755
  696    HD3  ARG  97           HD1      ARG  97 -20.390  -9.906  39.909
  697    HE   ARG  97           HE       ARG  97 -21.265 -12.252  40.544
  698   HH11  ARG  97          HH11      ARG  97 -19.255 -10.197  42.536
  699   HH12  ARG  97          HH12      ARG  97 -19.720 -10.976  44.022
  700   HH21  ARG  97          HH21      ARG  97 -21.849 -13.295  42.466
  701   HH22  ARG  97          HH22      ARG  97 -21.139 -12.789  43.975
  702    H    THR  98           HN       THR  98 -18.710 -15.737  36.693
  703    HA   THR  98           HA       THR  98 -18.320 -17.587  38.968
  704    HB   THR  98           HB       THR  98 -20.613 -17.686  37.825
  705    HG1  THR  98           HG1      THR  98 -19.245 -20.146  37.489
  706   HG21  THR  98          HG21      THR  98 -18.982 -18.926  35.592
  707   HG22  THR  98          HG22      THR  98 -19.831 -17.382  35.496
  708   HG23  THR  98          HG23      THR  98 -20.741 -18.887  35.683
  709    H    THR  99           HN       THR  99 -17.307 -19.681  38.405
  710    HA   THR  99           HA       THR  99 -15.326 -19.358  36.236
  711    HB   THR  99           HB       THR  99 -14.095 -21.213  37.579
  712    HG1  THR  99           HG1      THR  99 -15.042 -20.535  39.968
  713   HG21  THR  99          HG21      THR  99 -14.458 -18.447  38.812
  714   HG22  THR  99          HG22      THR  99 -13.245 -18.899  37.615
  715   HG23  THR  99          HG23      THR  99 -13.168 -19.565  39.249
  716    H    THR 100           HN       THR 100 -15.127 -21.141  34.756
  717    HA   THR 100           HA       THR 100 -16.900 -23.408  35.207
  718    HB   THR 100           HB       THR 100 -18.264 -21.790  33.913
  719    HG1  THR 100           HG1      THR 100 -18.990 -23.305  32.476
  720   HG21  THR 100          HG21      THR 100 -16.481 -20.658  32.660
  721   HG22  THR 100          HG22      THR 100 -17.720 -21.298  31.574
  722   HG23  THR 100          HG23      THR 100 -16.180 -22.143  31.753
  723    H    PHE 101           HN       PHE 101 -16.089 -25.285  34.492
  724    HA   PHE 101           HA       PHE 101 -13.531 -25.149  33.046
  725    HB2  PHE 101           HB2      PHE 101 -14.207 -26.422  35.475
  726    HB3  PHE 101           HB1      PHE 101 -14.027 -27.737  34.238
  727    HD1  PHE 101           HD1      PHE 101 -11.916 -27.191  32.609
  728    HD2  PHE 101           HD2      PHE 101 -12.307 -25.997  36.676
  729    HE1  PHE 101           HE1      PHE 101  -9.469 -27.058  32.800
  730    HE2  PHE 101           HE2      PHE 101  -9.857 -25.868  36.876
  731    HZ   PHE 101           HZ       PHE 101  -8.436 -26.401  34.936
  732    H    LYS 102           HN       LYS 102 -14.222 -25.257  30.965
  733    HA   LYS 102           HA       LYS 102 -15.484 -27.766  30.147
  734    HB2  LYS 102           HB2      LYS 102 -15.839 -24.986  29.016
  735    HB3  LYS 102           HB1      LYS 102 -16.449 -26.444  28.279
  736    HG2  LYS 102           HG2      LYS 102 -17.818 -26.855  30.305
  737    HG3  LYS 102           HG1      LYS 102 -17.257 -25.306  30.937
  738    HD2  LYS 102           HD2      LYS 102 -19.418 -24.985  29.925
  739    HD3  LYS 102           HD1      LYS 102 -18.195 -24.198  28.926
  740    HE2  LYS 102           HE2      LYS 102 -18.198 -26.080  27.394
  741    HE3  LYS 102           HE1      LYS 102 -19.367 -26.931  28.404
  742    HZ1  LYS 102           HZ1      LYS 102 -20.946 -25.121  27.974
  743    HZ2  LYS 102           HZ2      LYS 102 -20.461 -25.900  26.547
  744    HZ3  LYS 102           HZ3      LYS 102 -19.817 -24.382  26.946
  745    H    ASP 103           HN       ASP 103 -14.477 -28.823  28.449
  746    HA   ASP 103           HA       ASP 103 -11.927 -27.715  27.638
  747    HB2  ASP 103           HB2      ASP 103 -11.492 -29.965  26.747
  748    HB3  ASP 103           HB1      ASP 103 -11.882 -29.984  28.451
  749    HA   PRO 104           HA       PRO 104 -13.859 -26.570  23.760
  750    HB2  PRO 104           HB2      PRO 104 -11.823 -24.971  22.930
  751    HB3  PRO 104           HB1      PRO 104 -13.002 -24.426  24.131
  752    HG2  PRO 104           HG2      PRO 104 -10.230 -25.460  24.518
  753    HG3  PRO 104           HG1      PRO 104 -11.055 -24.132  25.347
  754    HD2  PRO 104           HD2      PRO 104 -10.745 -26.624  26.417
  755    HD3  PRO 104           HD1      PRO 104 -12.088 -25.540  26.834
  756    H    ARG 105           HN       ARG 105 -11.099 -28.394  24.460
  757    HA   ARG 105           HA       ARG 105 -10.702 -29.052  21.616
  758    HB2  ARG 105           HB2      ARG 105  -8.766 -29.582  23.875
  759    HB3  ARG 105           HB1      ARG 105  -8.485 -29.853  22.163
  760    HG2  ARG 105           HG2      ARG 105  -7.414 -27.894  22.290
  761    HG3  ARG 105           HG1      ARG 105  -9.042 -27.212  22.152
  762    HD2  ARG 105           HD2      ARG 105  -7.868 -26.150  24.019
  763    HD3  ARG 105           HD1      ARG 105  -9.200 -27.142  24.617
  764    HE   ARG 105           HE       ARG 105  -6.488 -28.270  24.569
  765   HH11  ARG 105          HH11      ARG 105  -9.223 -27.102  26.420
  766   HH12  ARG 105          HH12      ARG 105  -8.659 -27.769  27.915
  767   HH21  ARG 105          HH21      ARG 105  -5.732 -29.148  26.527
  768   HH22  ARG 105          HH22      ARG 105  -6.684 -28.959  27.971
  769    HA   PRO 106           HA       PRO 106 -12.940 -32.778  23.025
  770    HB2  PRO 106           HB2      PRO 106 -12.010 -33.554  20.282
  771    HB3  PRO 106           HB1      PRO 106 -13.621 -33.786  21.058
  772    HG2  PRO 106           HG2      PRO 106 -13.249 -31.866  19.256
  773    HG3  PRO 106           HG1      PRO 106 -14.236 -31.574  20.699
  774    HD2  PRO 106           HD2      PRO 106 -11.479 -30.644  20.052
  775    HD3  PRO 106           HD1      PRO 106 -12.784 -29.832  20.988
  776    H    GLY 107           HN       GLY 107 -11.898 -34.149  24.346
  777    HA2  GLY 107           HA2      GLY 107 -10.474 -35.931  24.845
  778    HA3  GLY 107           HA1      GLY 107  -9.560 -35.605  23.355
  779    H    PHE 108           HN       PHE 108  -9.335 -32.701  24.082
  780    HA   PHE 108           HA       PHE 108  -7.533 -31.436  24.815
  781    HB2  PHE 108           HB2      PHE 108  -7.605 -31.090  27.301
  782    HB3  PHE 108           HB1      PHE 108  -9.203 -30.953  26.499
  783    HD1  PHE 108           HD1      PHE 108 -10.909 -32.632  26.904
  784    HD2  PHE 108           HD2      PHE 108  -7.135 -32.875  28.864
  785    HE1  PHE 108           HE1      PHE 108 -11.845 -34.239  28.507
  786    HE2  PHE 108           HE2      PHE 108  -8.070 -34.489  30.469
  787    HZ   PHE 108           HZ       PHE 108 -10.397 -35.167  30.305
  788    H    GLU 109           HN       GLU 109  -6.487 -33.775  23.939
  789    HA   GLU 109           HA       GLU 109  -4.573 -34.985  23.930
  790    HB2  GLU 109           HB2      GLU 109  -3.740 -32.896  25.940
  791    HB3  GLU 109           HB1      GLU 109  -2.656 -34.100  25.265
  792    HG2  GLU 109           HG2      GLU 109  -4.105 -31.951  23.724
  793    HG3  GLU 109           HG1      GLU 109  -2.393 -31.982  24.134
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 -42.954   5.607   2.776
    2    H2   GLY   1           HT2      GLY   1 -42.361   7.179   2.585
    3    H3   GLY   1           HT3      GLY   1 -41.491   6.052   3.503
    4    HA2  GLY   1           HA1      GLY   1 -41.123   4.695   1.527
    5    HA3  GLY   1           HA2      GLY   1 -41.989   5.898   0.582
    6    H    SER   2           HN       SER   2 -40.548   6.844  -0.668
    7    HA   SER   2           HA       SER   2 -38.792   8.093  -1.375
    8    HB2  SER   2           HB2      SER   2 -38.511   8.729   1.570
    9    HB3  SER   2           HB1      SER   2 -37.701   9.591   0.261
   10    HG   SER   2           HG       SER   2 -39.919   9.934  -0.574
   11    H    HIS   3           HN       HIS   3 -38.381   5.282  -0.736
   12    HA   HIS   3           HA       HIS   3 -35.704   5.038   0.312
   13    HB2  HIS   3           HB2      HIS   3 -37.676   3.137  -0.922
   14    HB3  HIS   3           HB1      HIS   3 -35.976   2.693  -0.905
   15    HD1  HIS   3           HD1      HIS   3 -36.625   0.694   0.641
   16    HD2  HIS   3           HD2      HIS   3 -37.240   4.474   2.300
   17    HE1  HIS   3           HE1      HIS   3 -36.913   0.321   3.112
   18    HE2  HIS   3           HE2      HIS   3 -37.282   2.606   4.103
   19    H    MET   4           HN       MET   4 -33.787   4.732  -0.958
   20    HA   MET   4           HA       MET   4 -34.167   4.838  -3.867
   21    HB2  MET   4           HB2      MET   4 -33.301   7.064  -2.671
   22    HB3  MET   4           HB1      MET   4 -31.782   6.179  -2.673
   23    HG2  MET   4           HG2      MET   4 -31.820   5.981  -5.064
   24    HG3  MET   4           HG1      MET   4 -33.412   6.736  -5.134
   25    HE1  MET   4           HE1      MET   4 -33.179   9.035  -2.996
   26    HE2  MET   4           HE2      MET   4 -33.867   9.294  -4.598
   27    HE3  MET   4           HE3      MET   4 -32.635  10.396  -3.981
   28    H    GLN   5           HN       GLN   5 -32.146   4.039  -4.973
   29    HA   GLN   5           HA       GLN   5 -31.271   1.666  -3.517
   30    HB2  GLN   5           HB2      GLN   5 -32.327   1.399  -5.757
   31    HB3  GLN   5           HB1      GLN   5 -30.984   2.289  -6.458
   32    HG2  GLN   5           HG2      GLN   5 -29.479   0.525  -5.443
   33    HG3  GLN   5           HG1      GLN   5 -30.946  -0.406  -5.149
   34   HE21  GLN   5          HE21      GLN   5 -32.144  -1.186  -6.927
   35   HE22  GLN   5          HE22      GLN   5 -31.421  -1.316  -8.519
   36    H    TYR   6           HN       TYR   6 -29.438   1.981  -2.412
   37    HA   TYR   6           HA       TYR   6 -27.297   3.479  -3.756
   38    HB2  TYR   6           HB2      TYR   6 -27.681   2.780  -0.817
   39    HB3  TYR   6           HB1      TYR   6 -26.131   3.339  -1.424
   40    HD1  TYR   6           HD1      TYR   6 -25.953   5.663  -2.371
   41    HD2  TYR   6           HD2      TYR   6 -29.471   4.265  -0.415
   42    HE1  TYR   6           HE1      TYR   6 -26.712   7.979  -2.087
   43    HE2  TYR   6           HE2      TYR   6 -30.231   6.589  -0.119
   44    HH   TYR   6           HH       TYR   6 -29.290   8.861  -0.054
   45    H    LYS   7           HN       LYS   7 -25.438   2.446  -4.379
   46    HA   LYS   7           HA       LYS   7 -25.491  -0.464  -4.001
   47    HB2  LYS   7           HB2      LYS   7 -24.055  -0.437  -6.158
   48    HB3  LYS   7           HB1      LYS   7 -25.801  -0.137  -6.315
   49    HG2  LYS   7           HG2      LYS   7 -25.379   2.254  -6.416
   50    HG3  LYS   7           HG1      LYS   7 -23.649   1.968  -6.256
   51    HD2  LYS   7           HD2      LYS   7 -24.037   2.272  -8.563
   52    HD3  LYS   7           HD1      LYS   7 -23.833   0.536  -8.340
   53    HE2  LYS   7           HE2      LYS   7 -25.678   0.824  -9.807
   54    HE3  LYS   7           HE1      LYS   7 -26.339   0.357  -8.240
   55    HZ1  LYS   7           HZ1      LYS   7 -27.581   2.173  -9.290
   56    HZ2  LYS   7           HZ2      LYS   7 -26.191   3.146  -9.258
   57    HZ3  LYS   7           HZ3      LYS   7 -26.903   2.652  -7.811
   58    H    LEU   8           HN       LEU   8 -23.558  -1.562  -3.743
   59    HA   LEU   8           HA       LEU   8 -21.305   0.124  -2.859
   60    HB2  LEU   8           HB2      LEU   8 -22.513  -0.764  -0.868
   61    HB3  LEU   8           HB1      LEU   8 -22.251  -2.387  -1.464
   62    HG   LEU   8           HG       LEU   8 -19.790  -2.002  -1.260
   63   HD11  LEU   8          HD11      LEU   8 -20.714   0.564   0.031
   64   HD12  LEU   8          HD12      LEU   8 -19.541   0.351  -1.274
   65   HD13  LEU   8          HD13      LEU   8 -19.145  -0.172   0.357
   66   HD21  LEU   8          HD21      LEU   8 -19.844  -2.173   1.233
   67   HD22  LEU   8          HD22      LEU   8 -20.922  -3.277   0.374
   68   HD23  LEU   8          HD23      LEU   8 -21.576  -1.830   1.141
   69    H    ILE   9           HN       ILE   9 -19.328  -0.510  -3.507
   70    HA   ILE   9           HA       ILE   9 -19.124  -3.107  -4.882
   71    HB   ILE   9           HB       ILE   9 -17.793  -0.490  -5.651
   72   HG12  ILE   9          HG12      ILE   9 -19.666  -2.303  -7.235
   73   HG13  ILE   9          HG11      ILE   9 -20.182  -0.776  -6.428
   74   HG21  ILE   9          HG21      ILE   9 -16.217  -2.332  -5.875
   75   HG22  ILE   9          HG22      ILE   9 -16.716  -1.741  -7.460
   76   HG23  ILE   9          HG23      ILE   9 -17.391  -3.241  -6.824
   77   HD11  ILE   9          HD11      ILE   9 -18.115  -1.003  -8.640
   78   HD12  ILE   9          HD12      ILE   9 -18.702   0.485  -7.896
   79   HD13  ILE   9          HD13      ILE   9 -19.799  -0.514  -8.852
   80    H    LEU  10           HN       LEU  10 -17.798  -4.429  -3.811
   81    HA   LEU  10           HA       LEU  10 -15.890  -3.255  -1.929
   82    HB2  LEU  10           HB2      LEU  10 -16.539  -6.180  -2.299
   83    HB3  LEU  10           HB1      LEU  10 -15.522  -5.497  -1.062
   84    HG   LEU  10           HG       LEU  10 -17.452  -6.033   0.072
   85   HD11  LEU  10          HD11      LEU  10 -17.942  -3.183  -0.671
   86   HD12  LEU  10          HD12      LEU  10 -16.782  -3.748   0.543
   87   HD13  LEU  10          HD13      LEU  10 -18.510  -4.021   0.777
   88   HD21  LEU  10          HD21      LEU  10 -18.795  -6.522  -1.974
   89   HD22  LEU  10          HD22      LEU  10 -19.204  -4.807  -2.034
   90   HD23  LEU  10          HD23      LEU  10 -19.693  -5.778  -0.651
   91    H    ASN  11           HN       ASN  11 -13.894  -2.890  -2.662
   92    HA   ASN  11           HA       ASN  11 -12.881  -4.813  -4.637
   93    HB2  ASN  11           HB2      ASN  11 -13.233  -2.271  -5.272
   94    HB3  ASN  11           HB1      ASN  11 -11.711  -2.066  -4.412
   95   HD21  ASN  11          HD21      ASN  11 -12.302  -1.674  -7.212
   96   HD22  ASN  11          HD22      ASN  11 -11.248  -2.718  -8.089
   97    H    GLY  12           HN       GLY  12 -12.274  -6.080  -2.854
   98    HA2  GLY  12           HA2      GLY  12  -9.587  -5.299  -1.916
   99    HA3  GLY  12           HA1      GLY  12 -10.755  -5.993  -0.775
  100    H    LYS  13           HN       LYS  13  -8.255  -7.038  -1.454
  101    HA   LYS  13           HA       LYS  13  -8.021  -8.966  -3.382
  102    HB2  LYS  13           HB2      LYS  13  -6.966  -9.498  -0.619
  103    HB3  LYS  13           HB1      LYS  13  -6.176  -9.765  -2.169
  104    HG2  LYS  13           HG2      LYS  13  -5.787  -7.420  -2.439
  105    HG3  LYS  13           HG1      LYS  13  -6.753  -7.049  -1.006
  106    HD2  LYS  13           HD2      LYS  13  -5.003  -8.695   0.119
  107    HD3  LYS  13           HD1      LYS  13  -4.004  -8.144  -1.229
  108    HE2  LYS  13           HE2      LYS  13  -3.600  -6.720   0.658
  109    HE3  LYS  13           HE1      LYS  13  -4.490  -5.801  -0.558
  110    HZ1  LYS  13           HZ1      LYS  13  -5.634  -7.051   1.889
  111    HZ2  LYS  13           HZ2      LYS  13  -6.540  -6.244   0.703
  112    HZ3  LYS  13           HZ3      LYS  13  -5.397  -5.394   1.625
  113    H    THR  14           HN       THR  14  -9.559  -9.237  -0.215
  114    HA   THR  14           HA       THR  14 -10.149 -12.078  -0.694
  115    HB   THR  14           HB       THR  14 -10.723 -10.573   1.853
  116    HG1  THR  14           HG1      THR  14  -8.294 -11.960   1.489
  117   HG21  THR  14          HG21      THR  14  -9.978 -13.446   1.296
  118   HG22  THR  14          HG22      THR  14 -11.606 -12.857   1.636
  119   HG23  THR  14          HG23      THR  14 -10.355 -12.763   2.877
  120    H    LEU  15           HN       LEU  15 -11.599  -9.300  -1.522
  121    HA   LEU  15           HA       LEU  15 -14.232 -10.398  -1.520
  122    HB2  LEU  15           HB2      LEU  15 -13.568  -9.005   0.772
  123    HB3  LEU  15           HB1      LEU  15 -14.380  -7.800  -0.195
  124    HG   LEU  15           HG       LEU  15 -16.040  -8.719   1.172
  125   HD11  LEU  15          HD11      LEU  15 -16.779  -8.511  -1.107
  126   HD12  LEU  15          HD12      LEU  15 -17.529  -9.924  -0.364
  127   HD13  LEU  15          HD13      LEU  15 -16.177 -10.124  -1.478
  128   HD21  LEU  15          HD21      LEU  15 -16.420 -11.150   1.375
  129   HD22  LEU  15          HD22      LEU  15 -14.860 -10.631   2.011
  130   HD23  LEU  15          HD23      LEU  15 -14.949 -11.431   0.444
  131    H    LYS  16           HN       LYS  16 -14.288 -10.031  -3.671
  132    HA   LYS  16           HA       LYS  16 -14.438  -7.215  -4.482
  133    HB2  LYS  16           HB2      LYS  16 -13.132  -9.540  -5.919
  134    HB3  LYS  16           HB1      LYS  16 -13.598  -8.067  -6.758
  135    HG2  LYS  16           HG2      LYS  16 -12.039  -6.770  -5.545
  136    HG3  LYS  16           HG1      LYS  16 -11.744  -8.049  -4.367
  137    HD2  LYS  16           HD2      LYS  16  -9.969  -7.679  -6.039
  138    HD3  LYS  16           HD1      LYS  16 -10.581  -9.332  -5.964
  139    HE2  LYS  16           HE2      LYS  16 -10.249  -8.645  -8.275
  140    HE3  LYS  16           HE1      LYS  16 -11.966  -8.860  -7.949
  141    HZ1  LYS  16           HZ1      LYS  16 -10.723  -6.192  -7.737
  142    HZ2  LYS  16           HZ2      LYS  16 -12.348  -6.590  -8.009
  143    HZ3  LYS  16           HZ3      LYS  16 -11.204  -6.803  -9.238
  144    H    GLY  17           HN       GLY  17 -16.468  -6.789  -4.940
  145    HA2  GLY  17           HA2      GLY  17 -18.086  -8.061  -6.775
  146    HA3  GLY  17           HA1      GLY  17 -18.487  -8.768  -5.211
  147    H    GLU  18           HN       GLU  18 -20.643  -7.695  -5.808
  148    HA   GLU  18           HA       GLU  18 -20.606  -5.018  -4.615
  149    HB2  GLU  18           HB2      GLU  18 -22.351  -5.612  -6.999
  150    HB3  GLU  18           HB1      GLU  18 -22.061  -4.062  -6.237
  151    HG2  GLU  18           HG2      GLU  18 -20.768  -3.810  -8.071
  152    HG3  GLU  18           HG1      GLU  18 -19.582  -4.561  -7.001
  153    H    THR  19           HN       THR  19 -22.763  -4.257  -4.020
  154    HA   THR  19           HA       THR  19 -24.886  -6.173  -3.708
  155    HB   THR  19           HB       THR  19 -23.436  -6.733  -1.768
  156    HG1  THR  19           HG1      THR  19 -25.361  -7.164  -1.008
  157   HG21  THR  19          HG21      THR  19 -23.986  -3.856  -0.977
  158   HG22  THR  19          HG22      THR  19 -22.408  -4.560  -1.338
  159   HG23  THR  19          HG23      THR  19 -23.294  -5.072   0.100
  160    H    THR  20           HN       THR  20 -26.655  -4.966  -2.205
  161    HA   THR  20           HA       THR  20 -26.658  -2.122  -2.877
  162    HB   THR  20           HB       THR  20 -29.022  -2.338  -3.726
  163    HG1  THR  20           HG1      THR  20 -28.896  -4.728  -2.892
  164   HG21  THR  20          HG21      THR  20 -26.791  -3.631  -5.306
  165   HG22  THR  20          HG22      THR  20 -27.282  -1.938  -5.347
  166   HG23  THR  20          HG23      THR  20 -28.351  -3.177  -6.001
  167    H    THR  21           HN       THR  21 -28.345  -0.896  -1.787
  168    HA   THR  21           HA       THR  21 -29.884  -2.262   0.268
  169    HB   THR  21           HB       THR  21 -27.601  -1.717   1.323
  170    HG1  THR  21           HG1      THR  21 -29.773  -1.993   2.381
  171   HG21  THR  21          HG21      THR  21 -27.423   0.657   2.174
  172   HG22  THR  21          HG22      THR  21 -28.759   1.096   1.110
  173   HG23  THR  21          HG23      THR  21 -27.233   0.541   0.421
  174    H    GLU  22           HN       GLU  22 -31.502  -0.860   1.246
  175    HA   GLU  22           HA       GLU  22 -32.163   1.423  -0.503
  176    HB2  GLU  22           HB2      GLU  22 -33.973  -0.174   1.332
  177    HB3  GLU  22           HB1      GLU  22 -34.477   1.094   0.238
  178    HG2  GLU  22           HG2      GLU  22 -34.037  -0.268  -1.691
  179    HG3  GLU  22           HG1      GLU  22 -33.244  -1.517  -0.657
  180    H    ALA  23           HN       ALA  23 -31.846   3.390   0.375
  181    HA   ALA  23           HA       ALA  23 -32.372   3.730   3.256
  182    HB1  ALA  23           HB1      ALA  23 -29.830   4.729   1.937
  183    HB2  ALA  23           HB2      ALA  23 -29.934   3.358   3.042
  184    HB3  ALA  23           HB3      ALA  23 -30.311   4.984   3.616
  185    H    VAL  24           HN       VAL  24 -32.744   6.041   3.814
  186    HA   VAL  24           HA       VAL  24 -33.822   7.464   1.487
  187    HB   VAL  24           HB       VAL  24 -35.064   8.843   3.109
  188   HG11  VAL  24          HG11      VAL  24 -36.088   6.839   2.188
  189   HG12  VAL  24          HG12      VAL  24 -36.611   7.091   3.853
  190   HG13  VAL  24          HG13      VAL  24 -35.393   5.868   3.487
  191   HG21  VAL  24          HG21      VAL  24 -33.891   6.995   5.186
  192   HG22  VAL  24          HG22      VAL  24 -35.129   8.221   5.466
  193   HG23  VAL  24          HG23      VAL  24 -33.500   8.703   4.991
  194    H    ASP  25           HN       ASP  25 -30.961   7.393   2.842
  195    HA   ASP  25           HA       ASP  25 -30.349  10.118   2.124
  196    HB2  ASP  25           HB2      ASP  25 -30.985  10.133   4.618
  197    HB3  ASP  25           HB1      ASP  25 -29.509   9.210   4.880
  198    H    ALA  26           HN       ALA  26 -28.014  10.426   1.962
  199    HA   ALA  26           HA       ALA  26 -26.759   8.028   0.969
  200    HB1  ALA  26           HB1      ALA  26 -24.953   9.535   0.259
  201    HB2  ALA  26           HB2      ALA  26 -25.722  10.859   1.138
  202    HB3  ALA  26           HB3      ALA  26 -26.533  10.133  -0.248
  203    H    ALA  27           HN       ALA  27 -26.359  10.250   3.675
  204    HA   ALA  27           HA       ALA  27 -23.875   9.220   4.577
  205    HB1  ALA  27           HB1      ALA  27 -25.989  10.666   6.171
  206    HB2  ALA  27           HB2      ALA  27 -24.748  11.449   5.193
  207    HB3  ALA  27           HB3      ALA  27 -24.284  10.484   6.594
  208    H    THR  28           HN       THR  28 -27.216   8.408   5.194
  209    HA   THR  28           HA       THR  28 -26.762   6.705   7.422
  210    HB   THR  28           HB       THR  28 -29.077   6.472   5.498
  211    HG1  THR  28           HG1      THR  28 -28.856   8.263   7.722
  212   HG21  THR  28          HG21      THR  28 -28.835   6.018   8.486
  213   HG22  THR  28          HG22      THR  28 -28.926   4.754   7.260
  214   HG23  THR  28          HG23      THR  28 -30.306   5.820   7.528
  215    H    ALA  29           HN       ALA  29 -26.511   6.286   3.991
  216    HA   ALA  29           HA       ALA  29 -26.748   3.416   3.991
  217    HB1  ALA  29           HB1      ALA  29 -26.025   3.578   1.655
  218    HB2  ALA  29           HB2      ALA  29 -25.664   5.289   1.885
  219    HB3  ALA  29           HB3      ALA  29 -27.328   4.717   1.999
  220    H    GLU  30           HN       GLU  30 -24.234   5.837   4.070
  221    HA   GLU  30           HA       GLU  30 -21.981   4.218   3.757
  222    HB2  GLU  30           HB2      GLU  30 -22.171   6.812   3.840
  223    HB3  GLU  30           HB1      GLU  30 -22.099   6.611   5.581
  224    HG2  GLU  30           HG2      GLU  30 -19.967   5.188   5.019
  225    HG3  GLU  30           HG1      GLU  30 -19.988   6.187   3.566
  226    H    LYS  31           HN       LYS  31 -23.666   5.288   6.696
  227    HA   LYS  31           HA       LYS  31 -21.903   4.132   8.546
  228    HB2  LYS  31           HB2      LYS  31 -24.839   4.595   9.026
  229    HB3  LYS  31           HB1      LYS  31 -23.542   4.592  10.214
  230    HG2  LYS  31           HG2      LYS  31 -24.115   6.653   8.101
  231    HG3  LYS  31           HG1      LYS  31 -24.144   6.851   9.855
  232    HD2  LYS  31           HD2      LYS  31 -21.754   6.609   9.978
  233    HD3  LYS  31           HD1      LYS  31 -21.663   6.189   8.266
  234    HE2  LYS  31           HE2      LYS  31 -22.632   8.455   7.768
  235    HE3  LYS  31           HE1      LYS  31 -22.425   8.845   9.471
  236    HZ1  LYS  31           HZ1      LYS  31 -20.068   8.560   9.261
  237    HZ2  LYS  31           HZ2      LYS  31 -20.592   9.630   8.054
  238    HZ3  LYS  31           HZ3      LYS  31 -20.216   8.026   7.657
  239    H    VAL  32           HN       VAL  32 -24.801   2.834   6.989
  240    HA   VAL  32           HA       VAL  32 -24.857   0.447   8.565
  241    HB   VAL  32           HB       VAL  32 -26.179   1.037   5.908
  242   HG11  VAL  32          HG11      VAL  32 -27.650  -0.846   6.409
  243   HG12  VAL  32          HG12      VAL  32 -26.733  -1.185   7.876
  244   HG13  VAL  32          HG13      VAL  32 -25.969  -1.373   6.298
  245   HG21  VAL  32          HG21      VAL  32 -26.890   2.539   7.693
  246   HG22  VAL  32          HG22      VAL  32 -27.259   1.153   8.721
  247   HG23  VAL  32          HG23      VAL  32 -28.184   1.429   7.244
  248    H    PHE  33           HN       PHE  33 -23.762   1.188   5.271
  249    HA   PHE  33           HA       PHE  33 -22.965  -1.498   4.729
  250    HB2  PHE  33           HB2      PHE  33 -22.779   1.088   3.299
  251    HB3  PHE  33           HB1      PHE  33 -21.537  -0.089   2.910
  252    HD1  PHE  33           HD1      PHE  33 -23.534  -2.487   3.440
  253    HD2  PHE  33           HD2      PHE  33 -23.662   1.044   1.063
  254    HE1  PHE  33           HE1      PHE  33 -25.056  -3.608   1.860
  255    HE2  PHE  33           HE2      PHE  33 -25.198  -0.067  -0.513
  256    HZ   PHE  33           HZ       PHE  33 -25.891  -2.395  -0.130
  257    H    LYS  34           HN       LYS  34 -21.330   1.192   6.276
  258    HA   LYS  34           HA       LYS  34 -18.727   0.116   5.925
  259    HB2  LYS  34           HB2      LYS  34 -19.933   2.297   7.524
  260    HB3  LYS  34           HB1      LYS  34 -18.389   1.691   8.071
  261    HG2  LYS  34           HG2      LYS  34 -17.341   2.248   5.994
  262    HG3  LYS  34           HG1      LYS  34 -18.912   2.585   5.254
  263    HD2  LYS  34           HD2      LYS  34 -17.711   4.676   5.820
  264    HD3  LYS  34           HD1      LYS  34 -19.215   4.499   6.719
  265    HE2  LYS  34           HE2      LYS  34 -17.973   3.785   8.688
  266    HE3  LYS  34           HE1      LYS  34 -16.455   3.910   7.789
  267    HZ1  LYS  34           HZ1      LYS  34 -16.785   6.257   7.538
  268    HZ2  LYS  34           HZ2      LYS  34 -16.918   5.868   9.184
  269    HZ3  LYS  34           HZ3      LYS  34 -18.311   6.182   8.268
  270    H    GLN  35           HN       GLN  35 -21.245  -0.343   8.292
  271    HA   GLN  35           HA       GLN  35 -19.623  -1.921  10.037
  272    HB2  GLN  35           HB2      GLN  35 -21.633  -0.715  10.851
  273    HB3  GLN  35           HB1      GLN  35 -22.653  -1.657   9.792
  274    HG2  GLN  35           HG2      GLN  35 -21.102  -2.834  12.113
  275    HG3  GLN  35           HG1      GLN  35 -22.761  -2.270  12.195
  276   HE21  GLN  35          HE21      GLN  35 -21.543  -4.935  12.563
  277   HE22  GLN  35          HE22      GLN  35 -22.387  -5.983  11.478
  278    H    TYR  36           HN       TYR  36 -21.668  -2.391   7.277
  279    HA   TYR  36           HA       TYR  36 -21.823  -5.202   7.276
  280    HB2  TYR  36           HB2      TYR  36 -23.349  -4.031   5.886
  281    HB3  TYR  36           HB1      TYR  36 -22.072  -3.093   5.134
  282    HD1  TYR  36           HD1      TYR  36 -23.588  -6.481   5.283
  283    HD2  TYR  36           HD2      TYR  36 -20.970  -3.844   3.219
  284    HE1  TYR  36           HE1      TYR  36 -23.475  -8.071   3.408
  285    HE2  TYR  36           HE2      TYR  36 -20.842  -5.404   1.342
  286    HH   TYR  36           HH       TYR  36 -22.961  -8.075   1.029
  287    H    ALA  37           HN       ALA  37 -19.647  -2.964   5.575
  288    HA   ALA  37           HA       ALA  37 -18.015  -4.951   4.399
  289    HB1  ALA  37           HB1      ALA  37 -18.087  -2.653   3.585
  290    HB2  ALA  37           HB2      ALA  37 -16.432  -3.114   4.009
  291    HB3  ALA  37           HB3      ALA  37 -17.369  -2.082   5.093
  292    H    ASN  38           HN       ASN  38 -18.039  -3.336   7.485
  293    HA   ASN  38           HA       ASN  38 -15.515  -4.027   8.484
  294    HB2  ASN  38           HB2      ASN  38 -16.980  -2.436   9.667
  295    HB3  ASN  38           HB1      ASN  38 -18.144  -3.720   9.983
  296   HD21  ASN  38          HD21      ASN  38 -17.673  -5.327  11.528
  297   HD22  ASN  38          HD22      ASN  38 -16.390  -5.084  12.744
  298    H    ASP  39           HN       ASP  39 -18.611  -5.759   8.709
  299    HA   ASP  39           HA       ASP  39 -17.546  -7.975  10.132
  300    HB2  ASP  39           HB2      ASP  39 -20.104  -7.607   8.576
  301    HB3  ASP  39           HB1      ASP  39 -19.716  -9.088   9.443
  302    H    ASN  40           HN       ASN  40 -17.255  -7.063   6.912
  303    HA   ASN  40           HA       ASN  40 -16.806  -9.799   5.996
  304    HB2  ASN  40           HB2      ASN  40 -17.280  -7.186   4.615
  305    HB3  ASN  40           HB1      ASN  40 -16.404  -8.451   3.766
  306   HD21  ASN  40          HD21      ASN  40 -19.471  -7.459   5.086
  307   HD22  ASN  40          HD22      ASN  40 -20.422  -8.752   4.329
  308    H    GLY  41           HN       GLY  41 -15.134  -7.387   7.461
  309    HA2  GLY  41           HA2      GLY  41 -12.882  -7.242   7.949
  310    HA3  GLY  41           HA1      GLY  41 -12.609  -8.599   6.869
  311    H    VAL  42           HN       VAL  42 -14.317  -5.910   5.528
  312    HA   VAL  42           HA       VAL  42 -11.926  -5.274   3.974
  313    HB   VAL  42           HB       VAL  42 -14.831  -4.672   3.329
  314   HG11  VAL  42          HG11      VAL  42 -13.303  -3.069   2.321
  315   HG12  VAL  42          HG12      VAL  42 -13.921  -4.165   1.080
  316   HG13  VAL  42          HG13      VAL  42 -12.293  -4.380   1.721
  317   HG21  VAL  42          HG21      VAL  42 -12.948  -6.789   2.313
  318   HG22  VAL  42          HG22      VAL  42 -14.534  -6.441   1.629
  319   HG23  VAL  42          HG23      VAL  42 -14.400  -7.052   3.281
  320    H    ASP  43           HN       ASP  43 -10.895  -3.510   4.434
  321    HA   ASP  43           HA       ASP  43 -12.369  -1.143   5.353
  322    HB2  ASP  43           HB2      ASP  43 -11.405  -2.248   7.375
  323    HB3  ASP  43           HB1      ASP  43  -9.802  -2.121   6.655
  324    H    GLY  44           HN       GLY  44 -11.809   0.618   4.112
  325    HA2  GLY  44           HA2      GLY  44  -9.171   1.191   3.300
  326    HA3  GLY  44           HA1      GLY  44 -10.031   0.414   1.978
  327    H    GLU  45           HN       GLU  45  -9.484   2.627   1.050
  328    HA   GLU  45           HA       GLU  45 -10.775   4.967   1.924
  329    HB2  GLU  45           HB2      GLU  45  -9.607   4.061  -0.682
  330    HB3  GLU  45           HB1      GLU  45 -10.548   5.546  -0.638
  331    HG2  GLU  45           HG2      GLU  45  -8.053   4.928   0.926
  332    HG3  GLU  45           HG1      GLU  45  -8.224   6.066  -0.411
  333    H    TRP  46           HN       TRP  46 -12.653   5.975   1.303
  334    HA   TRP  46           HA       TRP  46 -14.660   4.206   0.083
  335    HB2  TRP  46           HB2      TRP  46 -14.784   5.815   2.568
  336    HB3  TRP  46           HB1      TRP  46 -16.202   5.913   1.537
  337    HD1  TRP  46           HD1      TRP  46 -13.932   3.077   2.903
  338    HE1  TRP  46           HE1      TRP  46 -15.409   1.097   3.590
  339    HE3  TRP  46           HE3      TRP  46 -18.562   4.997   1.694
  340    HZ2  TRP  46           HZ2      TRP  46 -18.125   0.432   3.629
  341    HZ3  TRP  46           HZ3      TRP  46 -20.531   3.603   2.125
  342    HH2  TRP  46           HH2      TRP  46 -20.310   1.366   3.063
  343    H    THR  47           HN       THR  47 -15.158   4.878  -1.862
  344    HA   THR  47           HA       THR  47 -15.137   7.761  -2.439
  345    HB   THR  47           HB       THR  47 -15.178   6.895  -4.883
  346    HG1  THR  47           HG1      THR  47 -13.994   4.595  -3.701
  347   HG21  THR  47          HG21      THR  47 -13.245   7.990  -3.833
  348   HG22  THR  47          HG22      THR  47 -12.745   6.688  -4.915
  349   HG23  THR  47          HG23      THR  47 -12.734   6.439  -3.168
  350    H    TYR  48           HN       TYR  48 -16.859   8.634  -3.746
  351    HA   TYR  48           HA       TYR  48 -19.261   7.057  -4.040
  352    HB2  TYR  48           HB2      TYR  48 -19.673   7.755  -1.835
  353    HB3  TYR  48           HB1      TYR  48 -18.992   9.333  -2.091
  354    HD1  TYR  48           HD1      TYR  48 -20.487  11.141  -2.305
  355    HD2  TYR  48           HD2      TYR  48 -21.810   7.209  -3.298
  356    HE1  TYR  48           HE1      TYR  48 -22.754  12.003  -2.704
  357    HE2  TYR  48           HE2      TYR  48 -24.074   8.073  -3.704
  358    HH   TYR  48           HH       TYR  48 -25.460   9.970  -3.068
  359    H    ASP  49           HN       ASP  49 -20.812   8.026  -5.415
  360    HA   ASP  49           HA       ASP  49 -20.120  10.612  -6.658
  361    HB2  ASP  49           HB2      ASP  49 -19.132   8.789  -8.107
  362    HB3  ASP  49           HB1      ASP  49 -20.764   8.193  -8.393
  363    H    ASP  50           HN       ASP  50 -21.984  11.826  -6.991
  364    HA   ASP  50           HA       ASP  50 -24.366  10.676  -5.791
  365    HB2  ASP  50           HB2      ASP  50 -25.302  13.092  -6.246
  366    HB3  ASP  50           HB1      ASP  50 -23.956  12.952  -5.105
  367    H    ALA  51           HN       ALA  51 -23.189  10.836  -8.978
  368    HA   ALA  51           HA       ALA  51 -25.768  11.101 -10.213
  369    HB1  ALA  51           HB1      ALA  51 -24.649  10.673 -12.307
  370    HB2  ALA  51           HB2      ALA  51 -23.197  10.137 -11.458
  371    HB3  ALA  51           HB3      ALA  51 -23.711  11.821 -11.352
  372    H    THR  52           HN       THR  52 -23.655   8.378  -9.377
  373    HA   THR  52           HA       THR  52 -25.725   6.552 -10.388
  374    HB   THR  52           HB       THR  52 -23.907   4.803 -10.094
  375    HG1  THR  52           HG1      THR  52 -21.878   6.584 -10.279
  376   HG21  THR  52          HG21      THR  52 -24.479   5.803 -12.285
  377   HG22  THR  52          HG22      THR  52 -22.763   5.412 -12.161
  378   HG23  THR  52          HG23      THR  52 -23.304   7.082 -11.988
  379    H    LYS  53           HN       LYS  53 -24.700   7.886  -7.490
  380    HA   LYS  53           HA       LYS  53 -25.063   7.439  -5.266
  381    HB2  LYS  53           HB2      LYS  53 -27.118   5.530  -6.417
  382    HB3  LYS  53           HB1      LYS  53 -26.927   5.847  -4.704
  383    HG2  LYS  53           HG2      LYS  53 -28.748   7.163  -5.425
  384    HG3  LYS  53           HG1      LYS  53 -27.394   8.268  -5.188
  385    HD2  LYS  53           HD2      LYS  53 -26.984   8.304  -7.585
  386    HD3  LYS  53           HD1      LYS  53 -28.290   7.149  -7.844
  387    HE2  LYS  53           HE2      LYS  53 -29.111   9.345  -8.338
  388    HE3  LYS  53           HE1      LYS  53 -29.866   8.783  -6.848
  389    HZ1  LYS  53           HZ1      LYS  53 -27.553  10.636  -7.005
  390    HZ2  LYS  53           HZ2      LYS  53 -28.316  10.125  -5.581
  391    HZ3  LYS  53           HZ3      LYS  53 -29.152  11.084  -6.690
  392    H    THR  54           HN       THR  54 -22.960   6.120  -6.580
  393    HA   THR  54           HA       THR  54 -22.974   3.395  -5.513
  394    HB   THR  54           HB       THR  54 -20.880   4.598  -7.328
  395    HG1  THR  54           HG1      THR  54 -22.485   4.678  -8.722
  396   HG21  THR  54          HG21      THR  54 -20.287   2.470  -6.211
  397   HG22  THR  54          HG22      THR  54 -20.482   2.241  -7.948
  398   HG23  THR  54          HG23      THR  54 -21.758   1.723  -6.844
  399    H    TYR  55           HN       TYR  55 -21.844   2.886  -3.755
  400    HA   TYR  55           HA       TYR  55 -19.618   4.632  -2.945
  401    HB2  TYR  55           HB2      TYR  55 -21.440   2.857  -1.310
  402    HB3  TYR  55           HB1      TYR  55 -19.868   3.349  -0.703
  403    HD1  TYR  55           HD1      TYR  55 -23.202   4.529  -1.722
  404    HD2  TYR  55           HD2      TYR  55 -19.517   5.578   0.143
  405    HE1  TYR  55           HE1      TYR  55 -24.212   6.623  -0.923
  406    HE2  TYR  55           HE2      TYR  55 -20.517   7.680   0.941
  407    HH   TYR  55           HH       TYR  55 -23.903   8.302   0.734
  408    H    THR  56           HN       THR  56 -17.597   3.780  -2.804
  409    HA   THR  56           HA       THR  56 -17.356   0.876  -3.206
  410    HB   THR  56           HB       THR  56 -15.779   3.001  -4.682
  411    HG1  THR  56           HG1      THR  56 -18.072   1.845  -5.246
  412   HG21  THR  56          HG21      THR  56 -14.312   1.131  -4.119
  413   HG22  THR  56          HG22      THR  56 -14.685   1.094  -5.843
  414   HG23  THR  56          HG23      THR  56 -15.495  -0.016  -4.737
  415    H    VAL  57           HN       VAL  57 -15.872  -0.128  -2.001
  416    HA   VAL  57           HA       VAL  57 -14.059   1.561  -0.409
  417    HB   VAL  57           HB       VAL  57 -15.661   0.468   1.123
  418   HG11  VAL  57          HG11      VAL  57 -14.686  -2.126  -0.056
  419   HG12  VAL  57          HG12      VAL  57 -16.343  -1.516  -0.010
  420   HG13  VAL  57          HG13      VAL  57 -15.543  -2.007   1.476
  421   HG21  VAL  57          HG21      VAL  57 -12.888  -0.705   1.302
  422   HG22  VAL  57          HG22      VAL  57 -14.049  -0.585   2.624
  423   HG23  VAL  57          HG23      VAL  57 -13.397   0.879   1.890
  424    H    THR  58           HN       THR  58 -12.020   1.349  -0.905
  425    HA   THR  58           HA       THR  58 -11.224  -1.013  -2.477
  426    HB   THR  58           HB       THR  58  -9.910   1.696  -2.658
  427    HG1  THR  58           HG1      THR  58 -12.204   0.682  -3.986
  428   HG21  THR  58          HG21      THR  58 -10.050  -0.659  -4.559
  429   HG22  THR  58          HG22      THR  58  -8.654  -0.178  -3.593
  430   HG23  THR  58          HG23      THR  58  -9.239   0.876  -4.880
  431    H    GLU  59           HN       GLU  59  -9.473  -2.136  -1.867
  432    HA   GLU  59           HA       GLU  59  -8.169  -1.385   0.629
  433    HB2  GLU  59           HB2      GLU  59  -7.822  -3.886  -1.057
  434    HB3  GLU  59           HB1      GLU  59  -7.077  -3.611   0.490
  435    HG2  GLU  59           HG2      GLU  59  -9.455  -3.411   1.415
  436    HG3  GLU  59           HG1      GLU  59  -9.949  -4.148  -0.111
  437    H    GLY  60           HN       GLY  60  -5.811  -1.359   0.858
  438    HA2  GLY  60           HA2      GLY  60  -4.499  -0.428  -1.619
  439    HA3  GLY  60           HA1      GLY  60  -3.968  -0.052   0.021
  440    H    SER  61           HN       SER  61  -3.445  -2.014  -2.628
  441    HA   SER  61           HA       SER  61  -2.604  -4.341  -1.127
  442    HB2  SER  61           HB2      SER  61  -3.764  -4.265  -3.473
  443    HB3  SER  61           HB1      SER  61  -2.129  -4.001  -4.064
  444    HG   SER  61           HG       SER  61  -1.508  -5.975  -3.268
  445    H    GLY  62           HN       GLY  62  -0.863  -2.663  -3.768
  446    HA2  GLY  62           HA2      GLY  62   1.607  -3.136  -2.232
  447    HA3  GLY  62           HA1      GLY  62   1.518  -2.971  -3.978
  448    H    GLY  63           HN       GLY  63   0.971  -1.157  -0.972
  449    HA2  GLY  63           HA2      GLY  63   2.075   1.197  -2.379
  450    HA3  GLY  63           HA1      GLY  63   0.688   1.322  -1.308
  451    H    ALA  64           HN       ALA  64   2.241  -0.843   0.346
  452    HA   ALA  64           HA       ALA  64   4.296   0.830   1.533
  453    HB1  ALA  64           HB1      ALA  64   2.238   1.567   2.634
  454    HB2  ALA  64           HB2      ALA  64   3.319   0.748   3.764
  455    HB3  ALA  64           HB3      ALA  64   1.908  -0.095   3.122
  456    H    GLY  65           HN       GLY  65   5.750  -0.294   2.844
  457    HA2  GLY  65           HA2      GLY  65   6.018  -2.428   4.183
  458    HA3  GLY  65           HA1      GLY  65   5.474  -3.231   2.715
  459    H    GLY  66           HN       GLY  66   8.148  -2.102   4.453
  460    HA2  GLY  66           HA2      GLY  66   9.919  -1.945   2.148
  461    HA3  GLY  66           HA1      GLY  66  10.368  -1.727   3.834
  462    H    GLN  67           HN       GLN  67   8.703  -4.337   4.180
  463    HA   GLN  67           HA       GLN  67   8.966  -6.582   4.253
  464    HB2  GLN  67           HB2      GLN  67  11.073  -6.170   2.109
  465    HB3  GLN  67           HB1      GLN  67  10.395  -7.738   2.614
  466    HG2  GLN  67           HG2      GLN  67   8.823  -5.456   1.408
  467    HG3  GLN  67           HG1      GLN  67   9.393  -6.880   0.540
  468   HE21  GLN  67          HE21      GLN  67   8.866  -8.748   2.658
  469   HE22  GLN  67          HE22      GLN  67   7.145  -8.918   2.749
  470    H    GLY  68           HN       GLY  68  11.165  -4.432   5.294
  471    HA2  GLY  68           HA2      GLY  68  12.455  -4.609   7.208
  472    HA3  GLY  68           HA1      GLY  68  12.236  -6.348   7.169
  473    H    MET  69           HN       MET  69  13.261  -6.792   4.553
  474    HA   MET  69           HA       MET  69  15.194  -7.209   3.428
  475    HB2  MET  69           HB2      MET  69  16.427  -4.930   4.993
  476    HB3  MET  69           HB1      MET  69  17.055  -5.657   3.524
  477    HG2  MET  69           HG2      MET  69  14.473  -4.126   3.743
  478    HG3  MET  69           HG1      MET  69  15.992  -3.485   3.125
  479    HE1  MET  69           HE1      MET  69  17.063  -4.144   0.824
  480    HE2  MET  69           HE2      MET  69  16.487  -5.472  -0.187
  481    HE3  MET  69           HE3      MET  69  17.185  -5.804   1.401
  482    H    ILE  70           HN       ILE  70  15.748  -9.223   4.194
  483    HA   ILE  70           HA       ILE  70  17.434  -9.308   6.601
  484    HB   ILE  70           HB       ILE  70  15.162 -11.258   6.068
  485   HG12  ILE  70          HG12      ILE  70  15.406  -9.163   8.242
  486   HG13  ILE  70          HG11      ILE  70  14.407  -9.007   6.800
  487   HG21  ILE  70          HG21      ILE  70  15.666 -12.238   8.234
  488   HG22  ILE  70          HG22      ILE  70  16.955 -11.070   8.511
  489   HG23  ILE  70          HG23      ILE  70  17.120 -12.278   7.233
  490   HD11  ILE  70          HD11      ILE  70  13.091  -9.656   8.742
  491   HD12  ILE  70          HD12      ILE  70  14.088 -11.098   8.941
  492   HD13  ILE  70          HD13      ILE  70  13.073 -10.919   7.510
  493    H    GLN  71           HN       GLN  71  16.921 -10.266   3.409
  494    HA   GLN  71           HA       GLN  71  18.562 -12.699   3.650
  495    HB2  GLN  71           HB2      GLN  71  17.155 -11.730   1.159
  496    HB3  GLN  71           HB1      GLN  71  17.753 -13.349   1.507
  497    HG2  GLN  71           HG2      GLN  71  15.697 -13.868   2.134
  498    HG3  GLN  71           HG1      GLN  71  15.943 -12.833   3.539
  499   HE21  GLN  71          HE21      GLN  71  16.104 -10.431   1.718
  500   HE22  GLN  71          HE22      GLN  71  14.457 -10.097   1.313
  501    H    GLU  72           HN       GLU  72  19.454  -9.895   3.841
  502    HA   GLU  72           HA       GLU  72  20.952  -9.536   1.355
  503    HB2  GLU  72           HB2      GLU  72  20.991  -7.469   3.501
  504    HB3  GLU  72           HB1      GLU  72  21.022  -7.269   1.759
  505    HG2  GLU  72           HG2      GLU  72  18.657  -7.720   3.549
  506    HG3  GLU  72           HG1      GLU  72  18.973  -6.378   2.462
  507    HA   PRO  73           HA       PRO  73  24.652 -10.687   3.553
  508    HB2  PRO  73           HB2      PRO  73  26.486  -9.784   1.755
  509    HB3  PRO  73           HB1      PRO  73  25.524 -11.283   1.505
  510    HG2  PRO  73           HG2      PRO  73  25.141  -8.544   0.333
  511    HG3  PRO  73           HG1      PRO  73  24.896 -10.132  -0.413
  512    HD2  PRO  73           HD2      PRO  73  22.877  -8.535   0.560
  513    HD3  PRO  73           HD1      PRO  73  22.764 -10.316   0.388
  514    H    ALA  74           HN       ALA  74  26.876  -9.633   3.981
  515    HA   ALA  74           HA       ALA  74  28.092  -8.053   5.030
  516    HB1  ALA  74           HB1      ALA  74  27.941  -5.737   4.274
  517    HB2  ALA  74           HB2      ALA  74  26.436  -6.109   3.435
  518    HB3  ALA  74           HB3      ALA  74  27.944  -6.855   2.909
  519    H    LEU  75           HN       LEU  75  27.576  -5.641   6.125
  520    HA   LEU  75           HA       LEU  75  25.882  -6.348   8.319
  521    HB2  LEU  75           HB2      LEU  75  27.644  -4.026   7.730
  522    HB3  LEU  75           HB1      LEU  75  26.443  -3.880   8.988
  523    HG   LEU  75           HG       LEU  75  28.678  -4.470   9.852
  524   HD11  LEU  75          HD11      LEU  75  26.728  -5.089  11.128
  525   HD12  LEU  75          HD12      LEU  75  27.953  -6.353  11.259
  526   HD13  LEU  75          HD13      LEU  75  26.557  -6.580  10.204
  527   HD21  LEU  75          HD21      LEU  75  29.567  -6.718   9.469
  528   HD22  LEU  75          HD22      LEU  75  29.464  -5.797   7.969
  529   HD23  LEU  75          HD23      LEU  75  28.261  -7.037   8.325
  530    HA   PRO  76           HA       PRO  76  22.223  -4.435   6.587
  531    HB2  PRO  76           HB2      PRO  76  21.089  -4.462   9.280
  532    HB3  PRO  76           HB1      PRO  76  20.558  -5.382   7.878
  533    HG2  PRO  76           HG2      PRO  76  21.752  -6.508  10.065
  534    HG3  PRO  76           HG1      PRO  76  21.832  -7.201   8.404
  535    HD2  PRO  76           HD2      PRO  76  23.956  -5.674   9.931
  536    HD3  PRO  76           HD1      PRO  76  24.120  -6.979   8.744
  537    HA   PRO  77           HA       PRO  77  22.324  -0.169   7.535
  538    HB2  PRO  77           HB2      PRO  77  19.759   0.569   8.046
  539    HB3  PRO  77           HB1      PRO  77  20.313   0.111   6.427
  540    HG2  PRO  77           HG2      PRO  77  18.954  -1.567   8.506
  541    HG3  PRO  77           HG1      PRO  77  18.520  -1.372   6.791
  542    HD2  PRO  77           HD2      PRO  77  19.934  -3.501   7.627
  543    HD3  PRO  77           HD1      PRO  77  20.349  -2.706   6.078
  544    H    GLY  78           HN       GLY  78  22.998   0.949   9.243
  545    HA2  GLY  78           HA2      GLY  78  23.103   1.744  11.418
  546    HA3  GLY  78           HA1      GLY  78  21.683   0.785  11.788
  547    H    TRP  79           HN       TRP  79  23.442  -1.587  10.601
  548    HA   TRP  79           HA       TRP  79  24.461  -2.300  13.258
  549    HB2  TRP  79           HB2      TRP  79  24.155  -3.882  10.694
  550    HB3  TRP  79           HB1      TRP  79  25.021  -4.512  12.087
  551    HD1  TRP  79           HD1      TRP  79  21.471  -3.466  11.023
  552    HE1  TRP  79           HE1      TRP  79  19.783  -4.600  12.603
  553    HE3  TRP  79           HE3      TRP  79  24.753  -5.564  14.333
  554    HZ2  TRP  79           HZ2      TRP  79  19.850  -6.174  14.966
  555    HZ3  TRP  79           HZ3      TRP  79  23.875  -6.857  16.220
  556    HH2  TRP  79           HH2      TRP  79  21.478  -7.165  16.541
  557    H    GLU  80           HN       GLU  80  26.621  -2.476  13.791
  558    HA   GLU  80           HA       GLU  80  28.553  -1.768  11.685
  559    HB2  GLU  80           HB2      GLU  80  28.386  -0.829  14.546
  560    HB3  GLU  80           HB1      GLU  80  29.844  -0.660  13.585
  561    HG2  GLU  80           HG2      GLU  80  27.203   0.477  12.730
  562    HG3  GLU  80           HG1      GLU  80  28.347   1.359  13.742
  563    H    MET  81           HN       MET  81  30.255  -3.062  11.493
  564    HA   MET  81           HA       MET  81  30.768  -5.048  13.591
  565    HB2  MET  81           HB2      MET  81  30.341  -6.056  11.417
  566    HB3  MET  81           HB1      MET  81  31.592  -5.037  10.677
  567    HG2  MET  81           HG2      MET  81  33.253  -6.191  12.198
  568    HG3  MET  81           HG1      MET  81  31.955  -7.294  12.641
  569    HE1  MET  81           HE1      MET  81  33.595  -9.291  11.889
  570    HE2  MET  81           HE2      MET  81  34.823  -8.152  11.338
  571    HE3  MET  81           HE3      MET  81  34.265  -9.435  10.263
  572    H    LYS  82           HN       LYS  82  32.592  -4.729  14.826
  573    HA   LYS  82           HA       LYS  82  34.674  -2.982  13.767
  574    HB2  LYS  82           HB2      LYS  82  33.140  -2.283  16.294
  575    HB3  LYS  82           HB1      LYS  82  34.616  -1.497  15.777
  576    HG2  LYS  82           HG2      LYS  82  33.547  -0.221  14.236
  577    HG3  LYS  82           HG1      LYS  82  32.469  -1.561  13.760
  578    HD2  LYS  82           HD2      LYS  82  31.191   0.235  14.745
  579    HD3  LYS  82           HD1      LYS  82  31.137  -1.189  15.785
  580    HE2  LYS  82           HE2      LYS  82  31.408   0.881  17.046
  581    HE3  LYS  82           HE1      LYS  82  32.781  -0.194  17.263
  582    HZ1  LYS  82           HZ1      LYS  82  32.699   2.113  15.391
  583    HZ2  LYS  82           HZ2      LYS  82  34.046   1.129  15.709
  584    HZ3  LYS  82           HZ3      LYS  82  33.424   2.137  16.924
  585    H    TYR  83           HN       TYR  83  36.634  -3.014  15.081
  586    HA   TYR  83           HA       TYR  83  36.785  -5.506  16.652
  587    HB2  TYR  83           HB2      TYR  83  39.027  -3.937  15.305
  588    HB3  TYR  83           HB1      TYR  83  39.202  -5.524  16.103
  589    HD1  TYR  83           HD1      TYR  83  37.957  -7.487  15.082
  590    HD2  TYR  83           HD2      TYR  83  38.462  -3.797  13.027
  591    HE1  TYR  83           HE1      TYR  83  37.521  -8.625  12.947
  592    HE2  TYR  83           HE2      TYR  83  38.027  -4.924  10.883
  593    HH   TYR  83           HH       TYR  83  36.689  -7.983  10.646
  594    H    THR  84           HN       THR  84  37.889  -5.503  18.635
  595    HA   THR  84           HA       THR  84  37.937  -2.969  20.023
  596    HB   THR  84           HB       THR  84  38.404  -4.199  22.021
  597    HG1  THR  84           HG1      THR  84  39.215  -6.279  22.005
  598   HG21  THR  84          HG21      THR  84  36.711  -5.963  22.039
  599   HG22  THR  84          HG22      THR  84  36.639  -5.916  20.277
  600   HG23  THR  84          HG23      THR  84  36.134  -4.513  21.222
  601    H    SER  85           HN       SER  85  40.111  -2.846  21.564
  602    HA   SER  85           HA       SER  85  42.218  -2.339  19.664
  603    HB2  SER  85           HB2      SER  85  43.458  -1.552  21.716
  604    HB3  SER  85           HB1      SER  85  41.908  -0.753  21.451
  605    HG   SER  85           HG       SER  85  42.442  -2.894  23.252
  606    H    GLU  86           HN       GLU  86  41.273  -5.161  20.674
  607    HA   GLU  86           HA       GLU  86  43.960  -6.207  21.397
  608    HB2  GLU  86           HB2      GLU  86  41.322  -7.576  22.003
  609    HB3  GLU  86           HB1      GLU  86  42.885  -7.891  22.738
  610    HG2  GLU  86           HG2      GLU  86  41.184  -5.433  23.145
  611    HG3  GLU  86           HG1      GLU  86  41.366  -6.773  24.272
  612    H    GLY  87           HN       GLY  87  41.817  -5.903  18.928
  613    HA2  GLY  87           HA2      GLY  87  41.901  -6.923  16.835
  614    HA3  GLY  87           HA1      GLY  87  42.892  -8.197  17.529
  615    H    VAL  88           HN       VAL  88  39.895  -7.394  19.080
  616    HA   VAL  88           HA       VAL  88  38.809  -9.975  18.176
  617    HB   VAL  88           HB       VAL  88  38.098  -8.446  20.691
  618   HG11  VAL  88          HG11      VAL  88  37.336 -11.196  19.721
  619   HG12  VAL  88          HG12      VAL  88  36.269  -9.810  19.933
  620   HG13  VAL  88          HG13      VAL  88  37.009 -10.577  21.339
  621   HG21  VAL  88          HG21      VAL  88  39.382 -10.140  21.890
  622   HG22  VAL  88          HG22      VAL  88  40.409  -9.274  20.748
  623   HG23  VAL  88          HG23      VAL  88  39.838 -10.898  20.363
  624    H    ARG  89           HN       ARG  89  37.068  -9.968  16.948
  625    HA   ARG  89           HA       ARG  89  35.761  -7.665  16.075
  626    HB2  ARG  89           HB2      ARG  89  35.119  -9.116  14.491
  627    HB3  ARG  89           HB1      ARG  89  36.064 -10.313  15.321
  628    HG2  ARG  89           HG2      ARG  89  34.008 -10.903  16.629
  629    HG3  ARG  89           HG1      ARG  89  33.112  -9.818  15.555
  630    HD2  ARG  89           HD2      ARG  89  33.153 -11.269  13.858
  631    HD3  ARG  89           HD1      ARG  89  34.815 -11.739  14.170
  632    HE   ARG  89           HE       ARG  89  34.094 -13.468  15.522
  633   HH11  ARG  89          HH11      ARG  89  31.342 -11.497  14.602
  634   HH12  ARG  89          HH12      ARG  89  30.165 -12.636  15.177
  635   HH21  ARG  89          HH21      ARG  89  32.578 -14.970  16.266
  636   HH22  ARG  89          HH22      ARG  89  30.878 -14.621  16.136
  637    H    TYR  90           HN       TYR  90  33.846  -6.723  16.662
  638    HA   TYR  90           HA       TYR  90  31.903  -8.236  18.204
  639    HB2  TYR  90           HB2      TYR  90  31.643  -6.609  19.960
  640    HB3  TYR  90           HB1      TYR  90  33.328  -7.071  19.901
  641    HD1  TYR  90           HD1      TYR  90  35.013  -5.481  19.002
  642    HD2  TYR  90           HD2      TYR  90  30.958  -4.351  19.582
  643    HE1  TYR  90           HE1      TYR  90  35.674  -3.113  18.915
  644    HE2  TYR  90           HE2      TYR  90  31.603  -1.979  19.496
  645    HH   TYR  90           HH       TYR  90  34.752  -0.954  18.519
  646    H    PHE  91           HN       PHE  91  29.739  -7.058  18.215
  647    HA   PHE  91           HA       PHE  91  29.618  -5.253  15.906
  648    HB2  PHE  91           HB2      PHE  91  27.574  -7.331  16.718
  649    HB3  PHE  91           HB1      PHE  91  27.374  -6.166  15.426
  650    HD1  PHE  91           HD1      PHE  91  28.990  -9.321  16.381
  651    HD2  PHE  91           HD2      PHE  91  28.661  -6.321  13.351
  652    HE1  PHE  91           HE1      PHE  91  30.008 -10.838  14.758
  653    HE2  PHE  91           HE2      PHE  91  29.680  -7.861  11.740
  654    HZ   PHE  91           HZ       PHE  91  30.349 -10.114  12.435
  655    H    VAL  92           HN       VAL  92  28.068  -3.619  15.949
  656    HA   VAL  92           HA       VAL  92  27.187  -2.915  18.673
  657    HB   VAL  92           HB       VAL  92  27.606  -1.064  16.313
  658   HG11  VAL  92          HG11      VAL  92  27.117  -0.413  19.213
  659   HG12  VAL  92          HG12      VAL  92  25.932  -0.253  17.909
  660   HG13  VAL  92          HG13      VAL  92  27.389   0.745  17.913
  661   HG21  VAL  92          HG21      VAL  92  29.552  -0.239  17.511
  662   HG22  VAL  92          HG22      VAL  92  29.721  -1.939  17.074
  663   HG23  VAL  92          HG23      VAL  92  29.327  -1.489  18.733
  664    H    ASP  93           HN       ASP  93  25.031  -3.215  18.975
  665    HA   ASP  93           HA       ASP  93  23.283  -3.214  16.627
  666    HB2  ASP  93           HB2      ASP  93  22.584  -4.851  18.234
  667    HB3  ASP  93           HB1      ASP  93  22.700  -3.722  19.571
  668    H    HIS  94           HN       HIS  94  21.967  -1.490  16.089
  669    HA   HIS  94           HA       HIS  94  22.621   0.987  17.427
  670    HB2  HIS  94           HB2      HIS  94  21.562   2.064  15.487
  671    HB3  HIS  94           HB1      HIS  94  22.754   0.870  14.990
  672    HD1  HIS  94           HD1      HIS  94  21.839  -1.358  13.937
  673    HD2  HIS  94           HD2      HIS  94  18.961   1.565  14.626
  674    HE1  HIS  94           HE1      HIS  94  19.807  -2.100  12.657
  675    HE2  HIS  94           HE2      HIS  94  18.029  -0.413  13.235
  676    H    ASN  95           HN       ASN  95  19.932  -1.237  17.417
  677    HA   ASN  95           HA       ASN  95  17.989   0.859  17.886
  678    HB2  ASN  95           HB2      ASN  95  16.321  -0.712  17.539
  679    HB3  ASN  95           HB1      ASN  95  17.641  -1.478  16.668
  680   HD21  ASN  95          HD21      ASN  95  18.581  -3.339  17.516
  681   HD22  ASN  95          HD22      ASN  95  17.822  -4.243  18.777
  682    H    THR  96           HN       THR  96  19.689  -1.554  19.823
  683    HA   THR  96           HA       THR  96  18.356  -0.489  22.223
  684    HB   THR  96           HB       THR  96  19.439  -2.352  23.442
  685    HG1  THR  96           HG1      THR  96  20.359  -3.108  20.842
  686   HG21  THR  96          HG21      THR  96  17.181  -2.635  22.438
  687   HG22  THR  96          HG22      THR  96  18.080  -4.145  22.594
  688   HG23  THR  96          HG23      THR  96  17.946  -3.360  21.022
  689    H    ARG  97           HN       ARG  97  21.089  -0.166  20.363
  690    HA   ARG  97           HA       ARG  97  23.132   0.785  20.574
  691    HB2  ARG  97           HB2      ARG  97  21.699   2.202  22.809
  692    HB3  ARG  97           HB1      ARG  97  23.367   2.561  22.377
  693    HG2  ARG  97           HG2      ARG  97  22.422   2.855  19.994
  694    HG3  ARG  97           HG1      ARG  97  20.869   3.024  20.809
  695    HD2  ARG  97           HD2      ARG  97  21.891   5.200  20.448
  696    HD3  ARG  97           HD1      ARG  97  21.795   4.830  22.168
  697    HE   ARG  97           HE       ARG  97  24.291   3.965  21.387
  698   HH11  ARG  97          HH11      ARG  97  22.561   6.998  21.341
  699   HH12  ARG  97          HH12      ARG  97  23.994   7.972  21.510
  700   HH21  ARG  97          HH21      ARG  97  26.188   5.219  21.621
  701   HH22  ARG  97          HH22      ARG  97  26.073   6.949  21.652
  702    H    THR  98           HN       THR  98  23.906  -1.289  21.034
  703    HA   THR  98           HA       THR  98  25.150  -1.497  23.671
  704    HB   THR  98           HB       THR  98  22.945  -2.835  23.585
  705    HG1  THR  98           HG1      THR  98  24.014  -4.636  24.661
  706   HG21  THR  98          HG21      THR  98  23.062  -5.043  22.492
  707   HG22  THR  98          HG22      THR  98  24.640  -4.630  21.822
  708   HG23  THR  98          HG23      THR  98  23.207  -3.743  21.304
  709    H    THR  99           HN       THR  99  26.735  -3.351  23.685
  710    HA   THR  99           HA       THR  99  28.014  -3.606  21.026
  711    HB   THR  99           HB       THR  99  30.162  -3.988  22.407
  712    HG1  THR  99           HG1      THR  99  28.970  -4.313  24.417
  713   HG21  THR  99          HG21      THR  99  30.578  -1.578  22.715
  714   HG22  THR  99          HG22      THR  99  28.844  -1.259  22.727
  715   HG23  THR  99          HG23      THR  99  29.623  -1.800  21.242
  716    H    THR 100           HN       THR 100  27.466  -5.675  20.324
  717    HA   THR 100           HA       THR 100  27.339  -7.754  22.391
  718    HB   THR 100           HB       THR 100  25.049  -7.090  21.689
  719    HG1  THR 100           HG1      THR 100  24.673  -9.116  22.137
  720   HG21  THR 100          HG21      THR 100  26.006  -8.007  18.972
  721   HG22  THR 100          HG22      THR 100  25.290  -6.450  19.401
  722   HG23  THR 100          HG23      THR 100  24.300  -7.906  19.402
  723    H    PHE 101           HN       PHE 101  27.811  -9.876  21.728
  724    HA   PHE 101           HA       PHE 101  29.528 -10.021  19.341
  725    HB2  PHE 101           HB2      PHE 101  29.457 -11.638  21.911
  726    HB3  PHE 101           HB1      PHE 101  30.420 -12.120  20.457
  727    HD1  PHE 101           HD1      PHE 101  32.532 -11.256  20.123
  728    HD2  PHE 101           HD2      PHE 101  29.988  -9.384  22.978
  729    HE1  PHE 101           HE1      PHE 101  34.414  -9.864  20.882
  730    HE2  PHE 101           HE2      PHE 101  31.866  -7.987  23.738
  731    HZ   PHE 101           HZ       PHE 101  34.076  -8.225  22.689
  732    H    LYS 102           HN       LYS 102  28.012 -10.591  17.761
  733    HA   LYS 102           HA       LYS 102  26.474 -13.029  18.285
  734    HB2  LYS 102           HB2      LYS 102  25.951 -10.723  16.418
  735    HB3  LYS 102           HB1      LYS 102  25.055 -12.225  16.373
  736    HG2  LYS 102           HG2      LYS 102  24.438 -11.836  18.770
  737    HG3  LYS 102           HG1      LYS 102  25.176 -10.241  18.626
  738    HD2  LYS 102           HD2      LYS 102  22.823  -9.989  18.291
  739    HD3  LYS 102           HD1      LYS 102  23.611  -9.780  16.725
  740    HE2  LYS 102           HE2      LYS 102  21.671 -11.156  16.419
  741    HE3  LYS 102           HE1      LYS 102  23.108 -12.154  16.215
  742    HZ1  LYS 102           HZ1      LYS 102  21.361 -12.047  18.620
  743    HZ2  LYS 102           HZ2      LYS 102  22.813 -12.916  18.531
  744    HZ3  LYS 102           HZ3      LYS 102  21.512 -13.339  17.530
  745    H    ASP 103           HN       ASP 103  26.890 -14.783  17.141
  746    HA   ASP 103           HA       ASP 103  28.805 -14.653  14.990
  747    HB2  ASP 103           HB2      ASP 103  28.783 -17.134  15.385
  748    HB3  ASP 103           HB1      ASP 103  29.333 -16.184  16.741
  749    HA   PRO 104           HA       PRO 104  25.532 -15.100  11.962
  750    HB2  PRO 104           HB2      PRO 104  27.179 -16.031   9.927
  751    HB3  PRO 104           HB1      PRO 104  26.941 -14.318  10.300
  752    HG2  PRO 104           HG2      PRO 104  29.187 -16.133  11.066
  753    HG3  PRO 104           HG1      PRO 104  29.222 -14.419  10.614
  754    HD2  PRO 104           HD2      PRO 104  29.436 -15.232  13.176
  755    HD3  PRO 104           HD1      PRO 104  28.624 -13.717  12.726
  756    H    ARG 105           HN       ARG 105  27.900 -17.584  12.650
  757    HA   ARG 105           HA       ARG 105  25.985 -19.652  11.813
  758    HB2  ARG 105           HB2      ARG 105  28.975 -19.882  12.217
  759    HB3  ARG 105           HB1      ARG 105  27.905 -21.160  11.655
  760    HG2  ARG 105           HG2      ARG 105  28.439 -18.572  10.206
  761    HG3  ARG 105           HG1      ARG 105  29.171 -20.140   9.828
  762    HD2  ARG 105           HD2      ARG 105  26.205 -19.605   9.828
  763    HD3  ARG 105           HD1      ARG 105  27.219 -19.529   8.388
  764    HE   ARG 105           HE       ARG 105  27.711 -22.002   9.453
  765   HH11  ARG 105          HH11      ARG 105  24.802 -20.293   8.484
  766   HH12  ARG 105          HH12      ARG 105  23.979 -21.739   7.979
  767   HH21  ARG 105          HH21      ARG 105  26.605 -23.900   8.801
  768   HH22  ARG 105          HH22      ARG 105  25.008 -23.775   8.114
  769    HA   PRO 106           HA       PRO 106  25.380 -19.817  16.326
  770    HB2  PRO 106           HB2      PRO 106  24.098 -22.372  15.423
  771    HB3  PRO 106           HB1      PRO 106  23.512 -21.143  16.609
  772    HG2  PRO 106           HG2      PRO 106  22.527 -21.246  14.131
  773    HG3  PRO 106           HG1      PRO 106  22.829 -19.695  14.936
  774    HD2  PRO 106           HD2      PRO 106  24.329 -21.028  12.736
  775    HD3  PRO 106           HD1      PRO 106  24.099 -19.280  13.088
  776    H    GLY 107           HN       GLY 107  27.089 -20.379  17.497
  777    HA2  GLY 107           HA2      GLY 107  28.322 -21.874  18.786
  778    HA3  GLY 107           HA1      GLY 107  27.810 -23.206  17.723
  779    H    PHE 108           HN       PHE 108  28.609 -21.719  15.267
  780    HA   PHE 108           HA       PHE 108  30.440 -21.810  13.838
  781    HB2  PHE 108           HB2      PHE 108  30.743 -19.730  15.489
  782    HB3  PHE 108           HB1      PHE 108  32.159 -20.694  16.039
  783    HD1  PHE 108           HD1      PHE 108  34.110 -20.876  14.694
  784    HD2  PHE 108           HD2      PHE 108  30.634 -18.954  13.151
  785    HE1  PHE 108           HE1      PHE 108  35.424 -20.021  12.810
  786    HE2  PHE 108           HE2      PHE 108  31.955 -18.089  11.265
  787    HZ   PHE 108           HZ       PHE 108  34.367 -18.598  11.117
  788    H    GLU 109           HN       GLU 109  30.006 -24.213  15.100
  789    HA   GLU 109           HA       GLU 109  30.946 -26.260  15.366
  790    HB2  GLU 109           HB2      GLU 109  32.455 -25.610  13.506
  791    HB3  GLU 109           HB1      GLU 109  33.565 -24.907  14.672
  792    HG2  GLU 109           HG2      GLU 109  34.379 -27.059  13.990
  793    HG3  GLU 109           HG1      GLU 109  33.885 -27.133  15.679
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1 -43.115   8.376   0.435
    2    H2   GLY   1           HT2      GLY   1 -43.718   8.269   2.018
    3    H3   GLY   1           HT3      GLY   1 -43.936   6.979   0.937
    4    HA2  GLY   1           HA1      GLY   1 -41.360   7.923   2.060
    5    HA3  GLY   1           HA2      GLY   1 -42.195   6.434   2.484
    6    H    SER   2           HN       SER   2 -39.973   7.918   0.397
    7    HA   SER   2           HA       SER   2 -39.989   5.566  -1.371
    8    HB2  SER   2           HB2      SER   2 -38.673   7.043  -2.940
    9    HB3  SER   2           HB1      SER   2 -40.330   7.577  -2.647
   10    HG   SER   2           HG       SER   2 -37.933   8.614  -1.545
   11    H    HIS   3           HN       HIS   3 -38.305   4.211  -1.295
   12    HA   HIS   3           HA       HIS   3 -36.048   4.877   0.441
   13    HB2  HIS   3           HB2      HIS   3 -36.829   2.304  -0.967
   14    HB3  HIS   3           HB1      HIS   3 -35.393   2.482   0.028
   15    HD1  HIS   3           HD1      HIS   3 -36.970   0.339   1.067
   16    HD2  HIS   3           HD2      HIS   3 -38.029   4.272   1.956
   17    HE1  HIS   3           HE1      HIS   3 -38.369   0.221   3.148
   18    HE2  HIS   3           HE2      HIS   3 -39.106   2.584   3.605
   19    H    MET   4           HN       MET   4 -33.892   5.070  -0.372
   20    HA   MET   4           HA       MET   4 -33.757   5.398  -3.285
   21    HB2  MET   4           HB2      MET   4 -31.703   6.330  -1.265
   22    HB3  MET   4           HB1      MET   4 -31.849   6.813  -2.948
   23    HG2  MET   4           HG2      MET   4 -33.836   7.452  -0.781
   24    HG3  MET   4           HG1      MET   4 -32.607   8.550  -1.400
   25    HE1  MET   4           HE1      MET   4 -32.592   9.579  -3.786
   26    HE2  MET   4           HE2      MET   4 -33.768   9.211  -5.046
   27    HE3  MET   4           HE3      MET   4 -32.623   7.976  -4.518
   28    H    GLN   5           HN       GLN   5 -32.391   4.155  -4.509
   29    HA   GLN   5           HA       GLN   5 -31.229   1.876  -3.127
   30    HB2  GLN   5           HB2      GLN   5 -32.626   1.477  -5.119
   31    HB3  GLN   5           HB1      GLN   5 -31.487   2.395  -6.093
   32    HG2  GLN   5           HG2      GLN   5 -29.729   0.752  -5.452
   33    HG3  GLN   5           HG1      GLN   5 -30.987  -0.206  -4.678
   34   HE21  GLN   5          HE21      GLN   5 -29.612   0.854  -7.669
   35   HE22  GLN   5          HE22      GLN   5 -30.495  -0.265  -8.693
   36    H    TYR   6           HN       TYR   6 -29.166   1.847  -2.571
   37    HA   TYR   6           HA       TYR   6 -27.260   3.419  -4.198
   38    HB2  TYR   6           HB2      TYR   6 -27.221   2.810  -1.201
   39    HB3  TYR   6           HB1      TYR   6 -25.806   3.412  -2.046
   40    HD1  TYR   6           HD1      TYR   6 -25.796   5.728  -2.929
   41    HD2  TYR   6           HD2      TYR   6 -29.058   4.216  -0.654
   42    HE1  TYR   6           HE1      TYR   6 -26.572   8.026  -2.524
   43    HE2  TYR   6           HE2      TYR   6 -29.842   6.507  -0.241
   44    HH   TYR   6           HH       TYR   6 -28.550   9.213  -1.920
   45    H    LYS   7           HN       LYS   7 -25.348   2.349  -4.793
   46    HA   LYS   7           HA       LYS   7 -25.350  -0.539  -4.216
   47    HB2  LYS   7           HB2      LYS   7 -24.003  -0.705  -6.397
   48    HB3  LYS   7           HB1      LYS   7 -25.736  -0.356  -6.543
   49    HG2  LYS   7           HG2      LYS   7 -25.251   1.987  -6.882
   50    HG3  LYS   7           HG1      LYS   7 -23.532   1.683  -6.690
   51    HD2  LYS   7           HD2      LYS   7 -25.306   0.553  -8.853
   52    HD3  LYS   7           HD1      LYS   7 -24.128   1.854  -9.049
   53    HE2  LYS   7           HE2      LYS   7 -22.329   0.314  -8.431
   54    HE3  LYS   7           HE1      LYS   7 -23.502  -0.988  -8.241
   55    HZ1  LYS   7           HZ1      LYS   7 -22.802   0.442 -10.748
   56    HZ2  LYS   7           HZ2      LYS   7 -24.073  -0.677 -10.619
   57    HZ3  LYS   7           HZ3      LYS   7 -22.473  -1.177 -10.369
   58    H    LEU   8           HN       LEU   8 -23.393  -1.556  -3.822
   59    HA   LEU   8           HA       LEU   8 -21.101   0.240  -3.288
   60    HB2  LEU   8           HB2      LEU   8 -22.279  -0.294  -1.144
   61    HB3  LEU   8           HB1      LEU   8 -22.079  -1.983  -1.495
   62    HG   LEU   8           HG       LEU   8 -19.540  -1.471  -1.510
   63   HD11  LEU   8          HD11      LEU   8 -18.898   0.316   0.034
   64   HD12  LEU   8          HD12      LEU   8 -20.573   0.862   0.093
   65   HD13  LEU   8          HD13      LEU   8 -19.675   0.941  -1.420
   66   HD21  LEU   8          HD21      LEU   8 -21.284  -1.573   0.916
   67   HD22  LEU   8          HD22      LEU   8 -19.529  -1.740   0.979
   68   HD23  LEU   8          HD23      LEU   8 -20.498  -2.914   0.084
   69    H    ILE   9           HN       ILE   9 -19.092  -0.611  -3.635
   70    HA   ILE   9           HA       ILE   9 -19.000  -3.342  -4.717
   71    HB   ILE   9           HB       ILE   9 -17.483  -0.963  -5.850
   72   HG12  ILE   9          HG12      ILE   9 -19.610  -2.717  -7.163
   73   HG13  ILE   9          HG11      ILE   9 -19.933  -1.072  -6.502
   74   HG21  ILE   9          HG21      ILE   9 -17.422  -3.903  -6.519
   75   HG22  ILE   9          HG22      ILE   9 -16.086  -2.894  -5.954
   76   HG23  ILE   9          HG23      ILE   9 -16.764  -2.649  -7.567
   77   HD11  ILE   9          HD11      ILE   9 -19.639  -0.995  -8.907
   78   HD12  ILE   9          HD12      ILE   9 -18.070  -1.792  -8.782
   79   HD13  ILE   9          HD13      ILE   9 -18.293  -0.173  -8.118
   80    H    LEU  10           HN       LEU  10 -17.549  -4.559  -3.693
   81    HA   LEU  10           HA       LEU  10 -15.735  -3.195  -1.843
   82    HB2  LEU  10           HB2      LEU  10 -16.325  -6.155  -1.996
   83    HB3  LEU  10           HB1      LEU  10 -15.344  -5.359  -0.793
   84    HG   LEU  10           HG       LEU  10 -17.262  -5.743   0.380
   85   HD11  LEU  10          HD11      LEU  10 -16.743  -3.356   0.440
   86   HD12  LEU  10          HD12      LEU  10 -18.445  -3.718   0.726
   87   HD13  LEU  10          HD13      LEU  10 -17.931  -3.098  -0.845
   88   HD21  LEU  10          HD21      LEU  10 -19.495  -5.725  -0.444
   89   HD22  LEU  10          HD22      LEU  10 -18.507  -6.658  -1.571
   90   HD23  LEU  10          HD23      LEU  10 -18.987  -5.006  -1.965
   91    H    ASN  11           HN       ASN  11 -14.108  -2.521  -3.207
   92    HA   ASN  11           HA       ASN  11 -12.828  -4.533  -4.929
   93    HB2  ASN  11           HB2      ASN  11 -11.816  -1.703  -4.435
   94    HB3  ASN  11           HB1      ASN  11 -11.461  -2.757  -5.785
   95   HD21  ASN  11          HD21      ASN  11 -12.016  -1.297  -7.316
   96   HD22  ASN  11          HD22      ASN  11 -13.645  -0.784  -7.590
   97    H    GLY  12           HN       GLY  12 -12.175  -5.911  -3.293
   98    HA2  GLY  12           HA2      GLY  12  -9.559  -5.190  -2.231
   99    HA3  GLY  12           HA1      GLY  12 -10.786  -5.692  -1.064
  100    H    LYS  13           HN       LYS  13  -8.197  -6.899  -2.343
  101    HA   LYS  13           HA       LYS  13  -8.893  -9.229  -3.693
  102    HB2  LYS  13           HB2      LYS  13  -6.606  -8.838  -1.750
  103    HB3  LYS  13           HB1      LYS  13  -6.727 -10.130  -2.940
  104    HG2  LYS  13           HG2      LYS  13  -6.749  -8.402  -4.726
  105    HG3  LYS  13           HG1      LYS  13  -6.474  -7.179  -3.486
  106    HD2  LYS  13           HD2      LYS  13  -4.654  -9.499  -4.125
  107    HD3  LYS  13           HD1      LYS  13  -4.387  -7.814  -4.581
  108    HE2  LYS  13           HE2      LYS  13  -4.231  -7.172  -2.256
  109    HE3  LYS  13           HE1      LYS  13  -4.629  -8.811  -1.747
  110    HZ1  LYS  13           HZ1      LYS  13  -2.587  -9.555  -2.901
  111    HZ2  LYS  13           HZ2      LYS  13  -2.287  -8.533  -1.588
  112    HZ3  LYS  13           HZ3      LYS  13  -2.176  -7.928  -3.169
  113    H    THR  14           HN       THR  14  -9.397  -8.421  -0.386
  114    HA   THR  14           HA       THR  14  -9.521 -11.121   0.628
  115    HB   THR  14           HB       THR  14 -10.769  -8.702   1.929
  116    HG1  THR  14           HG1      THR  14  -8.792  -7.860   1.581
  117   HG21  THR  14          HG21      THR  14 -11.097 -10.839   3.041
  118   HG22  THR  14          HG22      THR  14 -10.005  -9.836   3.993
  119   HG23  THR  14          HG23      THR  14  -9.364 -11.153   3.010
  120    H    LEU  15           HN       LEU  15 -11.748  -8.840  -0.840
  121    HA   LEU  15           HA       LEU  15 -13.813 -10.802  -1.024
  122    HB2  LEU  15           HB2      LEU  15 -13.849  -9.304   1.292
  123    HB3  LEU  15           HB1      LEU  15 -14.923  -8.410   0.246
  124    HG   LEU  15           HG       LEU  15 -16.325  -9.834   1.444
  125   HD11  LEU  15          HD11      LEU  15 -15.706 -11.280  -1.117
  126   HD12  LEU  15          HD12      LEU  15 -16.797  -9.910  -0.933
  127   HD13  LEU  15          HD13      LEU  15 -17.180 -11.450  -0.165
  128   HD21  LEU  15          HD21      LEU  15 -14.716 -11.224   2.507
  129   HD22  LEU  15          HD22      LEU  15 -14.268 -11.976   0.979
  130   HD23  LEU  15          HD23      LEU  15 -15.863 -12.276   1.674
  131    H    LYS  16           HN       LYS  16 -13.815 -10.429  -3.225
  132    HA   LYS  16           HA       LYS  16 -14.500  -7.712  -4.073
  133    HB2  LYS  16           HB2      LYS  16 -13.304 -10.044  -5.532
  134    HB3  LYS  16           HB1      LYS  16 -14.146  -8.790  -6.431
  135    HG2  LYS  16           HG2      LYS  16 -11.736  -8.404  -4.656
  136    HG3  LYS  16           HG1      LYS  16 -11.783  -8.301  -6.402
  137    HD2  LYS  16           HD2      LYS  16 -13.073  -6.453  -4.466
  138    HD3  LYS  16           HD1      LYS  16 -11.741  -6.138  -5.578
  139    HE2  LYS  16           HE2      LYS  16 -14.526  -6.868  -6.448
  140    HE3  LYS  16           HE1      LYS  16 -13.919  -5.218  -6.362
  141    HZ1  LYS  16           HZ1      LYS  16 -12.753  -7.372  -8.046
  142    HZ2  LYS  16           HZ2      LYS  16 -12.253  -5.750  -7.998
  143    HZ3  LYS  16           HZ3      LYS  16 -13.791  -6.150  -8.597
  144    H    GLY  17           HN       GLY  17 -16.493  -7.238  -4.524
  145    HA2  GLY  17           HA2      GLY  17 -18.334  -8.778  -5.904
  146    HA3  GLY  17           HA1      GLY  17 -18.608  -9.068  -4.189
  147    H    GLU  18           HN       GLU  18 -20.642  -7.965  -5.505
  148    HA   GLU  18           HA       GLU  18 -20.592  -5.192  -4.550
  149    HB2  GLU  18           HB2      GLU  18 -22.001  -6.049  -7.090
  150    HB3  GLU  18           HB1      GLU  18 -21.868  -4.419  -6.451
  151    HG2  GLU  18           HG2      GLU  18 -20.293  -4.352  -8.092
  152    HG3  GLU  18           HG1      GLU  18 -19.305  -4.842  -6.720
  153    H    THR  19           HN       THR  19 -22.775  -4.325  -4.143
  154    HA   THR  19           HA       THR  19 -24.958  -6.169  -3.886
  155    HB   THR  19           HB       THR  19 -23.552  -6.757  -1.901
  156    HG1  THR  19           HG1      THR  19 -25.331  -7.036  -0.740
  157   HG21  THR  19          HG21      THR  19 -23.501  -5.119  -0.009
  158   HG22  THR  19          HG22      THR  19 -24.167  -3.896  -1.093
  159   HG23  THR  19          HG23      THR  19 -22.570  -4.576  -1.409
  160    H    THR  20           HN       THR  20 -26.768  -5.014  -2.530
  161    HA   THR  20           HA       THR  20 -26.731  -2.118  -3.022
  162    HB   THR  20           HB       THR  20 -29.162  -2.355  -3.787
  163    HG1  THR  20           HG1      THR  20 -28.308  -5.070  -3.990
  164   HG21  THR  20          HG21      THR  20 -27.419  -1.802  -5.404
  165   HG22  THR  20          HG22      THR  20 -28.547  -2.954  -6.121
  166   HG23  THR  20          HG23      THR  20 -26.979  -3.508  -5.539
  167    H    THR  21           HN       THR  21 -28.489  -0.988  -1.811
  168    HA   THR  21           HA       THR  21 -29.819  -2.469   0.285
  169    HB   THR  21           HB       THR  21 -27.470  -1.961   1.203
  170    HG1  THR  21           HG1      THR  21 -29.233  -0.673   2.905
  171   HG21  THR  21          HG21      THR  21 -27.185   0.342   0.381
  172   HG22  THR  21          HG22      THR  21 -27.234   0.370   2.148
  173   HG23  THR  21          HG23      THR  21 -28.653   0.846   1.219
  174    H    GLU  22           HN       GLU  22 -31.383  -1.172   1.425
  175    HA   GLU  22           HA       GLU  22 -32.293   1.124  -0.162
  176    HB2  GLU  22           HB2      GLU  22 -33.697  -0.346   2.090
  177    HB3  GLU  22           HB1      GLU  22 -34.415   0.852   1.031
  178    HG2  GLU  22           HG2      GLU  22 -34.393  -0.624  -0.832
  179    HG3  GLU  22           HG1      GLU  22 -33.330  -1.793   0.041
  180    H    ALA  23           HN       ALA  23 -31.781   3.116   0.527
  181    HA   ALA  23           HA       ALA  23 -31.757   3.617   3.439
  182    HB1  ALA  23           HB1      ALA  23 -29.738   5.007   3.238
  183    HB2  ALA  23           HB2      ALA  23 -29.600   4.584   1.533
  184    HB3  ALA  23           HB3      ALA  23 -29.403   3.340   2.769
  185    H    VAL  24           HN       VAL  24 -32.282   5.857   3.964
  186    HA   VAL  24           HA       VAL  24 -33.610   7.232   1.734
  187    HB   VAL  24           HB       VAL  24 -34.876   8.455   3.544
  188   HG11  VAL  24          HG11      VAL  24 -35.866   6.608   2.294
  189   HG12  VAL  24          HG12      VAL  24 -36.404   6.575   3.972
  190   HG13  VAL  24          HG13      VAL  24 -35.162   5.448   3.418
  191   HG21  VAL  24          HG21      VAL  24 -33.334   8.035   5.394
  192   HG22  VAL  24          HG22      VAL  24 -33.677   6.308   5.293
  193   HG23  VAL  24          HG23      VAL  24 -34.951   7.434   5.762
  194    H    ASP  25           HN       ASP  25 -30.726   7.351   2.977
  195    HA   ASP  25           HA       ASP  25 -30.338  10.148   2.499
  196    HB2  ASP  25           HB2      ASP  25 -30.996  10.211   4.869
  197    HB3  ASP  25           HB1      ASP  25 -29.755   9.025   5.243
  198    H    ALA  26           HN       ALA  26 -28.026  10.670   2.476
  199    HA   ALA  26           HA       ALA  26 -26.575   8.527   1.234
  200    HB1  ALA  26           HB1      ALA  26 -24.851  10.201   0.823
  201    HB2  ALA  26           HB2      ALA  26 -25.664  11.327   1.909
  202    HB3  ALA  26           HB3      ALA  26 -26.443  10.839   0.404
  203    H    ALA  27           HN       ALA  27 -26.136  10.439   4.206
  204    HA   ALA  27           HA       ALA  27 -23.693   9.156   4.950
  205    HB1  ALA  27           HB1      ALA  27 -24.295  11.399   5.773
  206    HB2  ALA  27           HB2      ALA  27 -23.961  10.277   7.092
  207    HB3  ALA  27           HB3      ALA  27 -25.627  10.691   6.690
  208    H    THR  28           HN       THR  28 -27.051   8.509   5.339
  209    HA   THR  28           HA       THR  28 -26.819   6.602   7.447
  210    HB   THR  28           HB       THR  28 -29.069   6.753   5.423
  211    HG1  THR  28           HG1      THR  28 -28.718   8.809   6.398
  212   HG21  THR  28          HG21      THR  28 -30.408   5.874   7.318
  213   HG22  THR  28          HG22      THR  28 -28.938   5.780   8.290
  214   HG23  THR  28          HG23      THR  28 -29.112   4.766   6.859
  215    H    ALA  29           HN       ALA  29 -26.395   6.481   3.999
  216    HA   ALA  29           HA       ALA  29 -26.723   3.624   3.759
  217    HB1  ALA  29           HB1      ALA  29 -25.464   5.621   1.872
  218    HB2  ALA  29           HB2      ALA  29 -27.138   5.061   1.828
  219    HB3  ALA  29           HB3      ALA  29 -25.823   3.934   1.497
  220    H    GLU  30           HN       GLU  30 -24.133   5.945   4.133
  221    HA   GLU  30           HA       GLU  30 -21.913   4.277   3.907
  222    HB2  GLU  30           HB2      GLU  30 -22.060   6.865   4.196
  223    HB3  GLU  30           HB1      GLU  30 -22.103   6.507   5.912
  224    HG2  GLU  30           HG2      GLU  30 -19.962   5.103   5.391
  225    HG3  GLU  30           HG1      GLU  30 -19.877   6.165   3.984
  226    H    LYS  31           HN       LYS  31 -23.528   5.379   6.880
  227    HA   LYS  31           HA       LYS  31 -22.228   3.898   8.759
  228    HB2  LYS  31           HB2      LYS  31 -25.181   4.535   8.764
  229    HB3  LYS  31           HB1      LYS  31 -24.229   4.089  10.168
  230    HG2  LYS  31           HG2      LYS  31 -23.697   6.539   8.505
  231    HG3  LYS  31           HG1      LYS  31 -24.721   6.528   9.938
  232    HD2  LYS  31           HD2      LYS  31 -22.656   7.258  10.732
  233    HD3  LYS  31           HD1      LYS  31 -22.683   5.545  11.146
  234    HE2  LYS  31           HE2      LYS  31 -21.314   5.037   9.206
  235    HE3  LYS  31           HE1      LYS  31 -21.333   6.736   8.730
  236    HZ1  LYS  31           HZ1      LYS  31 -20.156   7.294  10.751
  237    HZ2  LYS  31           HZ2      LYS  31 -19.287   6.127   9.886
  238    HZ3  LYS  31           HZ3      LYS  31 -20.182   5.674  11.253
  239    H    VAL  32           HN       VAL  32 -24.956   2.784   6.768
  240    HA   VAL  32           HA       VAL  32 -25.242   0.299   8.155
  241    HB   VAL  32           HB       VAL  32 -26.272   1.145   5.442
  242   HG11  VAL  32          HG11      VAL  32 -27.036  -1.241   7.135
  243   HG12  VAL  32          HG12      VAL  32 -26.160  -1.289   5.606
  244   HG13  VAL  32          HG13      VAL  32 -27.837  -0.743   5.644
  245   HG21  VAL  32          HG21      VAL  32 -27.619   1.049   8.141
  246   HG22  VAL  32          HG22      VAL  32 -28.406   1.450   6.614
  247   HG23  VAL  32          HG23      VAL  32 -27.147   2.502   7.258
  248    H    PHE  33           HN       PHE  33 -23.899   1.177   4.969
  249    HA   PHE  33           HA       PHE  33 -23.046  -1.470   4.355
  250    HB2  PHE  33           HB2      PHE  33 -22.576   1.217   3.164
  251    HB3  PHE  33           HB1      PHE  33 -21.413  -0.034   2.793
  252    HD1  PHE  33           HD1      PHE  33 -23.394  -2.351   2.798
  253    HD2  PHE  33           HD2      PHE  33 -23.485   1.514   1.025
  254    HE1  PHE  33           HE1      PHE  33 -24.858  -3.208   1.022
  255    HE2  PHE  33           HE2      PHE  33 -24.962   0.665  -0.753
  256    HZ   PHE  33           HZ       PHE  33 -25.649  -1.695  -0.758
  257    H    LYS  34           HN       LYS  34 -21.594   1.075   6.246
  258    HA   LYS  34           HA       LYS  34 -18.946   0.076   6.088
  259    HB2  LYS  34           HB2      LYS  34 -20.382   1.874   8.018
  260    HB3  LYS  34           HB1      LYS  34 -18.723   1.424   8.292
  261    HG2  LYS  34           HG2      LYS  34 -18.404   2.264   5.830
  262    HG3  LYS  34           HG1      LYS  34 -19.892   3.146   6.168
  263    HD2  LYS  34           HD2      LYS  34 -18.053   4.601   6.705
  264    HD3  LYS  34           HD1      LYS  34 -18.812   4.073   8.212
  265    HE2  LYS  34           HE2      LYS  34 -17.089   2.412   8.549
  266    HE3  LYS  34           HE1      LYS  34 -16.371   2.804   6.987
  267    HZ1  LYS  34           HZ1      LYS  34 -15.804   4.982   7.804
  268    HZ2  LYS  34           HZ2      LYS  34 -15.183   3.811   8.856
  269    HZ3  LYS  34           HZ3      LYS  34 -16.575   4.685   9.277
  270    H    GLN  35           HN       GLN  35 -21.646  -0.458   8.295
  271    HA   GLN  35           HA       GLN  35 -20.337  -2.275  10.019
  272    HB2  GLN  35           HB2      GLN  35 -22.472  -1.196  10.593
  273    HB3  GLN  35           HB1      GLN  35 -23.272  -2.045   9.281
  274    HG2  GLN  35           HG2      GLN  35 -23.857  -3.229  11.189
  275    HG3  GLN  35           HG1      GLN  35 -22.575  -4.184  10.452
  276   HE21  GLN  35          HE21      GLN  35 -23.517  -4.046  13.226
  277   HE22  GLN  35          HE22      GLN  35 -22.123  -3.663  14.174
  278    H    TYR  36           HN       TYR  36 -21.879  -2.514   6.920
  279    HA   TYR  36           HA       TYR  36 -22.034  -5.342   6.722
  280    HB2  TYR  36           HB2      TYR  36 -23.454  -4.109   5.281
  281    HB3  TYR  36           HB1      TYR  36 -22.157  -3.037   4.792
  282    HD1  TYR  36           HD1      TYR  36 -23.152  -6.639   4.528
  283    HD2  TYR  36           HD2      TYR  36 -21.163  -3.318   2.809
  284    HE1  TYR  36           HE1      TYR  36 -22.771  -7.940   2.478
  285    HE2  TYR  36           HE2      TYR  36 -20.774  -4.581   0.740
  286    HH   TYR  36           HH       TYR  36 -20.624  -6.931   0.039
  287    H    ALA  37           HN       ALA  37 -19.766  -2.944   5.392
  288    HA   ALA  37           HA       ALA  37 -17.978  -4.818   4.253
  289    HB1  ALA  37           HB1      ALA  37 -16.459  -2.917   4.036
  290    HB2  ALA  37           HB2      ALA  37 -17.455  -1.979   5.148
  291    HB3  ALA  37           HB3      ALA  37 -18.099  -2.453   3.574
  292    H    ASN  38           HN       ASN  38 -18.174  -3.240   7.381
  293    HA   ASN  38           HA       ASN  38 -15.664  -3.987   8.408
  294    HB2  ASN  38           HB2      ASN  38 -17.224  -2.267   9.442
  295    HB3  ASN  38           HB1      ASN  38 -18.245  -3.597   9.980
  296   HD21  ASN  38          HD21      ASN  38 -15.511  -1.661  10.714
  297   HD22  ASN  38          HD22      ASN  38 -14.980  -2.542  12.161
  298    H    ASP  39           HN       ASP  39 -18.777  -5.625   8.375
  299    HA   ASP  39           HA       ASP  39 -18.041  -7.786  10.041
  300    HB2  ASP  39           HB2      ASP  39 -20.366  -7.267   9.653
  301    HB3  ASP  39           HB1      ASP  39 -20.184  -7.544   7.924
  302    H    ASN  40           HN       ASN  40 -17.467  -7.106   6.693
  303    HA   ASN  40           HA       ASN  40 -16.753  -9.852   6.062
  304    HB2  ASN  40           HB2      ASN  40 -17.107  -7.343   4.467
  305    HB3  ASN  40           HB1      ASN  40 -16.111  -8.642   3.814
  306   HD21  ASN  40          HD21      ASN  40 -19.332  -7.607   4.616
  307   HD22  ASN  40          HD22      ASN  40 -20.159  -8.995   3.902
  308    H    GLY  41           HN       GLY  41 -15.298  -6.999   7.212
  309    HA2  GLY  41           HA2      GLY  41 -13.102  -6.874   8.035
  310    HA3  GLY  41           HA1      GLY  41 -12.675  -8.262   7.047
  311    H    VAL  42           HN       VAL  42 -14.412  -5.937   5.280
  312    HA   VAL  42           HA       VAL  42 -11.952  -5.172   3.937
  313    HB   VAL  42           HB       VAL  42 -14.822  -4.740   3.060
  314   HG11  VAL  42          HG11      VAL  42 -12.180  -4.378   1.632
  315   HG12  VAL  42          HG12      VAL  42 -13.337  -3.118   2.051
  316   HG13  VAL  42          HG13      VAL  42 -13.757  -4.331   0.841
  317   HG21  VAL  42          HG21      VAL  42 -14.290  -6.588   1.464
  318   HG22  VAL  42          HG22      VAL  42 -14.361  -7.078   3.161
  319   HG23  VAL  42          HG23      VAL  42 -12.797  -6.858   2.367
  320    H    ASP  43           HN       ASP  43 -11.065  -3.343   4.453
  321    HA   ASP  43           HA       ASP  43 -12.743  -1.009   4.962
  322    HB2  ASP  43           HB2      ASP  43 -12.060  -1.961   7.201
  323    HB3  ASP  43           HB1      ASP  43 -10.383  -1.697   6.740
  324    H    GLY  44           HN       GLY  44 -11.867   0.881   4.099
  325    HA2  GLY  44           HA2      GLY  44  -9.213   1.292   3.379
  326    HA3  GLY  44           HA1      GLY  44 -10.010   0.531   2.004
  327    H    GLU  45           HN       GLU  45  -9.331   2.693   1.094
  328    HA   GLU  45           HA       GLU  45 -10.477   5.117   1.840
  329    HB2  GLU  45           HB2      GLU  45  -9.957   5.899  -0.378
  330    HB3  GLU  45           HB1      GLU  45  -8.681   4.805   0.122
  331    HG2  GLU  45           HG2      GLU  45  -9.557   3.053  -1.250
  332    HG3  GLU  45           HG1      GLU  45 -10.959   4.032  -1.677
  333    H    TRP  46           HN       TRP  46 -12.380   6.161   1.342
  334    HA   TRP  46           HA       TRP  46 -14.459   4.479   0.109
  335    HB2  TRP  46           HB2      TRP  46 -14.578   6.278   2.491
  336    HB3  TRP  46           HB1      TRP  46 -15.985   6.239   1.445
  337    HD1  TRP  46           HD1      TRP  46 -13.677   3.596   3.111
  338    HE1  TRP  46           HE1      TRP  46 -15.141   1.700   4.029
  339    HE3  TRP  46           HE3      TRP  46 -18.333   5.295   1.642
  340    HZ2  TRP  46           HZ2      TRP  46 -17.855   1.009   4.135
  341    HZ3  TRP  46           HZ3      TRP  46 -20.291   3.928   2.215
  342    HH2  TRP  46           HH2      TRP  46 -20.056   1.827   3.434
  343    H    THR  47           HN       THR  47 -15.182   5.154  -1.743
  344    HA   THR  47           HA       THR  47 -15.036   8.015  -2.402
  345    HB   THR  47           HB       THR  47 -14.837   7.136  -4.844
  346    HG1  THR  47           HG1      THR  47 -13.314   5.052  -4.236
  347   HG21  THR  47          HG21      THR  47 -12.496   6.891  -2.952
  348   HG22  THR  47          HG22      THR  47 -13.078   8.390  -3.676
  349   HG23  THR  47          HG23      THR  47 -12.400   7.123  -4.698
  350    H    TYR  48           HN       TYR  48 -16.649   8.702  -4.018
  351    HA   TYR  48           HA       TYR  48 -18.938   6.965  -4.336
  352    HB2  TYR  48           HB2      TYR  48 -19.496   7.825  -2.173
  353    HB3  TYR  48           HB1      TYR  48 -19.111   9.467  -2.626
  354    HD1  TYR  48           HD1      TYR  48 -20.756  10.860  -3.620
  355    HD2  TYR  48           HD2      TYR  48 -21.586   6.698  -3.160
  356    HE1  TYR  48           HE1      TYR  48 -23.105  11.258  -4.212
  357    HE2  TYR  48           HE2      TYR  48 -23.926   7.101  -3.755
  358    HH   TYR  48           HH       TYR  48 -25.541   8.882  -3.793
  359    H    ASP  49           HN       ASP  49 -20.477   7.746  -5.846
  360    HA   ASP  49           HA       ASP  49 -19.635  10.137  -7.358
  361    HB2  ASP  49           HB2      ASP  49 -18.701   8.362  -8.748
  362    HB3  ASP  49           HB1      ASP  49 -20.203   7.459  -8.727
  363    H    ASP  50           HN       ASP  50 -21.350  11.344  -8.170
  364    HA   ASP  50           HA       ASP  50 -23.849  10.830  -6.748
  365    HB2  ASP  50           HB2      ASP  50 -22.976  13.133  -6.779
  366    HB3  ASP  50           HB1      ASP  50 -22.969  13.126  -8.541
  367    H    ALA  51           HN       ALA  51 -22.652  10.589  -9.998
  368    HA   ALA  51           HA       ALA  51 -25.215  10.575 -11.253
  369    HB1  ALA  51           HB1      ALA  51 -24.019   9.939 -13.264
  370    HB2  ALA  51           HB2      ALA  51 -22.569   9.601 -12.318
  371    HB3  ALA  51           HB3      ALA  51 -23.182  11.251 -12.434
  372    H    THR  52           HN       THR  52 -23.072   8.066 -10.000
  373    HA   THR  52           HA       THR  52 -24.914   6.032 -11.024
  374    HB   THR  52           HB       THR  52 -23.088   4.433 -10.317
  375    HG1  THR  52           HG1      THR  52 -21.470   6.773 -10.219
  376   HG21  THR  52          HG21      THR  52 -21.653   4.978 -12.249
  377   HG22  THR  52          HG22      THR  52 -22.412   6.567 -12.351
  378   HG23  THR  52          HG23      THR  52 -23.367   5.114 -12.649
  379    H    LYS  53           HN       LYS  53 -24.299   7.655  -8.119
  380    HA   LYS  53           HA       LYS  53 -24.884   7.310  -5.905
  381    HB2  LYS  53           HB2      LYS  53 -26.859   5.449  -7.233
  382    HB3  LYS  53           HB1      LYS  53 -26.826   5.702  -5.502
  383    HG2  LYS  53           HG2      LYS  53 -28.528   7.062  -6.428
  384    HG3  LYS  53           HG1      LYS  53 -27.205   8.124  -5.939
  385    HD2  LYS  53           HD2      LYS  53 -28.102   8.746  -8.106
  386    HD3  LYS  53           HD1      LYS  53 -26.433   8.232  -8.252
  387    HE2  LYS  53           HE2      LYS  53 -27.624   7.281 -10.074
  388    HE3  LYS  53           HE1      LYS  53 -27.302   5.979  -8.936
  389    HZ1  LYS  53           HZ1      LYS  53 -29.576   6.210  -8.112
  390    HZ2  LYS  53           HZ2      LYS  53 -29.542   5.853  -9.770
  391    HZ3  LYS  53           HZ3      LYS  53 -29.874   7.434  -9.251
  392    H    THR  54           HN       THR  54 -22.729   5.805  -7.050
  393    HA   THR  54           HA       THR  54 -22.882   3.200  -5.760
  394    HB   THR  54           HB       THR  54 -20.637   4.223  -7.498
  395    HG1  THR  54           HG1      THR  54 -22.163   4.191  -8.991
  396   HG21  THR  54          HG21      THR  54 -20.186   1.827  -7.830
  397   HG22  THR  54          HG22      THR  54 -21.574   1.411  -6.823
  398   HG23  THR  54          HG23      THR  54 -20.177   2.218  -6.107
  399    H    TYR  55           HN       TYR  55 -22.026   2.948  -3.818
  400    HA   TYR  55           HA       TYR  55 -19.893   4.723  -2.855
  401    HB2  TYR  55           HB2      TYR  55 -21.666   2.688  -1.446
  402    HB3  TYR  55           HB1      TYR  55 -20.168   3.254  -0.715
  403    HD1  TYR  55           HD1      TYR  55 -23.532   4.355  -1.840
  404    HD2  TYR  55           HD2      TYR  55 -19.984   5.360   0.275
  405    HE1  TYR  55           HE1      TYR  55 -24.644   6.340  -0.928
  406    HE2  TYR  55           HE2      TYR  55 -21.086   7.357   1.187
  407    HH   TYR  55           HH       TYR  55 -22.942   8.825   0.667
  408    H    THR  56           HN       THR  56 -17.790   4.014  -2.738
  409    HA   THR  56           HA       THR  56 -17.345   1.147  -3.254
  410    HB   THR  56           HB       THR  56 -15.845   3.417  -4.569
  411    HG1  THR  56           HG1      THR  56 -18.090   2.046  -5.245
  412   HG21  THR  56          HG21      THR  56 -15.558   0.428  -4.916
  413   HG22  THR  56          HG22      THR  56 -14.402   1.473  -4.089
  414   HG23  THR  56          HG23      THR  56 -14.687   1.663  -5.821
  415    H    VAL  57           HN       VAL  57 -15.895   0.177  -2.019
  416    HA   VAL  57           HA       VAL  57 -14.097   1.862  -0.406
  417    HB   VAL  57           HB       VAL  57 -15.765   0.743   1.078
  418   HG11  VAL  57          HG11      VAL  57 -14.619  -1.815  -0.023
  419   HG12  VAL  57          HG12      VAL  57 -16.301  -1.277  -0.073
  420   HG13  VAL  57          HG13      VAL  57 -15.558  -1.713   1.461
  421   HG21  VAL  57          HG21      VAL  57 -14.167  -0.247   2.643
  422   HG22  VAL  57          HG22      VAL  57 -13.580   1.265   1.949
  423   HG23  VAL  57          HG23      VAL  57 -12.948  -0.275   1.367
  424    H    THR  58           HN       THR  58 -12.001   1.542  -0.767
  425    HA   THR  58           HA       THR  58 -11.287  -0.784  -2.449
  426    HB   THR  58           HB       THR  58  -9.892   1.895  -2.505
  427    HG1  THR  58           HG1      THR  58 -12.364   1.255  -3.423
  428   HG21  THR  58          HG21      THR  58 -10.050  -0.391  -4.488
  429   HG22  THR  58          HG22      THR  58  -8.672  -0.012  -3.456
  430   HG23  THR  58          HG23      THR  58  -9.161   1.114  -4.721
  431    H    GLU  59           HN       GLU  59  -9.802  -2.128  -1.648
  432    HA   GLU  59           HA       GLU  59  -8.224  -1.438   0.682
  433    HB2  GLU  59           HB2      GLU  59  -8.007  -3.855  -1.145
  434    HB3  GLU  59           HB1      GLU  59  -7.084  -3.635   0.310
  435    HG2  GLU  59           HG2      GLU  59  -9.326  -3.575   1.541
  436    HG3  GLU  59           HG1      GLU  59 -10.010  -4.206   0.045
  437    H    GLY  60           HN       GLY  60  -6.736   0.221   0.215
  438    HA2  GLY  60           HA2      GLY  60  -5.636   0.668  -2.356
  439    HA3  GLY  60           HA1      GLY  60  -5.022   1.330  -0.842
  440    H    SER  61           HN       SER  61  -4.413  -0.702  -3.416
  441    HA   SER  61           HA       SER  61  -2.703  -2.611  -2.268
  442    HB2  SER  61           HB2      SER  61  -2.597  -1.438  -5.060
  443    HB3  SER  61           HB1      SER  61  -1.869  -2.957  -4.543
  444    HG   SER  61           HG       SER  61  -3.845  -3.402  -5.513
  445    H    GLY  62           HN       GLY  62  -1.242  -1.817  -0.861
  446    HA2  GLY  62           HA2      GLY  62   0.689   0.174  -1.871
  447    HA3  GLY  62           HA1      GLY  62   0.298  -0.063  -0.173
  448    H    GLY  63           HN       GLY  63   1.459  -1.934  -2.952
  449    HA2  GLY  63           HA2      GLY  63   2.969  -3.673  -1.178
  450    HA3  GLY  63           HA1      GLY  63   2.820  -3.826  -2.921
  451    H    ALA  64           HN       ALA  64   3.694  -0.850  -1.355
  452    HA   ALA  64           HA       ALA  64   5.534   0.466  -1.399
  453    HB1  ALA  64           HB1      ALA  64   6.488  -1.339  -0.064
  454    HB2  ALA  64           HB2      ALA  64   7.706  -0.580  -1.089
  455    HB3  ALA  64           HB3      ALA  64   7.028  -2.144  -1.537
  456    H    GLY  65           HN       GLY  65   4.316  -0.587  -3.990
  457    HA2  GLY  65           HA2      GLY  65   6.196   0.744  -5.714
  458    HA3  GLY  65           HA1      GLY  65   6.078  -0.982  -6.022
  459    H    GLY  66           HN       GLY  66   5.443   1.020  -7.878
  460    HA2  GLY  66           HA2      GLY  66   2.530   1.170  -7.969
  461    HA3  GLY  66           HA1      GLY  66   3.653   1.977  -9.053
  462    H    GLN  67           HN       GLN  67   3.697  -1.424  -8.218
  463    HA   GLN  67           HA       GLN  67   3.983  -2.319 -10.853
  464    HB2  GLN  67           HB2      GLN  67   3.004  -3.799  -8.390
  465    HB3  GLN  67           HB1      GLN  67   3.445  -4.577  -9.932
  466    HG2  GLN  67           HG2      GLN  67   5.284  -2.990  -8.134
  467    HG3  GLN  67           HG1      GLN  67   5.252  -4.743  -8.328
  468   HE21  GLN  67          HE21      GLN  67   7.423  -2.818  -8.811
  469   HE22  GLN  67          HE22      GLN  67   7.886  -3.039 -10.470
  470    H    GLY  68           HN       GLY  68   2.476  -1.723 -12.309
  471    HA2  GLY  68           HA2      GLY  68   0.339  -3.137 -13.031
  472    HA3  GLY  68           HA1      GLY  68  -0.346  -2.139 -11.754
  473    H    MET  69           HN       MET  69  -0.941  -2.156 -14.665
  474    HA   MET  69           HA       MET  69  -1.262  -0.703 -16.396
  475    HB2  MET  69           HB2      MET  69  -1.092   1.321 -14.148
  476    HB3  MET  69           HB1      MET  69  -1.726   1.647 -15.755
  477    HG2  MET  69           HG2      MET  69  -3.502   0.007 -15.382
  478    HG3  MET  69           HG1      MET  69  -2.874  -0.300 -13.765
  479    HE1  MET  69           HE1      MET  69  -5.261   0.165 -12.733
  480    HE2  MET  69           HE2      MET  69  -5.894   0.462 -14.350
  481    HE3  MET  69           HE3      MET  69  -6.202   1.619 -13.058
  482    H    ILE  70           HN       ILE  70   1.238  -1.502 -16.535
  483    HA   ILE  70           HA       ILE  70   2.973   0.877 -16.538
  484    HB   ILE  70           HB       ILE  70   3.919  -2.015 -16.670
  485   HG12  ILE  70          HG12      ILE  70   3.952  -0.117 -14.312
  486   HG13  ILE  70          HG11      ILE  70   2.838  -1.468 -14.501
  487   HG21  ILE  70          HG21      ILE  70   5.521   0.497 -16.106
  488   HG22  ILE  70          HG22      ILE  70   5.443  -0.302 -17.678
  489   HG23  ILE  70          HG23      ILE  70   6.139  -1.145 -16.291
  490   HD11  ILE  70          HD11      ILE  70   5.836  -1.672 -14.274
  491   HD12  ILE  70          HD12      ILE  70   4.719  -3.025 -14.456
  492   HD13  ILE  70          HD13      ILE  70   4.668  -2.029 -13.001
  493    H    GLN  71           HN       GLN  71   1.684   1.370 -18.470
  494    HA   GLN  71           HA       GLN  71   2.923   0.149 -20.840
  495    HB2  GLN  71           HB2      GLN  71   0.050   0.961 -20.429
  496    HB3  GLN  71           HB1      GLN  71   0.740   0.618 -22.001
  497    HG2  GLN  71           HG2      GLN  71   1.237  -1.650 -21.321
  498    HG3  GLN  71           HG1      GLN  71   0.598  -1.316 -19.713
  499   HE21  GLN  71          HE21      GLN  71  -0.197  -1.808 -23.063
  500   HE22  GLN  71          HE22      GLN  71  -1.892  -2.049 -22.829
  501    H    GLU  72           HN       GLU  72   3.287   2.651 -19.121
  502    HA   GLU  72           HA       GLU  72   2.890   4.698 -21.187
  503    HB2  GLU  72           HB2      GLU  72   3.425   4.950 -18.223
  504    HB3  GLU  72           HB1      GLU  72   3.335   6.318 -19.328
  505    HG2  GLU  72           HG2      GLU  72   1.021   5.749 -19.841
  506    HG3  GLU  72           HG1      GLU  72   1.120   4.365 -18.751
  507    HA   PRO  73           HA       PRO  73   7.234   4.407 -22.008
  508    HB2  PRO  73           HB2      PRO  73   7.557   6.644 -23.495
  509    HB3  PRO  73           HB1      PRO  73   6.666   5.204 -24.119
  510    HG2  PRO  73           HG2      PRO  73   5.576   7.724 -22.876
  511    HG3  PRO  73           HG1      PRO  73   5.047   6.893 -24.352
  512    HD2  PRO  73           HD2      PRO  73   3.764   6.600 -21.991
  513    HD3  PRO  73           HD1      PRO  73   3.897   5.257 -23.175
  514    H    ALA  74           HN       ALA  74   9.199   5.704 -21.845
  515    HA   ALA  74           HA       ALA  74   9.339   8.141 -20.462
  516    HB1  ALA  74           HB1      ALA  74   8.620   6.806 -18.523
  517    HB2  ALA  74           HB2      ALA  74  10.269   7.397 -18.319
  518    HB3  ALA  74           HB3      ALA  74   9.984   5.716 -18.771
  519    H    LEU  75           HN       LEU  75  11.710   8.527 -19.723
  520    HA   LEU  75           HA       LEU  75  13.384   7.690 -21.901
  521    HB2  LEU  75           HB2      LEU  75  13.809   9.467 -19.518
  522    HB3  LEU  75           HB1      LEU  75  15.148   9.013 -20.540
  523    HG   LEU  75           HG       LEU  75  14.409  11.185 -21.206
  524   HD11  LEU  75          HD11      LEU  75  13.440   9.129 -23.177
  525   HD12  LEU  75          HD12      LEU  75  15.088   9.736 -23.018
  526   HD13  LEU  75          HD13      LEU  75  13.797  10.816 -23.545
  527   HD21  LEU  75          HD21      LEU  75  12.157  11.141 -20.282
  528   HD22  LEU  75          HD22      LEU  75  11.655  10.003 -21.532
  529   HD23  LEU  75          HD23      LEU  75  12.131  11.643 -21.973
  530    HA   PRO  76           HA       PRO  76  15.252   4.222 -19.825
  531    HB2  PRO  76           HB2      PRO  76  17.777   4.755 -21.261
  532    HB3  PRO  76           HB1      PRO  76  16.703   3.363 -21.438
  533    HG2  PRO  76           HG2      PRO  76  16.926   5.182 -23.391
  534    HG3  PRO  76           HG1      PRO  76  15.332   4.449 -22.972
  535    HD2  PRO  76           HD2      PRO  76  16.441   7.151 -22.097
  536    HD3  PRO  76           HD1      PRO  76  14.855   6.762 -22.801
  537    HA   PRO  77           HA       PRO  77  17.533   5.714 -16.295
  538    HB2  PRO  77           HB2      PRO  77  19.051   3.164 -16.807
  539    HB3  PRO  77           HB1      PRO  77  18.487   3.824 -15.264
  540    HG2  PRO  77           HG2      PRO  77  17.069   1.918 -16.358
  541    HG3  PRO  77           HG1      PRO  77  16.240   3.375 -15.765
  542    HD2  PRO  77           HD2      PRO  77  16.905   2.617 -18.610
  543    HD3  PRO  77           HD1      PRO  77  15.413   3.375 -17.935
  544    H    GLY  78           HN       GLY  78  19.051   7.204 -16.295
  545    HA2  GLY  78           HA2      GLY  78  21.260   7.999 -16.602
  546    HA3  GLY  78           HA1      GLY  78  21.500   6.804 -17.869
  547    H    TRP  79           HN       TRP  79  18.922   7.534 -19.194
  548    HA   TRP  79           HA       TRP  79  19.934   9.923 -20.606
  549    HB2  TRP  79           HB2      TRP  79  17.683   7.977 -21.255
  550    HB3  TRP  79           HB1      TRP  79  18.097   9.360 -22.247
  551    HD1  TRP  79           HD1      TRP  79  19.479   5.924 -21.182
  552    HE1  TRP  79           HE1      TRP  79  21.183   5.159 -22.947
  553    HE3  TRP  79           HE3      TRP  79  19.649  10.166 -24.067
  554    HZ2  TRP  79           HZ2      TRP  79  22.419   6.203 -25.259
  555    HZ3  TRP  79           HZ3      TRP  79  21.113  10.179 -26.035
  556    HH2  TRP  79           HH2      TRP  79  22.468   8.243 -26.620
  557    H    GLU  80           HN       GLU  80  18.716  11.872 -20.684
  558    HA   GLU  80           HA       GLU  80  16.051  11.806 -19.498
  559    HB2  GLU  80           HB2      GLU  80  18.054  12.645 -17.915
  560    HB3  GLU  80           HB1      GLU  80  17.711  14.151 -18.759
  561    HG2  GLU  80           HG2      GLU  80  15.258  13.686 -18.152
  562    HG3  GLU  80           HG1      GLU  80  15.918  12.549 -16.980
  563    H    MET  81           HN       MET  81  14.811  13.744 -19.987
  564    HA   MET  81           HA       MET  81  15.668  14.981 -22.512
  565    HB2  MET  81           HB2      MET  81  13.949  13.208 -22.833
  566    HB3  MET  81           HB1      MET  81  12.865  14.108 -21.747
  567    HG2  MET  81           HG2      MET  81  13.965  15.331 -24.262
  568    HG3  MET  81           HG1      MET  81  12.520  14.326 -24.269
  569    HE1  MET  81           HE1      MET  81  10.992  17.861 -24.692
  570    HE2  MET  81           HE2      MET  81  11.062  16.206 -25.303
  571    HE3  MET  81           HE3      MET  81  12.485  17.244 -25.393
  572    H    LYS  82           HN       LYS  82  15.430  17.181 -22.613
  573    HA   LYS  82           HA       LYS  82  13.756  18.575 -20.692
  574    HB2  LYS  82           HB2      LYS  82  16.738  19.127 -20.812
  575    HB3  LYS  82           HB1      LYS  82  15.574  20.085 -19.930
  576    HG2  LYS  82           HG2      LYS  82  15.139  18.193 -18.436
  577    HG3  LYS  82           HG1      LYS  82  16.332  17.216 -19.354
  578    HD2  LYS  82           HD2      LYS  82  18.069  18.868 -18.798
  579    HD3  LYS  82           HD1      LYS  82  16.895  19.803 -17.874
  580    HE2  LYS  82           HE2      LYS  82  17.779  16.977 -17.273
  581    HE3  LYS  82           HE1      LYS  82  18.304  18.427 -16.422
  582    HZ1  LYS  82           HZ1      LYS  82  16.631  17.519 -15.104
  583    HZ2  LYS  82           HZ2      LYS  82  15.636  17.156 -16.422
  584    HZ3  LYS  82           HZ3      LYS  82  15.840  18.773 -15.940
  585    H    TYR  83           HN       TYR  83  13.430  20.813 -21.273
  586    HA   TYR  83           HA       TYR  83  14.043  21.389 -24.104
  587    HB2  TYR  83           HB2      TYR  83  11.933  22.516 -22.214
  588    HB3  TYR  83           HB1      TYR  83  12.290  23.235 -23.804
  589    HD1  TYR  83           HD1      TYR  83  11.679  22.065 -25.846
  590    HD2  TYR  83           HD2      TYR  83  10.699  20.438 -22.034
  591    HE1  TYR  83           HE1      TYR  83  10.055  20.558 -26.912
  592    HE2  TYR  83           HE2      TYR  83   9.072  18.930 -23.099
  593    HH   TYR  83           HH       TYR  83   7.751  18.772 -25.133
  594    H    THR  84           HN       THR  84  15.063  23.326 -24.696
  595    HA   THR  84           HA       THR  84  16.641  24.622 -22.658
  596    HB   THR  84           HB       THR  84  17.634  25.945 -24.399
  597    HG1  THR  84           HG1      THR  84  16.701  25.982 -26.531
  598   HG21  THR  84          HG21      THR  84  17.001  23.215 -25.518
  599   HG22  THR  84          HG22      THR  84  18.346  23.630 -24.454
  600   HG23  THR  84          HG23      THR  84  18.282  24.285 -26.088
  601    H    SER  85           HN       SER  85  16.638  27.245 -22.951
  602    HA   SER  85           HA       SER  85  14.085  28.062 -21.931
  603    HB2  SER  85           HB2      SER  85  15.337  30.367 -22.010
  604    HB3  SER  85           HB1      SER  85  15.837  29.130 -20.855
  605    HG   SER  85           HG       SER  85  17.624  30.005 -21.986
  606    H    GLU  86           HN       GLU  86  14.655  27.310 -24.871
  607    HA   GLU  86           HA       GLU  86  13.319  29.635 -26.140
  608    HB2  GLU  86           HB2      GLU  86  15.729  29.345 -26.799
  609    HB3  GLU  86           HB1      GLU  86  15.333  27.737 -27.387
  610    HG2  GLU  86           HG2      GLU  86  13.873  28.670 -29.066
  611    HG3  GLU  86           HG1      GLU  86  14.163  30.299 -28.446
  612    H    GLY  87           HN       GLY  87  13.005  26.562 -25.069
  613    HA2  GLY  87           HA2      GLY  87  11.244  25.087 -25.359
  614    HA3  GLY  87           HA1      GLY  87  10.738  26.012 -26.763
  615    H    VAL  88           HN       VAL  88  14.028  24.930 -26.617
  616    HA   VAL  88           HA       VAL  88  13.463  23.119 -28.844
  617    HB   VAL  88           HB       VAL  88  16.107  24.221 -27.877
  618   HG11  VAL  88          HG11      VAL  88  15.450  22.573 -30.314
  619   HG12  VAL  88          HG12      VAL  88  16.435  22.073 -28.939
  620   HG13  VAL  88          HG13      VAL  88  17.001  23.357 -30.009
  621   HG21  VAL  88          HG21      VAL  88  16.007  25.532 -29.981
  622   HG22  VAL  88          HG22      VAL  88  14.753  25.963 -28.819
  623   HG23  VAL  88          HG23      VAL  88  14.357  24.958 -30.214
  624    H    ARG  89           HN       ARG  89  14.097  20.984 -28.880
  625    HA   ARG  89           HA       ARG  89  14.189  19.696 -26.276
  626    HB2  ARG  89           HB2      ARG  89  12.639  18.896 -27.980
  627    HB3  ARG  89           HB1      ARG  89  13.959  18.631 -29.100
  628    HG2  ARG  89           HG2      ARG  89  14.852  16.904 -27.543
  629    HG3  ARG  89           HG1      ARG  89  13.386  17.098 -26.577
  630    HD2  ARG  89           HD2      ARG  89  12.092  16.622 -28.701
  631    HD3  ARG  89           HD1      ARG  89  13.628  16.143 -29.417
  632    HE   ARG  89           HE       ARG  89  13.231  14.763 -26.992
  633   HH11  ARG  89          HH11      ARG  89  12.159  14.835 -30.319
  634   HH12  ARG  89          HH12      ARG  89  11.603  13.191 -30.313
  635   HH21  ARG  89          HH21      ARG  89  12.493  12.572 -26.989
  636   HH22  ARG  89          HH22      ARG  89  11.768  11.920 -28.423
  637    H    TYR  90           HN       TYR  90  16.039  19.025 -25.329
  638    HA   TYR  90           HA       TYR  90  18.159  18.058 -27.101
  639    HB2  TYR  90           HB2      TYR  90  19.919  19.054 -25.750
  640    HB3  TYR  90           HB1      TYR  90  18.843  20.294 -26.360
  641    HD1  TYR  90           HD1      TYR  90  17.144  21.299 -24.729
  642    HD2  TYR  90           HD2      TYR  90  20.404  18.881 -23.473
  643    HE1  TYR  90           HE1      TYR  90  16.991  22.270 -22.470
  644    HE2  TYR  90           HE2      TYR  90  20.252  19.837 -21.213
  645    HH   TYR  90           HH       TYR  90  19.411  21.914 -20.153
  646    H    PHE  91           HN       PHE  91  19.630  16.448 -26.033
  647    HA   PHE  91           HA       PHE  91  18.149  15.035 -23.922
  648    HB2  PHE  91           HB2      PHE  91  19.924  13.948 -26.111
  649    HB3  PHE  91           HB1      PHE  91  19.435  13.005 -24.721
  650    HD1  PHE  91           HD1      PHE  91  17.085  12.221 -24.460
  651    HD2  PHE  91           HD2      PHE  91  18.341  14.553 -27.820
  652    HE1  PHE  91           HE1      PHE  91  15.024  11.635 -25.650
  653    HE2  PHE  91           HE2      PHE  91  16.269  13.956 -28.998
  654    HZ   PHE  91           HZ       PHE  91  14.549  12.412 -27.750
  655    H    VAL  92           HN       VAL  92  19.198  14.291 -22.141
  656    HA   VAL  92           HA       VAL  92  21.938  15.321 -21.764
  657    HB   VAL  92           HB       VAL  92  19.862  14.859 -19.615
  658   HG11  VAL  92          HG11      VAL  92  21.389  16.177 -18.211
  659   HG12  VAL  92          HG12      VAL  92  22.540  16.242 -19.544
  660   HG13  VAL  92          HG13      VAL  92  22.141  14.693 -18.799
  661   HG21  VAL  92          HG21      VAL  92  20.704  17.444 -20.912
  662   HG22  VAL  92          HG22      VAL  92  19.661  17.302 -19.501
  663   HG23  VAL  92          HG23      VAL  92  19.130  16.669 -21.057
  664    H    ASP  93           HN       ASP  93  23.443  13.761 -21.559
  665    HA   ASP  93           HA       ASP  93  22.601  11.071 -20.724
  666    HB2  ASP  93           HB2      ASP  93  24.115  11.163 -22.640
  667    HB3  ASP  93           HB1      ASP  93  25.288  12.099 -21.744
  668    H    HIS  94           HN       HIS  94  22.650  10.613 -18.541
  669    HA   HIS  94           HA       HIS  94  23.867  12.533 -16.751
  670    HB2  HIS  94           HB2      HIS  94  22.092  10.149 -16.345
  671    HB3  HIS  94           HB1      HIS  94  22.983  10.813 -14.990
  672    HD1  HIS  94           HD1      HIS  94  22.158  12.942 -13.949
  673    HD2  HIS  94           HD2      HIS  94  20.093  11.924 -17.420
  674    HE1  HIS  94           HE1      HIS  94  20.172  14.486 -14.038
  675    HE2  HIS  94           HE2      HIS  94  18.830  13.712 -16.025
  676    H    ASN  95           HN       ASN  95  25.109   9.883 -18.313
  677    HA   ASN  95           HA       ASN  95  26.716   9.049 -16.026
  678    HB2  ASN  95           HB2      ASN  95  26.718   7.004 -17.032
  679    HB3  ASN  95           HB1      ASN  95  25.663   7.691 -18.257
  680   HD21  ASN  95          HD21      ASN  95  26.522   8.336 -20.225
  681   HD22  ASN  95          HD22      ASN  95  28.076   7.772 -20.760
  682    H    THR  96           HN       THR  96  27.130  10.687 -19.153
  683    HA   THR  96           HA       THR  96  29.924  11.179 -18.408
  684    HB   THR  96           HB       THR  96  30.188  11.922 -20.794
  685    HG1  THR  96           HG1      THR  96  28.322  12.302 -21.759
  686   HG21  THR  96          HG21      THR  96  29.081   9.136 -20.468
  687   HG22  THR  96          HG22      THR  96  30.730   9.616 -20.060
  688   HG23  THR  96          HG23      THR  96  30.174   9.688 -21.735
  689    H    ARG  97           HN       ARG  97  26.906  12.632 -18.325
  690    HA   ARG  97           HA       ARG  97  26.171  14.714 -17.722
  691    HB2  ARG  97           HB2      ARG  97  29.085  15.219 -17.110
  692    HB3  ARG  97           HB1      ARG  97  27.742  16.247 -16.614
  693    HG2  ARG  97           HG2      ARG  97  26.792  14.332 -15.375
  694    HG3  ARG  97           HG1      ARG  97  28.222  13.401 -15.820
  695    HD2  ARG  97           HD2      ARG  97  28.328  14.394 -13.529
  696    HD3  ARG  97           HD1      ARG  97  29.651  14.886 -14.586
  697    HE   ARG  97           HE       ARG  97  28.298  16.978 -14.961
  698   HH11  ARG  97          HH11      ARG  97  27.954  15.101 -12.015
  699   HH12  ARG  97          HH12      ARG  97  27.476  16.468 -11.054
  700   HH21  ARG  97          HH21      ARG  97  27.702  18.777 -13.671
  701   HH22  ARG  97          HH22      ARG  97  27.347  18.543 -11.990
  702    H    THR  98           HN       THR  98  26.976  14.087 -20.318
  703    HA   THR  98           HA       THR  98  27.735  16.677 -21.476
  704    HB   THR  98           HB       THR  98  27.818  15.270 -23.638
  705    HG1  THR  98           HG1      THR  98  26.643  13.495 -22.663
  706   HG21  THR  98          HG21      THR  98  29.865  16.004 -22.485
  707   HG22  THR  98          HG22      THR  98  30.060  14.358 -23.094
  708   HG23  THR  98          HG23      THR  98  29.738  14.633 -21.383
  709    H    THR  99           HN       THR  99  26.445  17.535 -23.287
  710    HA   THR  99           HA       THR  99  23.636  16.608 -23.219
  711    HB   THR  99           HB       THR  99  23.242  19.001 -24.209
  712    HG1  THR  99           HG1      THR  99  24.944  20.454 -23.287
  713   HG21  THR  99          HG21      THR  99  22.510  18.380 -21.927
  714   HG22  THR  99          HG22      THR  99  23.212  20.000 -21.905
  715   HG23  THR  99          HG23      THR  99  24.148  18.625 -21.322
  716    H    THR 100           HN       THR 100  23.344  15.283 -25.006
  717    HA   THR 100           HA       THR 100  24.732  15.988 -27.480
  718    HB   THR 100           HB       THR 100  24.855  13.596 -26.559
  719    HG1  THR 100           HG1      THR 100  25.513  13.543 -28.580
  720   HG21  THR 100          HG21      THR 100  22.017  13.573 -27.595
  721   HG22  THR 100          HG22      THR 100  22.565  13.155 -25.971
  722   HG23  THR 100          HG23      THR 100  22.982  12.120 -27.333
  723    H    PHE 101           HN       PHE 101  23.608  16.215 -29.431
  724    HA   PHE 101           HA       PHE 101  20.747  16.817 -29.092
  725    HB2  PHE 101           HB2      PHE 101  22.441  18.754 -29.580
  726    HB3  PHE 101           HB1      PHE 101  22.414  18.080 -31.268
  727    HD1  PHE 101           HD1      PHE 101  20.050  17.760 -32.303
  728    HD2  PHE 101           HD2      PHE 101  20.847  20.258 -28.955
  729    HE1  PHE 101           HE1      PHE 101  17.939  18.960 -32.700
  730    HE2  PHE 101           HE2      PHE 101  18.730  21.450 -29.331
  731    HZ   PHE 101           HZ       PHE 101  17.277  20.811 -31.212
  732    H    LYS 102           HN       LYS 102  19.674  15.153 -29.971
  733    HA   LYS 102           HA       LYS 102  20.417  14.353 -32.693
  734    HB2  LYS 102           HB2      LYS 102  21.162  12.654 -30.941
  735    HB3  LYS 102           HB1      LYS 102  19.455  12.361 -30.636
  736    HG2  LYS 102           HG2      LYS 102  19.233  11.856 -33.101
  737    HG3  LYS 102           HG1      LYS 102  20.996  11.871 -33.168
  738    HD2  LYS 102           HD2      LYS 102  20.348   9.609 -32.901
  739    HD3  LYS 102           HD1      LYS 102  20.963  10.139 -31.334
  740    HE2  LYS 102           HE2      LYS 102  18.734  10.403 -30.485
  741    HE3  LYS 102           HE1      LYS 102  18.045  10.096 -32.080
  742    HZ1  LYS 102           HZ1      LYS 102  19.064   7.847 -31.961
  743    HZ2  LYS 102           HZ2      LYS 102  17.851   8.114 -30.808
  744    HZ3  LYS 102           HZ3      LYS 102  19.479   8.161 -30.343
  745    H    ASP 103           HN       ASP 103  18.785  15.349 -33.714
  746    HA   ASP 103           HA       ASP 103  16.052  14.553 -32.932
  747    HB2  ASP 103           HB2      ASP 103  16.528  17.032 -32.773
  748    HB3  ASP 103           HB1      ASP 103  16.818  17.023 -34.511
  749    HA   PRO 104           HA       PRO 104  16.062  12.239 -36.697
  750    HB2  PRO 104           HB2      PRO 104  13.331  12.238 -37.141
  751    HB3  PRO 104           HB1      PRO 104  14.149  11.134 -36.031
  752    HG2  PRO 104           HG2      PRO 104  12.707  13.691 -35.442
  753    HG3  PRO 104           HG1      PRO 104  12.697  12.160 -34.546
  754    HD2  PRO 104           HD2      PRO 104  14.146  14.244 -33.710
  755    HD3  PRO 104           HD1      PRO 104  14.746  12.579 -33.556
  756    H    ARG 105           HN       ARG 105  14.733  15.464 -36.522
  757    HA   ARG 105           HA       ARG 105  14.667  15.547 -39.465
  758    HB2  ARG 105           HB2      ARG 105  13.411  17.470 -37.498
  759    HB3  ARG 105           HB1      ARG 105  13.360  17.635 -39.244
  760    HG2  ARG 105           HG2      ARG 105  11.266  16.761 -38.637
  761    HG3  ARG 105           HG1      ARG 105  12.169  15.394 -39.300
  762    HD2  ARG 105           HD2      ARG 105  12.767  14.769 -36.947
  763    HD3  ARG 105           HD1      ARG 105  11.668  16.028 -36.391
  764    HE   ARG 105           HE       ARG 105  10.672  13.860 -38.100
  765   HH11  ARG 105          HH11      ARG 105  10.663  15.652 -35.101
  766   HH12  ARG 105          HH12      ARG 105   9.270  14.827 -34.450
  767   HH21  ARG 105          HH21      ARG 105   8.843  12.739 -37.240
  768   HH22  ARG 105          HH22      ARG 105   8.255  13.152 -35.657
  769    HA   PRO 106           HA       PRO 106  18.549  17.679 -38.704
  770    HB2  PRO 106           HB2      PRO 106  19.315  18.036 -41.287
  771    HB3  PRO 106           HB1      PRO 106  19.458  16.452 -40.435
  772    HG2  PRO 106           HG2      PRO 106  17.394  17.392 -42.394
  773    HG3  PRO 106           HG1      PRO 106  18.155  15.800 -42.229
  774    HD2  PRO 106           HD2      PRO 106  15.651  16.421 -41.305
  775    HD3  PRO 106           HD1      PRO 106  16.687  15.123 -40.617
  776    H    GLY 107           HN       GLY 107  18.850  19.768 -38.281
  777    HA2  GLY 107           HA2      GLY 107  18.849  22.054 -38.605
  778    HA3  GLY 107           HA1      GLY 107  17.959  21.810 -40.124
  779    H    PHE 108           HN       PHE 108  15.938  20.158 -38.481
  780    HA   PHE 108           HA       PHE 108  13.731  20.643 -37.948
  781    HB2  PHE 108           HB2      PHE 108  13.579  21.742 -35.630
  782    HB3  PHE 108           HB1      PHE 108  14.536  20.225 -35.748
  783    HD1  PHE 108           HD1      PHE 108  16.961  20.293 -35.443
  784    HD2  PHE 108           HD2      PHE 108  14.624  23.844 -35.140
  785    HE1  PHE 108           HE1      PHE 108  18.843  21.439 -34.357
  786    HE2  PHE 108           HE2      PHE 108  16.509  24.990 -34.058
  787    HZ   PHE 108           HZ       PHE 108  18.627  23.786 -33.667
  788    H    GLU 109           HN       GLU 109  14.433  22.356 -39.915
  789    HA   GLU 109           HA       GLU 109  12.869  24.725 -39.225
  790    HB2  GLU 109           HB2      GLU 109  15.287  25.371 -39.123
  791    HB3  GLU 109           HB1      GLU 109  15.462  24.883 -40.801
  792    HG2  GLU 109           HG2      GLU 109  15.251  27.272 -40.663
  793    HG3  GLU 109           HG1      GLU 109  13.829  26.599 -41.455
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1 -42.576   7.068  -3.530
    2    H2   GLY   1           HT2      GLY   1 -42.588   6.702  -5.187
    3    H3   GLY   1           HT3      GLY   1 -42.048   8.217  -4.658
    4    HA2  GLY   1           HA1      GLY   1 -40.727   5.626  -4.097
    5    HA3  GLY   1           HA2      GLY   1 -40.181   6.821  -5.269
    6    H    SER   2           HN       SER   2 -40.293   5.908  -1.952
    7    HA   SER   2           HA       SER   2 -39.149   8.439  -1.069
    8    HB2  SER   2           HB2      SER   2 -39.317   7.325   1.218
    9    HB3  SER   2           HB1      SER   2 -40.846   7.612   0.382
   10    HG   SER   2           HG       SER   2 -40.936   5.526   1.097
   11    H    HIS   3           HN       HIS   3 -38.357   5.009  -0.466
   12    HA   HIS   3           HA       HIS   3 -35.742   5.507   0.349
   13    HB2  HIS   3           HB2      HIS   3 -35.340   3.054  -0.046
   14    HB3  HIS   3           HB1      HIS   3 -36.764   3.395   0.922
   15    HD1  HIS   3           HD1      HIS   3 -37.162   0.794   0.097
   16    HD2  HIS   3           HD2      HIS   3 -37.746   3.826  -2.708
   17    HE1  HIS   3           HE1      HIS   3 -38.566  -0.223  -1.731
   18    HE2  HIS   3           HE2      HIS   3 -38.902   1.614  -3.419
   19    H    MET   4           HN       MET   4 -33.700   5.329  -0.711
   20    HA   MET   4           HA       MET   4 -33.864   5.547  -3.640
   21    HB2  MET   4           HB2      MET   4 -31.817   6.853  -1.822
   22    HB3  MET   4           HB1      MET   4 -31.914   7.028  -3.567
   23    HG2  MET   4           HG2      MET   4 -34.100   8.112  -3.329
   24    HG3  MET   4           HG1      MET   4 -33.968   7.965  -1.577
   25    HE1  MET   4           HE1      MET   4 -31.101  10.530  -4.128
   26    HE2  MET   4           HE2      MET   4 -32.534   9.758  -4.808
   27    HE3  MET   4           HE3      MET   4 -31.202   8.771  -4.207
   28    H    GLN   5           HN       GLN   5 -32.520   4.284  -4.837
   29    HA   GLN   5           HA       GLN   5 -31.340   2.039  -3.545
   30    HB2  GLN   5           HB2      GLN   5 -32.398   1.768  -5.698
   31    HB3  GLN   5           HB1      GLN   5 -31.325   2.952  -6.424
   32    HG2  GLN   5           HG2      GLN   5 -29.423   1.399  -5.896
   33    HG3  GLN   5           HG1      GLN   5 -30.631   0.186  -5.465
   34   HE21  GLN   5          HE21      GLN   5 -31.941  -0.697  -7.089
   35   HE22  GLN   5          HE22      GLN   5 -31.520  -0.552  -8.790
   36    H    TYR   6           HN       TYR   6 -29.426   2.041  -2.592
   37    HA   TYR   6           HA       TYR   6 -27.280   3.692  -3.771
   38    HB2  TYR   6           HB2      TYR   6 -27.750   2.851  -0.885
   39    HB3  TYR   6           HB1      TYR   6 -26.152   3.343  -1.428
   40    HD1  TYR   6           HD1      TYR   6 -25.730   5.690  -2.037
   41    HD2  TYR   6           HD2      TYR   6 -29.545   4.435  -0.627
   42    HE1  TYR   6           HE1      TYR   6 -26.362   8.038  -1.663
   43    HE2  TYR   6           HE2      TYR   6 -30.178   6.777  -0.246
   44    HH   TYR   6           HH       TYR   6 -29.154   8.938   0.102
   45    H    LYS   7           HN       LYS   7 -25.277   2.668  -4.168
   46    HA   LYS   7           HA       LYS   7 -25.436  -0.265  -4.023
   47    HB2  LYS   7           HB2      LYS   7 -23.724   1.149  -6.034
   48    HB3  LYS   7           HB1      LYS   7 -24.439  -0.474  -6.160
   49    HG2  LYS   7           HG2      LYS   7 -26.672   0.857  -6.180
   50    HG3  LYS   7           HG1      LYS   7 -25.641   2.210  -6.643
   51    HD2  LYS   7           HD2      LYS   7 -24.777   0.870  -8.519
   52    HD3  LYS   7           HD1      LYS   7 -25.897  -0.424  -8.078
   53    HE2  LYS   7           HE2      LYS   7 -27.738   1.329  -8.299
   54    HE3  LYS   7           HE1      LYS   7 -26.532   2.337  -9.094
   55    HZ1  LYS   7           HZ1      LYS   7 -26.251   0.591 -10.764
   56    HZ2  LYS   7           HZ2      LYS   7 -27.856   1.125 -10.694
   57    HZ3  LYS   7           HZ3      LYS   7 -27.428  -0.355  -9.987
   58    H    LEU   8           HN       LEU   8 -23.407  -1.404  -4.023
   59    HA   LEU   8           HA       LEU   8 -21.129   0.106  -2.966
   60    HB2  LEU   8           HB2      LEU   8 -22.501  -0.680  -0.999
   61    HB3  LEU   8           HB1      LEU   8 -22.208  -2.317  -1.536
   62    HG   LEU   8           HG       LEU   8 -19.749  -1.853  -1.277
   63   HD11  LEU   8          HD11      LEU   8 -19.294  -0.019   0.442
   64   HD12  LEU   8          HD12      LEU   8 -20.844   0.665  -0.047
   65   HD13  LEU   8          HD13      LEU   8 -19.545   0.484  -1.225
   66   HD21  LEU   8          HD21      LEU   8 -21.690  -1.869   0.987
   67   HD22  LEU   8          HD22      LEU   8 -19.949  -1.965   1.251
   68   HD23  LEU   8          HD23      LEU   8 -20.769  -3.212   0.309
   69    H    ILE   9           HN       ILE   9 -19.322  -0.560  -3.930
   70    HA   ILE   9           HA       ILE   9 -19.179  -3.334  -4.863
   71    HB   ILE   9           HB       ILE   9 -17.991  -0.841  -6.064
   72   HG12  ILE   9          HG12      ILE   9 -18.907  -1.586  -8.095
   73   HG13  ILE   9          HG11      ILE   9 -19.231  -3.233  -7.512
   74   HG21  ILE   9          HG21      ILE   9 -16.992  -3.648  -6.524
   75   HG22  ILE   9          HG22      ILE   9 -16.103  -2.329  -5.767
   76   HG23  ILE   9          HG23      ILE   9 -16.535  -2.234  -7.474
   77   HD11  ILE   9          HD11      ILE   9 -21.003  -2.283  -6.071
   78   HD12  ILE   9          HD12      ILE   9 -21.276  -1.926  -7.779
   79   HD13  ILE   9          HD13      ILE   9 -20.656  -0.673  -6.702
   80    H    LEU  10           HN       LEU  10 -17.795  -4.611  -3.796
   81    HA   LEU  10           HA       LEU  10 -15.954  -3.311  -1.927
   82    HB2  LEU  10           HB2      LEU  10 -16.709  -6.233  -2.057
   83    HB3  LEU  10           HB1      LEU  10 -15.655  -5.511  -0.876
   84    HG   LEU  10           HG       LEU  10 -17.604  -5.810   0.286
   85   HD11  LEU  10          HD11      LEU  10 -18.569  -3.686   0.747
   86   HD12  LEU  10          HD12      LEU  10 -17.936  -3.032  -0.760
   87   HD13  LEU  10          HD13      LEU  10 -16.826  -3.536   0.522
   88   HD21  LEU  10          HD21      LEU  10 -18.956  -6.477  -1.682
   89   HD22  LEU  10          HD22      LEU  10 -19.256  -4.767  -2.001
   90   HD23  LEU  10          HD23      LEU  10 -19.832  -5.501  -0.506
   91    H    ASN  11           HN       ASN  11 -14.038  -2.892  -2.725
   92    HA   ASN  11           HA       ASN  11 -12.885  -4.744  -4.704
   93    HB2  ASN  11           HB2      ASN  11 -13.160  -2.209  -5.160
   94    HB3  ASN  11           HB1      ASN  11 -11.832  -1.996  -4.030
   95   HD21  ASN  11          HD21      ASN  11 -12.034  -1.414  -6.901
   96   HD22  ASN  11          HD22      ASN  11 -10.745  -2.290  -7.648
   97    H    GLY  12           HN       GLY  12 -12.183  -6.273  -3.243
   98    HA2  GLY  12           HA2      GLY  12  -9.754  -5.487  -1.782
   99    HA3  GLY  12           HA1      GLY  12 -10.981  -6.478  -0.960
  100    H    LYS  13           HN       LYS  13  -8.113  -6.728  -2.307
  101    HA   LYS  13           HA       LYS  13  -8.011  -8.550  -4.304
  102    HB2  LYS  13           HB2      LYS  13  -6.155  -8.456  -1.919
  103    HB3  LYS  13           HB1      LYS  13  -5.785  -9.170  -3.482
  104    HG2  LYS  13           HG2      LYS  13  -6.027  -6.946  -4.517
  105    HG3  LYS  13           HG1      LYS  13  -6.299  -6.258  -2.914
  106    HD2  LYS  13           HD2      LYS  13  -4.093  -7.059  -2.208
  107    HD3  LYS  13           HD1      LYS  13  -3.829  -7.733  -3.818
  108    HE2  LYS  13           HE2      LYS  13  -4.113  -5.444  -4.750
  109    HE3  LYS  13           HE1      LYS  13  -4.179  -4.828  -3.099
  110    HZ1  LYS  13           HZ1      LYS  13  -1.954  -4.664  -4.118
  111    HZ2  LYS  13           HZ2      LYS  13  -1.896  -6.352  -4.238
  112    HZ3  LYS  13           HZ3      LYS  13  -1.954  -5.613  -2.713
  113    H    THR  14           HN       THR  14  -8.791  -9.276  -0.960
  114    HA   THR  14           HA       THR  14  -8.595 -12.149  -1.520
  115    HB   THR  14           HB       THR  14  -9.270 -12.314   0.952
  116    HG1  THR  14           HG1      THR  14  -8.316 -10.041   1.791
  117   HG21  THR  14          HG21      THR  14  -6.665 -10.986   0.188
  118   HG22  THR  14          HG22      THR  14  -6.997 -12.720   0.163
  119   HG23  THR  14          HG23      THR  14  -6.970 -11.846   1.694
  120    H    LEU  15           HN       LEU  15 -10.990  -9.719  -0.580
  121    HA   LEU  15           HA       LEU  15 -13.093 -11.579  -1.434
  122    HB2  LEU  15           HB2      LEU  15 -12.962 -11.408   1.057
  123    HB3  LEU  15           HB1      LEU  15 -13.176  -9.682   0.924
  124    HG   LEU  15           HG       LEU  15 -15.172 -11.233   1.577
  125   HD11  LEU  15          HD11      LEU  15 -16.721  -9.598   0.431
  126   HD12  LEU  15          HD12      LEU  15 -15.279  -8.890  -0.302
  127   HD13  LEU  15          HD13      LEU  15 -15.467  -8.892   1.454
  128   HD21  LEU  15          HD21      LEU  15 -15.028 -12.701  -0.346
  129   HD22  LEU  15          HD22      LEU  15 -15.246 -11.327  -1.428
  130   HD23  LEU  15          HD23      LEU  15 -16.555 -11.818  -0.356
  131    H    LYS  16           HN       LYS  16 -13.833 -10.735  -3.289
  132    HA   LYS  16           HA       LYS  16 -14.386  -7.843  -3.352
  133    HB2  LYS  16           HB2      LYS  16 -14.266  -9.543  -5.835
  134    HB3  LYS  16           HB1      LYS  16 -14.110  -7.803  -5.713
  135    HG2  LYS  16           HG2      LYS  16 -11.977  -8.382  -6.185
  136    HG3  LYS  16           HG1      LYS  16 -11.870  -8.444  -4.415
  137    HD2  LYS  16           HD2      LYS  16 -12.340 -10.876  -4.570
  138    HD3  LYS  16           HD1      LYS  16 -12.354 -10.702  -6.322
  139    HE2  LYS  16           HE2      LYS  16  -9.983  -9.920  -4.679
  140    HE3  LYS  16           HE1      LYS  16 -10.211 -11.564  -5.268
  141    HZ1  LYS  16           HZ1      LYS  16 -10.307 -10.671  -7.537
  142    HZ2  LYS  16           HZ2      LYS  16  -8.833 -10.330  -6.779
  143    HZ3  LYS  16           HZ3      LYS  16  -9.999  -9.110  -6.940
  144    H    GLY  17           HN       GLY  17 -16.392  -7.250  -4.503
  145    HA2  GLY  17           HA2      GLY  17 -18.390  -9.040  -5.194
  146    HA3  GLY  17           HA1      GLY  17 -18.559  -8.754  -3.467
  147    H    GLU  18           HN       GLU  18 -20.680  -7.989  -4.433
  148    HA   GLU  18           HA       GLU  18 -20.709  -5.150  -4.320
  149    HB2  GLU  18           HB2      GLU  18 -21.918  -4.958  -6.620
  150    HB3  GLU  18           HB1      GLU  18 -20.161  -4.991  -6.577
  151    HG2  GLU  18           HG2      GLU  18 -20.109  -7.264  -7.269
  152    HG3  GLU  18           HG1      GLU  18 -21.852  -7.426  -7.084
  153    H    THR  19           HN       THR  19 -22.817  -4.277  -4.150
  154    HA   THR  19           HA       THR  19 -25.120  -5.977  -4.211
  155    HB   THR  19           HB       THR  19 -24.045  -6.838  -2.150
  156    HG1  THR  19           HG1      THR  19 -25.921  -6.428  -0.771
  157   HG21  THR  19          HG21      THR  19 -24.424  -3.998  -1.139
  158   HG22  THR  19          HG22      THR  19 -22.878  -4.792  -1.432
  159   HG23  THR  19          HG23      THR  19 -23.935  -5.372  -0.142
  160    H    THR  20           HN       THR  20 -26.942  -4.766  -2.784
  161    HA   THR  20           HA       THR  20 -26.700  -1.881  -3.157
  162    HB   THR  20           HB       THR  20 -28.992  -1.833  -4.192
  163    HG1  THR  20           HG1      THR  20 -28.783  -4.386  -5.195
  164   HG21  THR  20          HG21      THR  20 -28.229  -2.561  -6.480
  165   HG22  THR  20          HG22      THR  20 -26.759  -3.179  -5.722
  166   HG23  THR  20          HG23      THR  20 -27.125  -1.456  -5.662
  167    H    THR  21           HN       THR  21 -28.400  -0.661  -2.065
  168    HA   THR  21           HA       THR  21 -30.097  -2.117  -0.215
  169    HB   THR  21           HB       THR  21 -27.881  -1.750   1.020
  170    HG1  THR  21           HG1      THR  21 -29.367  -2.083   2.499
  171   HG21  THR  21          HG21      THR  21 -27.644   0.548   2.024
  172   HG22  THR  21          HG22      THR  21 -28.893   1.117   0.917
  173   HG23  THR  21          HG23      THR  21 -27.358   0.529   0.278
  174    H    GLU  22           HN       GLU  22 -31.690  -0.730   0.806
  175    HA   GLU  22           HA       GLU  22 -32.260   1.621  -0.878
  176    HB2  GLU  22           HB2      GLU  22 -34.637   1.247  -0.133
  177    HB3  GLU  22           HB1      GLU  22 -33.995  -0.117  -1.047
  178    HG2  GLU  22           HG2      GLU  22 -33.577  -1.331   1.032
  179    HG3  GLU  22           HG1      GLU  22 -34.253   0.059   1.963
  180    H    ALA  23           HN       ALA  23 -31.656   3.464   0.108
  181    HA   ALA  23           HA       ALA  23 -32.432   3.841   2.936
  182    HB1  ALA  23           HB1      ALA  23 -29.682   4.490   1.824
  183    HB2  ALA  23           HB2      ALA  23 -30.060   3.197   2.963
  184    HB3  ALA  23           HB3      ALA  23 -30.255   4.882   3.444
  185    H    VAL  24           HN       VAL  24 -32.550   6.195   3.511
  186    HA   VAL  24           HA       VAL  24 -33.090   7.796   1.109
  187    HB   VAL  24           HB       VAL  24 -34.505   9.210   2.578
  188   HG11  VAL  24          HG11      VAL  24 -35.500   7.448   1.231
  189   HG12  VAL  24          HG12      VAL  24 -36.347   7.607   2.769
  190   HG13  VAL  24          HG13      VAL  24 -35.212   6.281   2.522
  191   HG21  VAL  24          HG21      VAL  24 -33.981   7.055   4.621
  192   HG22  VAL  24          HG22      VAL  24 -35.156   8.362   4.781
  193   HG23  VAL  24          HG23      VAL  24 -33.432   8.728   4.713
  194    H    ASP  25           HN       ASP  25 -30.531   7.421   2.932
  195    HA   ASP  25           HA       ASP  25 -29.809  10.231   2.840
  196    HB2  ASP  25           HB2      ASP  25 -29.659   8.598   5.376
  197    HB3  ASP  25           HB1      ASP  25 -28.726  10.066   5.126
  198    H    ALA  26           HN       ALA  26 -27.617  10.555   2.451
  199    HA   ALA  26           HA       ALA  26 -26.078   8.431   1.455
  200    HB1  ALA  26           HB1      ALA  26 -25.180  11.162   2.386
  201    HB2  ALA  26           HB2      ALA  26 -25.752  10.760   0.766
  202    HB3  ALA  26           HB3      ALA  26 -24.246  10.064   1.369
  203    H    ALA  27           HN       ALA  27 -25.986  10.156   4.551
  204    HA   ALA  27           HA       ALA  27 -23.753   8.841   5.635
  205    HB1  ALA  27           HB1      ALA  27 -24.567   9.614   7.811
  206    HB2  ALA  27           HB2      ALA  27 -26.119  10.030   7.079
  207    HB3  ALA  27           HB3      ALA  27 -24.658  10.887   6.594
  208    H    THR  28           HN       THR  28 -27.196   8.041   5.702
  209    HA   THR  28           HA       THR  28 -26.977   5.846   7.483
  210    HB   THR  28           HB       THR  28 -29.069   6.197   5.317
  211    HG1  THR  28           HG1      THR  28 -30.211   7.359   6.901
  212   HG21  THR  28          HG21      THR  28 -29.037   3.978   6.404
  213   HG22  THR  28          HG22      THR  28 -30.483   4.892   6.833
  214   HG23  THR  28          HG23      THR  28 -29.150   4.762   7.980
  215    H    ALA  29           HN       ALA  29 -26.495   6.148   4.012
  216    HA   ALA  29           HA       ALA  29 -26.609   3.340   3.450
  217    HB1  ALA  29           HB1      ALA  29 -26.996   5.029   1.706
  218    HB2  ALA  29           HB2      ALA  29 -25.664   3.955   1.278
  219    HB3  ALA  29           HB3      ALA  29 -25.330   5.581   1.874
  220    H    GLU  30           HN       GLU  30 -24.172   5.709   4.237
  221    HA   GLU  30           HA       GLU  30 -21.887   4.087   3.943
  222    HB2  GLU  30           HB2      GLU  30 -22.151   6.681   4.304
  223    HB3  GLU  30           HB1      GLU  30 -22.117   6.248   6.004
  224    HG2  GLU  30           HG2      GLU  30 -19.947   5.047   5.540
  225    HG3  GLU  30           HG1      GLU  30 -19.970   5.847   3.968
  226    H    LYS  31           HN       LYS  31 -23.679   5.084   6.856
  227    HA   LYS  31           HA       LYS  31 -22.309   3.689   8.759
  228    HB2  LYS  31           HB2      LYS  31 -25.266   4.259   8.717
  229    HB3  LYS  31           HB1      LYS  31 -24.377   3.749  10.133
  230    HG2  LYS  31           HG2      LYS  31 -23.160   5.760  10.187
  231    HG3  LYS  31           HG1      LYS  31 -23.716   6.233   8.585
  232    HD2  LYS  31           HD2      LYS  31 -24.921   7.490  10.256
  233    HD3  LYS  31           HD1      LYS  31 -26.019   6.349   9.479
  234    HE2  LYS  31           HE2      LYS  31 -26.397   6.355  11.866
  235    HE3  LYS  31           HE1      LYS  31 -25.728   4.803  11.368
  236    HZ1  LYS  31           HZ1      LYS  31 -24.727   5.694  13.416
  237    HZ2  LYS  31           HZ2      LYS  31 -24.131   7.020  12.540
  238    HZ3  LYS  31           HZ3      LYS  31 -23.590   5.453  12.182
  239    H    VAL  32           HN       VAL  32 -25.034   2.399   6.849
  240    HA   VAL  32           HA       VAL  32 -25.121  -0.060   8.326
  241    HB   VAL  32           HB       VAL  32 -26.325   0.626   5.638
  242   HG11  VAL  32          HG11      VAL  32 -26.893  -1.689   7.493
  243   HG12  VAL  32          HG12      VAL  32 -26.106  -1.785   5.918
  244   HG13  VAL  32          HG13      VAL  32 -27.796  -1.299   6.029
  245   HG21  VAL  32          HG21      VAL  32 -27.567   0.586   8.383
  246   HG22  VAL  32          HG22      VAL  32 -28.406   0.917   6.868
  247   HG23  VAL  32          HG23      VAL  32 -27.167   2.029   7.452
  248    H    PHE  33           HN       PHE  33 -23.864   0.911   5.144
  249    HA   PHE  33           HA       PHE  33 -22.942  -1.710   4.495
  250    HB2  PHE  33           HB2      PHE  33 -22.565   1.000   3.316
  251    HB3  PHE  33           HB1      PHE  33 -21.456  -0.267   2.854
  252    HD1  PHE  33           HD1      PHE  33 -23.561  -2.522   2.969
  253    HD2  PHE  33           HD2      PHE  33 -23.532   1.345   1.203
  254    HE1  PHE  33           HE1      PHE  33 -25.148  -3.295   1.254
  255    HE2  PHE  33           HE2      PHE  33 -25.124   0.588  -0.509
  256    HZ   PHE  33           HZ       PHE  33 -25.939  -1.742  -0.491
  257    H    LYS  34           HN       LYS  34 -21.545   0.915   6.338
  258    HA   LYS  34           HA       LYS  34 -18.863   0.089   6.125
  259    HB2  LYS  34           HB2      LYS  34 -20.355   1.732   8.143
  260    HB3  LYS  34           HB1      LYS  34 -18.680   1.342   8.397
  261    HG2  LYS  34           HG2      LYS  34 -18.321   2.351   6.049
  262    HG3  LYS  34           HG1      LYS  34 -19.917   3.065   6.291
  263    HD2  LYS  34           HD2      LYS  34 -18.344   4.701   7.043
  264    HD3  LYS  34           HD1      LYS  34 -19.061   3.974   8.484
  265    HE2  LYS  34           HE2      LYS  34 -17.108   2.446   8.625
  266    HE3  LYS  34           HE1      LYS  34 -16.377   3.314   7.276
  267    HZ1  LYS  34           HZ1      LYS  34 -17.074   4.453   9.926
  268    HZ2  LYS  34           HZ2      LYS  34 -16.430   5.334   8.626
  269    HZ3  LYS  34           HZ3      LYS  34 -15.513   4.110   9.357
  270    H    GLN  35           HN       GLN  35 -21.367  -0.649   8.525
  271    HA   GLN  35           HA       GLN  35 -19.768  -2.358  10.085
  272    HB2  GLN  35           HB2      GLN  35 -22.008  -1.289  10.731
  273    HB3  GLN  35           HB1      GLN  35 -22.797  -2.468   9.713
  274    HG2  GLN  35           HG2      GLN  35 -21.195  -3.160  12.192
  275    HG3  GLN  35           HG1      GLN  35 -22.931  -2.951  12.125
  276   HE21  GLN  35          HE21      GLN  35 -23.322  -4.231   9.591
  277   HE22  GLN  35          HE22      GLN  35 -23.067  -5.920   9.848
  278    H    TYR  36           HN       TYR  36 -21.647  -2.728   7.192
  279    HA   TYR  36           HA       TYR  36 -21.676  -5.545   6.986
  280    HB2  TYR  36           HB2      TYR  36 -23.195  -4.267   5.646
  281    HB3  TYR  36           HB1      TYR  36 -21.890  -3.303   4.981
  282    HD1  TYR  36           HD1      TYR  36 -23.324  -6.754   4.958
  283    HD2  TYR  36           HD2      TYR  36 -20.833  -3.904   3.029
  284    HE1  TYR  36           HE1      TYR  36 -23.190  -8.213   2.979
  285    HE2  TYR  36           HE2      TYR  36 -20.691  -5.341   1.046
  286    HH   TYR  36           HH       TYR  36 -22.730  -8.049   0.601
  287    H    ALA  37           HN       ALA  37 -19.597  -3.105   5.448
  288    HA   ALA  37           HA       ALA  37 -17.835  -4.951   4.234
  289    HB1  ALA  37           HB1      ALA  37 -16.428  -2.994   3.803
  290    HB2  ALA  37           HB2      ALA  37 -17.367  -2.054   4.963
  291    HB3  ALA  37           HB3      ALA  37 -18.124  -2.628   3.480
  292    H    ASN  38           HN       ASN  38 -17.768  -3.197   7.275
  293    HA   ASN  38           HA       ASN  38 -15.130  -3.812   8.042
  294    HB2  ASN  38           HB2      ASN  38 -16.615  -2.033   9.112
  295    HB3  ASN  38           HB1      ASN  38 -17.498  -3.337   9.897
  296   HD21  ASN  38          HD21      ASN  38 -14.693  -1.312  10.043
  297   HD22  ASN  38          HD22      ASN  38 -13.985  -2.044  11.500
  298    H    ASP  39           HN       ASP  39 -18.162  -5.546   8.410
  299    HA   ASP  39           HA       ASP  39 -17.219  -7.522  10.191
  300    HB2  ASP  39           HB2      ASP  39 -19.631  -7.055   9.707
  301    HB3  ASP  39           HB1      ASP  39 -19.416  -7.813   8.129
  302    H    ASN  40           HN       ASN  40 -17.281  -7.326   6.650
  303    HA   ASN  40           HA       ASN  40 -16.212  -9.959   6.273
  304    HB2  ASN  40           HB2      ASN  40 -16.246  -7.634   4.327
  305    HB3  ASN  40           HB1      ASN  40 -16.030  -9.329   3.928
  306   HD21  ASN  40          HD21      ASN  40 -18.032  -7.254   3.206
  307   HD22  ASN  40          HD22      ASN  40 -19.572  -8.028   3.556
  308    H    GLY  41           HN       GLY  41 -14.886  -7.058   7.305
  309    HA2  GLY  41           HA2      GLY  41 -12.655  -6.788   7.990
  310    HA3  GLY  41           HA1      GLY  41 -12.181  -8.074   6.891
  311    H    VAL  42           HN       VAL  42 -14.238  -5.838   5.385
  312    HA   VAL  42           HA       VAL  42 -11.953  -4.731   3.970
  313    HB   VAL  42           HB       VAL  42 -14.885  -4.601   3.232
  314   HG11  VAL  42          HG11      VAL  42 -14.062  -3.897   1.049
  315   HG12  VAL  42          HG12      VAL  42 -12.396  -4.048   1.605
  316   HG13  VAL  42          HG13      VAL  42 -13.442  -2.809   2.295
  317   HG21  VAL  42          HG21      VAL  42 -14.207  -6.322   1.535
  318   HG22  VAL  42          HG22      VAL  42 -14.201  -6.882   3.210
  319   HG23  VAL  42          HG23      VAL  42 -12.680  -6.477   2.407
  320    H    ASP  43           HN       ASP  43 -11.217  -3.083   5.052
  321    HA   ASP  43           HA       ASP  43 -13.036  -0.816   5.502
  322    HB2  ASP  43           HB2      ASP  43 -12.317  -1.975   7.669
  323    HB3  ASP  43           HB1      ASP  43 -10.690  -1.391   7.324
  324    H    GLY  44           HN       GLY  44 -12.436   0.480   3.815
  325    HA2  GLY  44           HA2      GLY  44  -9.637   1.292   3.679
  326    HA3  GLY  44           HA1      GLY  44 -10.351   0.606   2.225
  327    H    GLU  45           HN       GLU  45  -9.665   2.835   1.485
  328    HA   GLU  45           HA       GLU  45 -11.079   5.124   2.363
  329    HB2  GLU  45           HB2      GLU  45  -9.142   4.480   0.305
  330    HB3  GLU  45           HB1      GLU  45 -10.362   5.597  -0.291
  331    HG2  GLU  45           HG2      GLU  45  -8.779   6.001   2.233
  332    HG3  GLU  45           HG1      GLU  45  -8.355   6.695   0.671
  333    H    TRP  46           HN       TRP  46 -12.773   6.251   1.377
  334    HA   TRP  46           HA       TRP  46 -14.583   4.458  -0.111
  335    HB2  TRP  46           HB2      TRP  46 -15.170   6.499   2.029
  336    HB3  TRP  46           HB1      TRP  46 -16.405   6.076   0.858
  337    HD1  TRP  46           HD1      TRP  46 -13.918   3.890   2.880
  338    HE1  TRP  46           HE1      TRP  46 -15.225   2.012   4.037
  339    HE3  TRP  46           HE3      TRP  46 -18.706   5.120   1.405
  340    HZ2  TRP  46           HZ2      TRP  46 -17.873   1.159   4.294
  341    HZ3  TRP  46           HZ3      TRP  46 -20.549   3.698   2.177
  342    HH2  TRP  46           HH2      TRP  46 -20.141   1.761   3.589
  343    H    THR  47           HN       THR  47 -15.343   5.069  -2.003
  344    HA   THR  47           HA       THR  47 -15.033   7.889  -2.805
  345    HB   THR  47           HB       THR  47 -15.046   6.042  -5.073
  346    HG1  THR  47           HG1      THR  47 -13.485   5.424  -2.925
  347   HG21  THR  47          HG21      THR  47 -13.105   7.394  -5.726
  348   HG22  THR  47          HG22      THR  47 -13.081   8.139  -4.127
  349   HG23  THR  47          HG23      THR  47 -14.446   8.413  -5.208
  350    H    TYR  48           HN       TYR  48 -16.847   8.788  -3.860
  351    HA   TYR  48           HA       TYR  48 -19.106   6.974  -4.281
  352    HB2  TYR  48           HB2      TYR  48 -19.551   7.767  -2.114
  353    HB3  TYR  48           HB1      TYR  48 -19.015   9.371  -2.471
  354    HD1  TYR  48           HD1      TYR  48 -20.649  11.031  -2.740
  355    HD2  TYR  48           HD2      TYR  48 -21.667   6.962  -3.495
  356    HE1  TYR  48           HE1      TYR  48 -22.970  11.691  -3.165
  357    HE2  TYR  48           HE2      TYR  48 -23.995   7.622  -3.917
  358    HH   TYR  48           HH       TYR  48 -25.533   9.456  -3.365
  359    H    ASP  49           HN       ASP  49 -20.789   7.831  -5.598
  360    HA   ASP  49           HA       ASP  49 -20.084  10.210  -7.198
  361    HB2  ASP  49           HB2      ASP  49 -19.324   8.474  -8.726
  362    HB3  ASP  49           HB1      ASP  49 -20.768   7.522  -8.480
  363    H    ASP  50           HN       ASP  50 -21.893  11.465  -7.633
  364    HA   ASP  50           HA       ASP  50 -24.232  10.594  -6.082
  365    HB2  ASP  50           HB2      ASP  50 -23.235  12.877  -5.686
  366    HB3  ASP  50           HB1      ASP  50 -23.730  13.317  -7.322
  367    H    ALA  51           HN       ALA  51 -23.196  10.743  -9.301
  368    HA   ALA  51           HA       ALA  51 -25.739  11.192 -10.513
  369    HB1  ALA  51           HB1      ALA  51 -24.650  10.494 -12.587
  370    HB2  ALA  51           HB2      ALA  51 -23.251   9.944 -11.663
  371    HB3  ALA  51           HB3      ALA  51 -23.664  11.657 -11.698
  372    H    THR  52           HN       THR  52 -23.960   8.329  -9.491
  373    HA   THR  52           HA       THR  52 -26.238   6.696 -10.377
  374    HB   THR  52           HB       THR  52 -24.571   4.780 -10.212
  375    HG1  THR  52           HG1      THR  52 -22.674   6.916 -10.301
  376   HG21  THR  52          HG21      THR  52 -24.054   6.997 -12.211
  377   HG22  THR  52          HG22      THR  52 -25.277   5.734 -12.360
  378   HG23  THR  52          HG23      THR  52 -23.564   5.315 -12.400
  379    H    LYS  53           HN       LYS  53 -24.800   7.840  -7.527
  380    HA   LYS  53           HA       LYS  53 -25.114   7.378  -5.295
  381    HB2  LYS  53           HB2      LYS  53 -27.416   6.020  -6.555
  382    HB3  LYS  53           HB1      LYS  53 -26.989   5.460  -4.946
  383    HG2  LYS  53           HG2      LYS  53 -28.696   7.206  -4.895
  384    HG3  LYS  53           HG1      LYS  53 -27.224   7.681  -4.054
  385    HD2  LYS  53           HD2      LYS  53 -26.538   8.975  -6.026
  386    HD3  LYS  53           HD1      LYS  53 -28.046   8.532  -6.828
  387    HE2  LYS  53           HE2      LYS  53 -29.322   9.643  -5.093
  388    HE3  LYS  53           HE1      LYS  53 -27.837  10.034  -4.229
  389    HZ1  LYS  53           HZ1      LYS  53 -28.484  10.987  -6.963
  390    HZ2  LYS  53           HZ2      LYS  53 -27.155  11.449  -6.007
  391    HZ3  LYS  53           HZ3      LYS  53 -28.724  11.887  -5.548
  392    H    THR  54           HN       THR  54 -23.381   5.739  -7.093
  393    HA   THR  54           HA       THR  54 -23.232   3.164  -5.795
  394    HB   THR  54           HB       THR  54 -21.199   4.290  -7.722
  395    HG1  THR  54           HG1      THR  54 -22.845   4.477  -9.071
  396   HG21  THR  54          HG21      THR  54 -22.270   1.478  -7.542
  397   HG22  THR  54          HG22      THR  54 -20.942   2.017  -6.515
  398   HG23  THR  54          HG23      THR  54 -20.760   2.023  -8.271
  399    H    TYR  55           HN       TYR  55 -22.090   2.829  -3.963
  400    HA   TYR  55           HA       TYR  55 -19.880   4.664  -3.326
  401    HB2  TYR  55           HB2      TYR  55 -21.550   2.850  -1.577
  402    HB3  TYR  55           HB1      TYR  55 -19.968   3.384  -1.049
  403    HD1  TYR  55           HD1      TYR  55 -23.397   4.479  -1.866
  404    HD2  TYR  55           HD2      TYR  55 -19.629   5.586  -0.232
  405    HE1  TYR  55           HE1      TYR  55 -24.408   6.504  -0.907
  406    HE2  TYR  55           HE2      TYR  55 -20.628   7.610   0.722
  407    HH   TYR  55           HH       TYR  55 -22.544   9.065   0.345
  408    H    THR  56           HN       THR  56 -17.825   3.912  -3.178
  409    HA   THR  56           HA       THR  56 -17.439   1.029  -3.605
  410    HB   THR  56           HB       THR  56 -15.747   3.190  -4.873
  411    HG1  THR  56           HG1      THR  56 -18.167   2.301  -5.579
  412   HG21  THR  56          HG21      THR  56 -14.560   1.081  -4.532
  413   HG22  THR  56          HG22      THR  56 -14.891   1.320  -6.248
  414   HG23  THR  56          HG23      THR  56 -15.873   0.199  -5.310
  415    H    VAL  57           HN       VAL  57 -16.070   0.099  -2.226
  416    HA   VAL  57           HA       VAL  57 -14.385   1.872  -0.584
  417    HB   VAL  57           HB       VAL  57 -16.061   0.743   0.855
  418   HG11  VAL  57          HG11      VAL  57 -15.819  -1.716   1.280
  419   HG12  VAL  57          HG12      VAL  57 -14.858  -1.811  -0.191
  420   HG13  VAL  57          HG13      VAL  57 -16.546  -1.300  -0.263
  421   HG21  VAL  57          HG21      VAL  57 -13.272  -0.300   1.289
  422   HG22  VAL  57          HG22      VAL  57 -14.533  -0.148   2.513
  423   HG23  VAL  57          HG23      VAL  57 -13.861   1.296   1.754
  424    H    THR  58           HN       THR  58 -12.324   1.743  -0.982
  425    HA   THR  58           HA       THR  58 -11.378  -0.577  -2.522
  426    HB   THR  58           HB       THR  58 -10.056   2.131  -2.318
  427    HG1  THR  58           HG1      THR  58 -12.354   1.725  -3.360
  428   HG21  THR  58          HG21      THR  58  -8.634   0.269  -3.088
  429   HG22  THR  58          HG22      THR  58  -8.938   1.435  -4.376
  430   HG23  THR  58          HG23      THR  58  -9.809  -0.100  -4.351
  431    H    GLU  59           HN       GLU  59 -10.045  -1.941  -1.597
  432    HA   GLU  59           HA       GLU  59  -8.929  -1.440   1.011
  433    HB2  GLU  59           HB2      GLU  59  -9.822  -3.672   0.080
  434    HB3  GLU  59           HB1      GLU  59  -8.320  -3.775  -0.822
  435    HG2  GLU  59           HG2      GLU  59  -8.599  -3.726   2.182
  436    HG3  GLU  59           HG1      GLU  59  -8.287  -5.138   1.187
  437    H    GLY  60           HN       GLY  60  -6.886  -0.477   1.326
  438    HA2  GLY  60           HA2      GLY  60  -5.176  -0.317  -1.080
  439    HA3  GLY  60           HA1      GLY  60  -5.326   0.985   0.094
  440    H    SER  61           HN       SER  61  -3.608  -1.748  -0.811
  441    HA   SER  61           HA       SER  61  -2.457  -2.205   1.812
  442    HB2  SER  61           HB2      SER  61  -2.875  -4.158   0.426
  443    HB3  SER  61           HB1      SER  61  -1.918  -3.477  -0.887
  444    HG   SER  61           HG       SER  61  -0.278  -3.458   1.098
  445    H    GLY  62           HN       GLY  62  -1.945  -0.140  -0.791
  446    HA2  GLY  62           HA2      GLY  62  -0.168   1.571  -0.120
  447    HA3  GLY  62           HA1      GLY  62   0.907   0.177  -0.129
  448    H    GLY  63           HN       GLY  63   1.958   1.796  -1.717
  449    HA2  GLY  63           HA2      GLY  63   0.713   1.656  -4.378
  450    HA3  GLY  63           HA1      GLY  63   2.033   2.723  -3.914
  451    H    ALA  64           HN       ALA  64   3.671   0.811  -2.657
  452    HA   ALA  64           HA       ALA  64   4.262  -1.139  -4.764
  453    HB1  ALA  64           HB1      ALA  64   6.621  -0.557  -4.796
  454    HB2  ALA  64           HB2      ALA  64   6.339   0.724  -3.618
  455    HB3  ALA  64           HB3      ALA  64   5.644   0.846  -5.234
  456    H    GLY  65           HN       GLY  65   5.186   0.101  -1.577
  457    HA2  GLY  65           HA2      GLY  65   4.947  -1.245   0.384
  458    HA3  GLY  65           HA1      GLY  65   5.214  -2.674  -0.606
  459    H    GLY  66           HN       GLY  66   6.768  -3.247   1.038
  460    HA2  GLY  66           HA2      GLY  66   9.173  -1.610   1.206
  461    HA3  GLY  66           HA1      GLY  66   8.809  -3.024   2.176
  462    H    GLN  67           HN       GLN  67   8.610  -2.979  -1.324
  463    HA   GLN  67           HA       GLN  67  10.528  -5.144  -1.483
  464    HB2  GLN  67           HB2      GLN  67   9.214  -3.614  -3.763
  465    HB3  GLN  67           HB1      GLN  67  10.012  -5.203  -3.854
  466    HG2  GLN  67           HG2      GLN  67   7.471  -4.579  -2.353
  467    HG3  GLN  67           HG1      GLN  67   7.586  -5.396  -3.908
  468   HE21  GLN  67          HE21      GLN  67   6.465  -6.286  -1.352
  469   HE22  GLN  67          HE22      GLN  67   7.283  -7.770  -0.984
  470    H    GLY  68           HN       GLY  68  12.620  -4.535  -1.167
  471    HA2  GLY  68           HA2      GLY  68  13.766  -2.657  -3.036
  472    HA3  GLY  68           HA1      GLY  68  13.765  -2.090  -1.377
  473    H    MET  69           HN       MET  69  15.961  -2.867  -3.298
  474    HA   MET  69           HA       MET  69  17.366  -4.733  -1.483
  475    HB2  MET  69           HB2      MET  69  18.537  -5.654  -3.437
  476    HB3  MET  69           HB1      MET  69  16.794  -5.860  -3.597
  477    HG2  MET  69           HG2      MET  69  16.678  -3.971  -5.106
  478    HG3  MET  69           HG1      MET  69  18.402  -3.669  -4.899
  479    HE1  MET  69           HE1      MET  69  20.005  -6.783  -6.617
  480    HE2  MET  69           HE2      MET  69  19.572  -6.668  -4.912
  481    HE3  MET  69           HE3      MET  69  20.292  -5.284  -5.734
  482    H    ILE  70           HN       ILE  70  17.164  -1.700  -2.144
  483    HA   ILE  70           HA       ILE  70  20.019  -1.172  -1.982
  484    HB   ILE  70           HB       ILE  70  18.238   0.126  -4.076
  485   HG12  ILE  70          HG12      ILE  70  20.764  -1.518  -4.381
  486   HG13  ILE  70          HG11      ILE  70  19.127  -2.075  -4.719
  487   HG21  ILE  70          HG21      ILE  70  20.170   1.505  -4.705
  488   HG22  ILE  70          HG22      ILE  70  21.116   0.801  -3.397
  489   HG23  ILE  70          HG23      ILE  70  19.714   1.806  -3.024
  490   HD11  ILE  70          HD11      ILE  70  18.935  -0.363  -6.478
  491   HD12  ILE  70          HD12      ILE  70  20.252  -1.496  -6.780
  492   HD13  ILE  70          HD13      ILE  70  20.602   0.120  -6.164
  493    H    GLN  71           HN       GLN  71  19.888  -0.250   0.083
  494    HA   GLN  71           HA       GLN  71  17.909   1.889   0.394
  495    HB2  GLN  71           HB2      GLN  71  17.839   1.426   2.749
  496    HB3  GLN  71           HB1      GLN  71  17.597  -0.084   1.886
  497    HG2  GLN  71           HG2      GLN  71  19.917  -0.702   2.283
  498    HG3  GLN  71           HG1      GLN  71  20.193   0.829   3.114
  499   HE21  GLN  71          HE21      GLN  71  19.285   1.161   5.142
  500   HE22  GLN  71          HE22      GLN  71  18.734  -0.155   6.122
  501    H    GLU  72           HN       GLU  72  20.898   1.563  -0.396
  502    HA   GLU  72           HA       GLU  72  22.345   3.185   1.417
  503    HB2  GLU  72           HB2      GLU  72  24.100   3.240  -0.221
  504    HB3  GLU  72           HB1      GLU  72  23.421   1.625  -0.197
  505    HG2  GLU  72           HG2      GLU  72  22.226   2.035  -2.240
  506    HG3  GLU  72           HG1      GLU  72  22.714   3.724  -2.222
  507    HA   PRO  73           HA       PRO  73  20.891   7.153  -0.045
  508    HB2  PRO  73           HB2      PRO  73  22.142   8.709   1.735
  509    HB3  PRO  73           HB1      PRO  73  20.950   7.485   2.327
  510    HG2  PRO  73           HG2      PRO  73  23.953   7.289   2.153
  511    HG3  PRO  73           HG1      PRO  73  22.899   6.949   3.542
  512    HD2  PRO  73           HD2      PRO  73  23.819   5.008   1.835
  513    HD3  PRO  73           HD1      PRO  73  22.261   4.893   2.720
  514    H    ALA  74           HN       ALA  74  21.744   9.060  -1.071
  515    HA   ALA  74           HA       ALA  74  24.363   8.675  -2.294
  516    HB1  ALA  74           HB1      ALA  74  23.659  10.353  -3.901
  517    HB2  ALA  74           HB2      ALA  74  22.194  10.655  -2.965
  518    HB3  ALA  74           HB3      ALA  74  22.434   9.092  -3.746
  519    H    LEU  75           HN       LEU  75  25.424  10.938  -2.848
  520    HA   LEU  75           HA       LEU  75  26.355  11.939  -0.369
  521    HB2  LEU  75           HB2      LEU  75  26.797  12.870  -3.195
  522    HB3  LEU  75           HB1      LEU  75  27.518  13.665  -1.821
  523    HG   LEU  75           HG       LEU  75  29.173  12.263  -2.747
  524   HD11  LEU  75          HD11      LEU  75  29.686  10.757  -0.920
  525   HD12  LEU  75          HD12      LEU  75  28.019  10.850  -0.350
  526   HD13  LEU  75          HD13      LEU  75  29.048  12.283  -0.309
  527   HD21  LEU  75          HD21      LEU  75  28.863   9.864  -3.119
  528   HD22  LEU  75          HD22      LEU  75  27.735  10.820  -4.077
  529   HD23  LEU  75          HD23      LEU  75  27.176  10.003  -2.618
  530    HA   PRO  76           HA       PRO  76  23.289  15.199   0.139
  531    HB2  PRO  76           HB2      PRO  76  25.249  16.492   1.949
  532    HB3  PRO  76           HB1      PRO  76  23.633  15.901   2.341
  533    HG2  PRO  76           HG2      PRO  76  25.815  14.656   3.255
  534    HG3  PRO  76           HG1      PRO  76  24.370  13.725   2.701
  535    HD2  PRO  76           HD2      PRO  76  26.949  14.283   1.173
  536    HD3  PRO  76           HD1      PRO  76  26.067  12.752   1.372
  537    HA   PRO  77           HA       PRO  77  24.558  18.366  -2.729
  538    HB2  PRO  77           HB2      PRO  77  23.065  20.097  -0.765
  539    HB3  PRO  77           HB1      PRO  77  22.980  20.105  -2.535
  540    HG2  PRO  77           HG2      PRO  77  21.069  18.896  -1.231
  541    HG3  PRO  77           HG1      PRO  77  21.835  18.066  -2.605
  542    HD2  PRO  77           HD2      PRO  77  22.258  17.600   0.350
  543    HD3  PRO  77           HD1      PRO  77  22.109  16.409  -0.996
  544    H    GLY  78           HN       GLY  78  26.430  19.405  -2.867
  545    HA2  GLY  78           HA2      GLY  78  28.073  20.952  -2.131
  546    HA3  GLY  78           HA1      GLY  78  27.479  20.780  -0.488
  547    H    TRP  79           HN       TRP  79  27.552  17.765  -0.742
  548    HA   TRP  79           HA       TRP  79  30.423  17.457  -0.155
  549    HB2  TRP  79           HB2      TRP  79  28.051  15.593   0.159
  550    HB3  TRP  79           HB1      TRP  79  29.705  15.058   0.383
  551    HD1  TRP  79           HD1      TRP  79  27.177  17.547   1.929
  552    HE1  TRP  79           HE1      TRP  79  27.793  17.881   4.413
  553    HE3  TRP  79           HE3      TRP  79  31.504  14.804   2.066
  554    HZ2  TRP  79           HZ2      TRP  79  29.842  17.077   6.184
  555    HZ3  TRP  79           HZ3      TRP  79  32.727  14.641   4.192
  556    HH2  TRP  79           HH2      TRP  79  31.922  15.754   6.207
  557    H    GLU  80           HN       GLU  80  31.843  16.315  -1.485
  558    HA   GLU  80           HA       GLU  80  30.667  15.056  -3.863
  559    HB2  GLU  80           HB2      GLU  80  32.793  17.074  -3.642
  560    HB3  GLU  80           HB1      GLU  80  33.173  15.725  -4.699
  561    HG2  GLU  80           HG2      GLU  80  30.752  17.499  -4.917
  562    HG3  GLU  80           HG1      GLU  80  32.194  17.572  -5.934
  563    H    MET  81           HN       MET  81  31.564  13.203  -4.598
  564    HA   MET  81           HA       MET  81  33.419  11.876  -2.744
  565    HB2  MET  81           HB2      MET  81  31.174  10.849  -2.708
  566    HB3  MET  81           HB1      MET  81  31.249  10.631  -4.474
  567    HG2  MET  81           HG2      MET  81  33.182   9.140  -4.163
  568    HG3  MET  81           HG1      MET  81  33.027   9.322  -2.417
  569    HE1  MET  81           HE1      MET  81  30.059   9.045  -5.034
  570    HE2  MET  81           HE2      MET  81  29.860   7.294  -5.097
  571    HE3  MET  81           HE3      MET  81  31.343   8.034  -5.700
  572    H    LYS  82           HN       LYS  82  35.405  11.652  -3.684
  573    HA   LYS  82           HA       LYS  82  35.475  11.051  -6.540
  574    HB2  LYS  82           HB2      LYS  82  37.310  13.172  -5.419
  575    HB3  LYS  82           HB1      LYS  82  37.028  12.764  -7.099
  576    HG2  LYS  82           HG2      LYS  82  34.705  13.644  -6.878
  577    HG3  LYS  82           HG1      LYS  82  35.132  14.156  -5.215
  578    HD2  LYS  82           HD2      LYS  82  36.929  15.555  -6.111
  579    HD3  LYS  82           HD1      LYS  82  36.518  15.049  -7.750
  580    HE2  LYS  82           HE2      LYS  82  34.625  16.482  -5.892
  581    HE3  LYS  82           HE1      LYS  82  35.627  17.290  -7.093
  582    HZ1  LYS  82           HZ1      LYS  82  33.592  17.015  -8.134
  583    HZ2  LYS  82           HZ2      LYS  82  33.353  15.451  -7.529
  584    HZ3  LYS  82           HZ3      LYS  82  34.510  15.725  -8.747
  585    H    TYR  83           HN       TYR  83  37.534  10.129  -7.228
  586    HA   TYR  83           HA       TYR  83  39.015   8.937  -4.968
  587    HB2  TYR  83           HB2      TYR  83  38.414   7.610  -7.649
  588    HB3  TYR  83           HB1      TYR  83  39.203   6.840  -6.246
  589    HD1  TYR  83           HD1      TYR  83  37.845   6.223  -4.273
  590    HD2  TYR  83           HD2      TYR  83  36.032   7.838  -7.771
  591    HE1  TYR  83           HE1      TYR  83  35.646   5.431  -3.500
  592    HE2  TYR  83           HE2      TYR  83  33.833   7.053  -7.001
  593    HH   TYR  83           HH       TYR  83  32.915   5.321  -5.509
  594    H    THR  84           HN       THR  84  41.257   8.557  -5.330
  595    HA   THR  84           HA       THR  84  42.424  10.226  -7.399
  596    HB   THR  84           HB       THR  84  44.555   9.842  -6.360
  597    HG1  THR  84           HG1      THR  84  44.868   8.236  -4.807
  598   HG21  THR  84          HG21      THR  84  42.421  10.073  -4.238
  599   HG22  THR  84          HG22      THR  84  43.192  11.390  -5.121
  600   HG23  THR  84          HG23      THR  84  44.132  10.421  -3.989
  601    H    SER  85           HN       SER  85  44.427   9.095  -8.556
  602    HA   SER  85           HA       SER  85  43.233   6.971 -10.078
  603    HB2  SER  85           HB2      SER  85  45.941   8.135 -10.396
  604    HB3  SER  85           HB1      SER  85  45.021   7.268 -11.608
  605    HG   SER  85           HG       SER  85  43.552   9.305 -10.705
  606    H    GLU  86           HN       GLU  86  44.294   6.610  -7.231
  607    HA   GLU  86           HA       GLU  86  45.976   4.222  -7.785
  608    HB2  GLU  86           HB2      GLU  86  46.132   6.127  -5.426
  609    HB3  GLU  86           HB1      GLU  86  47.074   4.650  -5.585
  610    HG2  GLU  86           HG2      GLU  86  48.250   5.547  -7.480
  611    HG3  GLU  86           HG1      GLU  86  47.194   6.958  -7.514
  612    H    GLY  87           HN       GLY  87  43.003   5.191  -6.894
  613    HA2  GLY  87           HA2      GLY  87  41.309   3.857  -6.023
  614    HA3  GLY  87           HA1      GLY  87  42.526   2.786  -5.346
  615    H    VAL  88           HN       VAL  88  43.127   6.047  -4.643
  616    HA   VAL  88           HA       VAL  88  42.340   5.617  -1.877
  617    HB   VAL  88           HB       VAL  88  43.846   7.922  -3.135
  618   HG11  VAL  88          HG11      VAL  88  44.443   8.538  -0.852
  619   HG12  VAL  88          HG12      VAL  88  43.440   7.227  -0.227
  620   HG13  VAL  88          HG13      VAL  88  42.696   8.576  -1.084
  621   HG21  VAL  88          HG21      VAL  88  45.835   6.924  -2.115
  622   HG22  VAL  88          HG22      VAL  88  45.087   5.823  -3.271
  623   HG23  VAL  88          HG23      VAL  88  44.866   5.568  -1.541
  624    H    ARG  89           HN       ARG  89  40.579   6.456  -1.006
  625    HA   ARG  89           HA       ARG  89  38.814   8.067  -2.689
  626    HB2  ARG  89           HB2      ARG  89  38.152   5.900  -1.487
  627    HB3  ARG  89           HB1      ARG  89  38.187   6.840  -0.007
  628    HG2  ARG  89           HG2      ARG  89  36.457   8.319  -0.915
  629    HG3  ARG  89           HG1      ARG  89  36.419   7.346  -2.388
  630    HD2  ARG  89           HD2      ARG  89  36.062   5.397  -0.599
  631    HD3  ARG  89           HD1      ARG  89  35.387   6.734   0.329
  632    HE   ARG  89           HE       ARG  89  34.283   6.804  -2.237
  633   HH11  ARG  89          HH11      ARG  89  34.175   4.842   0.675
  634   HH12  ARG  89          HH12      ARG  89  32.618   4.173   0.295
  635   HH21  ARG  89          HH21      ARG  89  32.236   5.897  -2.739
  636   HH22  ARG  89          HH22      ARG  89  31.526   4.750  -1.645
  637    H    TYR  90           HN       TYR  90  38.606  10.229  -2.371
  638    HA   TYR  90           HA       TYR  90  39.084  11.208   0.349
  639    HB2  TYR  90           HB2      TYR  90  40.200  13.202  -0.409
  640    HB3  TYR  90           HB1      TYR  90  41.042  11.811  -1.039
  641    HD1  TYR  90           HD1      TYR  90  40.696  11.191  -3.464
  642    HD2  TYR  90           HD2      TYR  90  39.443  14.918  -1.843
  643    HE1  TYR  90           HE1      TYR  90  40.530  12.107  -5.734
  644    HE2  TYR  90           HE2      TYR  90  39.283  15.858  -4.115
  645    HH   TYR  90           HH       TYR  90  39.292  13.952  -6.884
  646    H    PHE  91           HN       PHE  91  37.847  13.178   0.888
  647    HA   PHE  91           HA       PHE  91  35.504  13.465  -0.868
  648    HB2  PHE  91           HB2      PHE  91  35.574  13.321   2.149
  649    HB3  PHE  91           HB1      PHE  91  34.237  14.038   1.274
  650    HD1  PHE  91           HD1      PHE  91  32.461  12.746   0.633
  651    HD2  PHE  91           HD2      PHE  91  36.185  10.832   1.422
  652    HE1  PHE  91           HE1      PHE  91  31.397  10.548   0.343
  653    HE2  PHE  91           HE2      PHE  91  35.123   8.640   1.128
  654    HZ   PHE  91           HZ       PHE  91  32.732   8.495   0.586
  655    H    VAL  92           HN       VAL  92  34.643  15.522  -1.055
  656    HA   VAL  92           HA       VAL  92  36.478  17.658  -0.204
  657    HB   VAL  92           HB       VAL  92  34.677  17.653  -2.631
  658   HG11  VAL  92          HG11      VAL  92  35.087  19.884  -1.747
  659   HG12  VAL  92          HG12      VAL  92  35.914  19.658  -3.287
  660   HG13  VAL  92          HG13      VAL  92  36.825  19.594  -1.777
  661   HG21  VAL  92          HG21      VAL  92  37.665  17.264  -2.468
  662   HG22  VAL  92          HG22      VAL  92  36.722  17.426  -3.950
  663   HG23  VAL  92          HG23      VAL  92  36.473  16.035  -2.898
  664    H    ASP  93           HN       ASP  93  35.620  18.779   1.435
  665    HA   ASP  93           HA       ASP  93  32.730  19.099   1.727
  666    HB2  ASP  93           HB2      ASP  93  35.141  19.898   3.352
  667    HB3  ASP  93           HB1      ASP  93  33.667  20.847   3.528
  668    H    HIS  94           HN       HIS  94  32.109  20.278  -0.170
  669    HA   HIS  94           HA       HIS  94  33.578  22.616  -0.935
  670    HB2  HIS  94           HB2      HIS  94  32.213  21.099  -2.474
  671    HB3  HIS  94           HB1      HIS  94  30.791  21.939  -1.868
  672    HD1  HIS  94           HD1      HIS  94  30.550  22.605  -4.475
  673    HD2  HIS  94           HD2      HIS  94  33.759  24.307  -2.446
  674    HE1  HIS  94           HE1      HIS  94  31.282  24.564  -5.881
  675    HE2  HIS  94           HE2      HIS  94  33.340  25.458  -4.723
  676    H    ASN  95           HN       ASN  95  31.515  22.097   1.572
  677    HA   ASN  95           HA       ASN  95  30.071  24.571   1.540
  678    HB2  ASN  95           HB2      ASN  95  29.540  23.998   3.929
  679    HB3  ASN  95           HB1      ASN  95  29.142  22.711   2.796
  680   HD21  ASN  95          HD21      ASN  95  30.284  20.778   2.869
  681   HD22  ASN  95          HD22      ASN  95  31.349  20.369   4.176
  682    H    THR  96           HN       THR  96  32.916  23.399   3.313
  683    HA   THR  96           HA       THR  96  33.541  26.157   4.069
  684    HB   THR  96           HB       THR  96  35.344  24.825   5.463
  685    HG1  THR  96           HG1      THR  96  33.323  22.851   5.450
  686   HG21  THR  96          HG21      THR  96  32.402  24.873   6.166
  687   HG22  THR  96          HG22      THR  96  33.566  26.167   6.452
  688   HG23  THR  96          HG23      THR  96  33.720  24.638   7.315
  689    H    ARG  97           HN       ARG  97  34.286  23.891   1.779
  690    HA   ARG  97           HA       ARG  97  35.831  23.711   0.138
  691    HB2  ARG  97           HB2      ARG  97  36.339  26.495   1.056
  692    HB3  ARG  97           HB1      ARG  97  37.483  25.746  -0.051
  693    HG2  ARG  97           HG2      ARG  97  35.667  25.276  -1.610
  694    HG3  ARG  97           HG1      ARG  97  34.530  26.042  -0.503
  695    HD2  ARG  97           HD2      ARG  97  36.915  27.461  -1.661
  696    HD3  ARG  97           HD1      ARG  97  35.316  27.489  -2.405
  697    HE   ARG  97           HE       ARG  97  34.667  28.363  -0.025
  698   HH11  ARG  97          HH11      ARG  97  37.580  29.103  -1.822
  699   HH12  ARG  97          HH12      ARG  97  37.681  30.735  -1.223
  700   HH21  ARG  97          HH21      ARG  97  34.834  30.490   0.814
  701   HH22  ARG  97          HH22      ARG  97  36.135  31.512   0.284
  702    H    THR  98           HN       THR  98  36.575  21.958   1.354
  703    HA   THR  98           HA       THR  98  39.415  22.104   1.896
  704    HB   THR  98           HB       THR  98  38.370  22.791   4.093
  705    HG1  THR  98           HG1      THR  98  39.740  21.462   5.261
  706   HG21  THR  98          HG21      THR  98  37.255  21.050   5.448
  707   HG22  THR  98          HG22      THR  98  37.295  19.959   4.062
  708   HG23  THR  98          HG23      THR  98  36.328  21.430   3.992
  709    H    THR  99           HN       THR  99  40.155  19.812   2.618
  710    HA   THR  99           HA       THR  99  38.479  17.803   1.230
  711    HB   THR  99           HB       THR  99  40.710  16.668   0.625
  712    HG1  THR  99           HG1      THR  99  41.802  18.241   2.180
  713   HG21  THR  99          HG21      THR  99  40.123  19.402  -0.593
  714   HG22  THR  99          HG22      THR  99  39.412  17.873  -1.112
  715   HG23  THR  99          HG23      THR  99  41.140  18.173  -1.343
  716    H    THR 100           HN       THR 100  38.418  15.721   2.211
  717    HA   THR 100           HA       THR 100  40.032  15.295   4.585
  718    HB   THR 100           HB       THR 100  38.050  16.476   5.466
  719    HG1  THR 100           HG1      THR 100  37.730  15.057   7.100
  720   HG21  THR 100          HG21      THR 100  36.497  14.187   4.244
  721   HG22  THR 100          HG22      THR 100  36.396  15.889   3.794
  722   HG23  THR 100          HG23      THR 100  35.827  15.361   5.378
  723    H    PHE 101           HN       PHE 101  39.922  13.082   5.352
  724    HA   PHE 101           HA       PHE 101  39.023  11.207   3.258
  725    HB2  PHE 101           HB2      PHE 101  41.408  11.117   5.134
  726    HB3  PHE 101           HB1      PHE 101  40.801   9.656   4.253
  727    HD1  PHE 101           HD1      PHE 101  41.664   9.180   2.206
  728    HD2  PHE 101           HD2      PHE 101  41.958  13.173   3.633
  729    HE1  PHE 101           HE1      PHE 101  43.014   9.770   0.246
  730    HE2  PHE 101           HE2      PHE 101  43.312  13.779   1.667
  731    HZ   PHE 101           HZ       PHE 101  43.841  12.076  -0.030
  732    H    LYS 102           HN       LYS 102  37.023  10.705   4.091
  733    HA   LYS 102           HA       LYS 102  37.077   9.141   6.544
  734    HB2  LYS 102           HB2      LYS 102  36.412  11.439   7.204
  735    HB3  LYS 102           HB1      LYS 102  35.051  11.335   6.097
  736    HG2  LYS 102           HG2      LYS 102  34.096   9.531   7.384
  737    HG3  LYS 102           HG1      LYS 102  35.501   9.520   8.453
  738    HD2  LYS 102           HD2      LYS 102  33.707  10.708   9.535
  739    HD3  LYS 102           HD1      LYS 102  34.968  11.858   9.090
  740    HE2  LYS 102           HE2      LYS 102  33.683  12.531   7.134
  741    HE3  LYS 102           HE1      LYS 102  32.439  11.346   7.531
  742    HZ1  LYS 102           HZ1      LYS 102  32.179  12.550   9.686
  743    HZ2  LYS 102           HZ2      LYS 102  31.674  13.409   8.319
  744    HZ3  LYS 102           HZ3      LYS 102  33.158  13.786   9.058
  745    H    ASP 103           HN       ASP 103  36.123   7.267   6.167
  746    HA   ASP 103           HA       ASP 103  34.084   7.116   4.051
  747    HB2  ASP 103           HB2      ASP 103  36.227   5.705   3.866
  748    HB3  ASP 103           HB1      ASP 103  35.581   4.766   5.210
  749    HA   PRO 104           HA       PRO 104  31.306   6.454   7.466
  750    HB2  PRO 104           HB2      PRO 104  29.047   6.035   6.048
  751    HB3  PRO 104           HB1      PRO 104  29.803   7.631   6.117
  752    HG2  PRO 104           HG2      PRO 104  29.969   5.552   3.972
  753    HG3  PRO 104           HG1      PRO 104  29.734   7.302   3.816
  754    HD2  PRO 104           HD2      PRO 104  32.146   6.076   3.469
  755    HD3  PRO 104           HD1      PRO 104  31.980   7.746   4.046
  756    H    ARG 105           HN       ARG 105  32.323   3.996   5.328
  757    HA   ARG 105           HA       ARG 105  30.634   2.002   6.698
  758    HB2  ARG 105           HB2      ARG 105  31.872   2.095   3.990
  759    HB3  ARG 105           HB1      ARG 105  31.650   0.526   4.746
  760    HG2  ARG 105           HG2      ARG 105  29.809   1.134   3.240
  761    HG3  ARG 105           HG1      ARG 105  29.266   0.891   4.897
  762    HD2  ARG 105           HD2      ARG 105  29.399   3.373   5.206
  763    HD3  ARG 105           HD1      ARG 105  29.722   3.509   3.476
  764    HE   ARG 105           HE       ARG 105  27.515   2.549   3.084
  765   HH11  ARG 105          HH11      ARG 105  28.175   3.786   6.304
  766   HH12  ARG 105          HH12      ARG 105  26.504   4.038   6.686
  767   HH21  ARG 105          HH21      ARG 105  25.327   2.875   3.591
  768   HH22  ARG 105          HH22      ARG 105  24.870   3.513   5.142
  769    HA   PRO 106           HA       PRO 106  34.523   1.130   8.926
  770    HB2  PRO 106           HB2      PRO 106  32.726  -0.964  10.071
  771    HB3  PRO 106           HB1      PRO 106  33.803   0.207  10.919
  772    HG2  PRO 106           HG2      PRO 106  31.133   0.510  10.850
  773    HG3  PRO 106           HG1      PRO 106  32.222   1.885  10.796
  774    HD2  PRO 106           HD2      PRO 106  30.616   0.697   8.674
  775    HD3  PRO 106           HD1      PRO 106  31.121   2.391   8.908
  776    H    GLY 107           HN       GLY 107  36.004  -0.053   7.874
  777    HA2  GLY 107           HA2      GLY 107  37.023  -2.100   7.344
  778    HA3  GLY 107           HA1      GLY 107  35.422  -2.869   7.294
  779    H    PHE 108           HN       PHE 108  34.288  -0.810   5.488
  780    HA   PHE 108           HA       PHE 108  33.735  -0.991   3.218
  781    HB2  PHE 108           HB2      PHE 108  35.426   0.252   1.848
  782    HB3  PHE 108           HB1      PHE 108  34.966   1.085   3.371
  783    HD1  PHE 108           HD1      PHE 108  36.613   1.358   5.154
  784    HD2  PHE 108           HD2      PHE 108  37.633  -0.646   1.530
  785    HE1  PHE 108           HE1      PHE 108  39.000   1.580   5.704
  786    HE2  PHE 108           HE2      PHE 108  40.016  -0.421   2.083
  787    HZ   PHE 108           HZ       PHE 108  40.707   0.692   4.165
  788    H    GLU 109           HN       GLU 109  34.540  -3.526   4.013
  789    HA   GLU 109           HA       GLU 109  35.426  -4.584   1.470
  790    HB2  GLU 109           HB2      GLU 109  37.545  -4.266   2.661
  791    HB3  GLU 109           HB1      GLU 109  36.932  -5.165   4.038
  792    HG2  GLU 109           HG2      GLU 109  38.429  -6.542   2.768
  793    HG3  GLU 109           HG1      GLU 109  36.790  -7.176   2.635
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1 -40.551   8.933   3.556
    2    H2   GLY   1           HT2      GLY   1 -40.555  10.574   3.132
    3    H3   GLY   1           HT3      GLY   1 -39.190   9.618   2.813
    4    HA2  GLY   1           HA1      GLY   1 -41.863   9.265   1.574
    5    HA3  GLY   1           HA2      GLY   1 -40.481  10.034   0.803
    6    H    SER   2           HN       SER   2 -40.262   8.571  -0.851
    7    HA   SER   2           HA       SER   2 -40.139   5.745  -0.409
    8    HB2  SER   2           HB2      SER   2 -39.188   7.314  -2.820
    9    HB3  SER   2           HB1      SER   2 -39.617   5.603  -2.763
   10    HG   SER   2           HG       SER   2 -41.777   6.356  -2.114
   11    H    HIS   3           HN       HIS   3 -38.075   4.616  -1.487
   12    HA   HIS   3           HA       HIS   3 -35.781   5.686   0.018
   13    HB2  HIS   3           HB2      HIS   3 -36.071   2.903  -1.135
   14    HB3  HIS   3           HB1      HIS   3 -34.864   3.457   0.019
   15    HD1  HIS   3           HD1      HIS   3 -37.558   1.333  -0.014
   16    HD2  HIS   3           HD2      HIS   3 -36.563   4.538   2.445
   17    HE1  HIS   3           HE1      HIS   3 -38.851   0.983   2.116
   18    HE2  HIS   3           HE2      HIS   3 -38.366   3.018   3.521
   19    H    MET   4           HN       MET   4 -33.624   5.077  -1.047
   20    HA   MET   4           HA       MET   4 -33.831   5.325  -3.975
   21    HB2  MET   4           HB2      MET   4 -32.705   7.291  -2.348
   22    HB3  MET   4           HB1      MET   4 -31.327   6.330  -2.881
   23    HG2  MET   4           HG2      MET   4 -31.636   8.148  -4.392
   24    HG3  MET   4           HG1      MET   4 -32.028   6.636  -5.209
   25    HE1  MET   4           HE1      MET   4 -32.794   9.524  -6.290
   26    HE2  MET   4           HE2      MET   4 -34.466   9.303  -6.802
   27    HE3  MET   4           HE3      MET   4 -33.266   8.062  -7.160
   28    H    GLN   5           HN       GLN   5 -32.144   4.212  -5.093
   29    HA   GLN   5           HA       GLN   5 -31.392   1.826  -3.624
   30    HB2  GLN   5           HB2      GLN   5 -32.426   1.578  -5.844
   31    HB3  GLN   5           HB1      GLN   5 -31.093   2.469  -6.564
   32    HG2  GLN   5           HG2      GLN   5 -29.546   0.701  -5.767
   33    HG3  GLN   5           HG1      GLN   5 -30.945  -0.208  -5.200
   34   HE21  GLN   5          HE21      GLN   5 -29.165   0.903  -7.961
   35   HE22  GLN   5          HE22      GLN   5 -29.961  -0.133  -9.135
   36    H    TYR   6           HN       TYR   6 -29.605   2.130  -2.432
   37    HA   TYR   6           HA       TYR   6 -27.382   3.588  -3.640
   38    HB2  TYR   6           HB2      TYR   6 -27.865   2.679  -0.784
   39    HB3  TYR   6           HB1      TYR   6 -26.254   3.145  -1.308
   40    HD1  TYR   6           HD1      TYR   6 -25.786   5.468  -1.985
   41    HD2  TYR   6           HD2      TYR   6 -29.607   4.342  -0.479
   42    HE1  TYR   6           HE1      TYR   6 -26.340   7.837  -1.646
   43    HE2  TYR   6           HE2      TYR   6 -30.161   6.708  -0.123
   44    HH   TYR   6           HH       TYR   6 -29.013   8.857   0.182
   45    H    LYS   7           HN       LYS   7 -25.377   2.684  -3.968
   46    HA   LYS   7           HA       LYS   7 -25.424  -0.255  -4.287
   47    HB2  LYS   7           HB2      LYS   7 -25.714   1.406  -6.346
   48    HB3  LYS   7           HB1      LYS   7 -23.967   1.544  -6.197
   49    HG2  LYS   7           HG2      LYS   7 -25.474  -1.010  -6.678
   50    HG3  LYS   7           HG1      LYS   7 -24.649  -0.051  -7.903
   51    HD2  LYS   7           HD2      LYS   7 -22.521  -0.447  -6.805
   52    HD3  LYS   7           HD1      LYS   7 -23.337  -1.391  -5.552
   53    HE2  LYS   7           HE2      LYS   7 -23.206  -2.035  -8.495
   54    HE3  LYS   7           HE1      LYS   7 -22.359  -2.875  -7.196
   55    HZ1  LYS   7           HZ1      LYS   7 -24.235  -4.176  -7.717
   56    HZ2  LYS   7           HZ2      LYS   7 -25.277  -2.843  -7.743
   57    HZ3  LYS   7           HZ3      LYS   7 -24.636  -3.383  -6.273
   58    H    LEU   8           HN       LEU   8 -23.473  -1.328  -3.903
   59    HA   LEU   8           HA       LEU   8 -21.117   0.310  -3.234
   60    HB2  LEU   8           HB2      LEU   8 -22.284  -0.160  -1.080
   61    HB3  LEU   8           HB1      LEU   8 -22.239  -1.858  -1.452
   62    HG   LEU   8           HG       LEU   8 -19.659  -1.531  -1.520
   63   HD11  LEU   8          HD11      LEU   8 -19.640   0.890  -1.383
   64   HD12  LEU   8          HD12      LEU   8 -18.862   0.183   0.033
   65   HD13  LEU   8          HD13      LEU   8 -20.497   0.829   0.157
   66   HD21  LEU   8          HD21      LEU   8 -19.634  -1.829   0.992
   67   HD22  LEU   8          HD22      LEU   8 -20.614  -2.961   0.059
   68   HD23  LEU   8          HD23      LEU   8 -21.387  -1.632   0.919
   69    H    ILE   9           HN       ILE   9 -19.172  -0.619  -3.639
   70    HA   ILE   9           HA       ILE   9 -19.181  -3.365  -4.693
   71    HB   ILE   9           HB       ILE   9 -17.619  -1.018  -5.799
   72   HG12  ILE   9          HG12      ILE   9 -19.668  -2.814  -7.167
   73   HG13  ILE   9          HG11      ILE   9 -20.027  -1.157  -6.555
   74   HG21  ILE   9          HG21      ILE   9 -17.468  -3.937  -6.536
   75   HG22  ILE   9          HG22      ILE   9 -16.202  -2.971  -5.774
   76   HG23  ILE   9          HG23      ILE   9 -16.701  -2.623  -7.430
   77   HD11  ILE   9          HD11      ILE   9 -18.049  -1.894  -8.733
   78   HD12  ILE   9          HD12      ILE   9 -18.356  -0.265  -8.131
   79   HD13  ILE   9          HD13      ILE   9 -19.634  -1.153  -8.963
   80    H    LEU  10           HN       LEU  10 -17.744  -4.663  -3.670
   81    HA   LEU  10           HA       LEU  10 -15.951  -3.347  -1.772
   82    HB2  LEU  10           HB2      LEU  10 -16.603  -6.286  -1.994
   83    HB3  LEU  10           HB1      LEU  10 -15.552  -5.569  -0.800
   84    HG   LEU  10           HG       LEU  10 -17.477  -5.919   0.398
   85   HD11  LEU  10          HD11      LEU  10 -16.777  -3.602   0.628
   86   HD12  LEU  10          HD12      LEU  10 -18.502  -3.840   0.909
   87   HD13  LEU  10          HD13      LEU  10 -17.956  -3.146  -0.614
   88   HD21  LEU  10          HD21      LEU  10 -19.732  -5.648  -0.369
   89   HD22  LEU  10          HD22      LEU  10 -18.844  -6.614  -1.547
   90   HD23  LEU  10          HD23      LEU  10 -19.176  -4.914  -1.870
   91    H    ASN  11           HN       ASN  11 -14.231  -2.682  -2.873
   92    HA   ASN  11           HA       ASN  11 -12.978  -4.495  -4.767
   93    HB2  ASN  11           HB2      ASN  11 -11.794  -1.864  -3.867
   94    HB3  ASN  11           HB1      ASN  11 -11.594  -2.686  -5.410
   95   HD21  ASN  11          HD21      ASN  11 -13.571  -0.584  -3.531
   96   HD22  ASN  11          HD22      ASN  11 -14.624  -0.111  -4.813
   97    H    GLY  12           HN       GLY  12 -12.423  -6.148  -3.347
   98    HA2  GLY  12           HA2      GLY  12 -10.110  -5.527  -1.622
   99    HA3  GLY  12           HA1      GLY  12 -11.384  -6.629  -1.071
  100    H    LYS  13           HN       LYS  13  -8.355  -6.593  -2.211
  101    HA   LYS  13           HA       LYS  13  -8.034  -8.191  -4.356
  102    HB2  LYS  13           HB2      LYS  13  -6.428  -8.265  -1.805
  103    HB3  LYS  13           HB1      LYS  13  -5.881  -8.870  -3.363
  104    HG2  LYS  13           HG2      LYS  13  -6.662  -6.010  -2.844
  105    HG3  LYS  13           HG1      LYS  13  -5.015  -6.616  -2.775
  106    HD2  LYS  13           HD2      LYS  13  -5.327  -7.424  -5.138
  107    HD3  LYS  13           HD1      LYS  13  -6.839  -6.518  -5.161
  108    HE2  LYS  13           HE2      LYS  13  -5.615  -4.455  -4.681
  109    HE3  LYS  13           HE1      LYS  13  -4.101  -5.359  -4.648
  110    HZ1  LYS  13           HZ1      LYS  13  -4.698  -6.044  -7.002
  111    HZ2  LYS  13           HZ2      LYS  13  -4.197  -4.442  -6.772
  112    HZ3  LYS  13           HZ3      LYS  13  -5.845  -4.790  -6.966
  113    H    THR  14           HN       THR  14  -8.746  -9.366  -1.087
  114    HA   THR  14           HA       THR  14  -8.460 -12.119  -1.961
  115    HB   THR  14           HB       THR  14  -9.392 -11.024   0.707
  116    HG1  THR  14           HG1      THR  14  -6.862 -11.924  -0.263
  117   HG21  THR  14          HG21      THR  14  -8.980 -13.265   1.577
  118   HG22  THR  14          HG22      THR  14  -8.508 -13.819  -0.029
  119   HG23  THR  14          HG23      THR  14 -10.174 -13.331   0.279
  120    H    LEU  15           HN       LEU  15 -11.148  -9.967  -1.002
  121    HA   LEU  15           HA       LEU  15 -12.996 -11.830  -2.314
  122    HB2  LEU  15           HB2      LEU  15 -13.103 -12.048   0.135
  123    HB3  LEU  15           HB1      LEU  15 -13.392 -10.332   0.257
  124    HG   LEU  15           HG       LEU  15 -15.462 -10.729  -1.166
  125   HD11  LEU  15          HD11      LEU  15 -15.028 -13.538  -0.166
  126   HD12  LEU  15          HD12      LEU  15 -14.836 -13.021  -1.840
  127   HD13  LEU  15          HD13      LEU  15 -16.420 -12.939  -1.071
  128   HD21  LEU  15          HD21      LEU  15 -15.278 -10.149   1.217
  129   HD22  LEU  15          HD22      LEU  15 -15.325 -11.867   1.604
  130   HD23  LEU  15          HD23      LEU  15 -16.716 -11.099   0.834
  131    H    LYS  16           HN       LYS  16 -13.855 -10.797  -4.014
  132    HA   LYS  16           HA       LYS  16 -14.462  -7.921  -3.732
  133    HB2  LYS  16           HB2      LYS  16 -14.048  -9.349  -6.370
  134    HB3  LYS  16           HB1      LYS  16 -14.145  -7.619  -6.103
  135    HG2  LYS  16           HG2      LYS  16 -11.909  -7.741  -6.309
  136    HG3  LYS  16           HG1      LYS  16 -11.961  -8.208  -4.610
  137    HD2  LYS  16           HD2      LYS  16 -10.557  -9.627  -6.045
  138    HD3  LYS  16           HD1      LYS  16 -11.824 -10.526  -5.206
  139    HE2  LYS  16           HE2      LYS  16 -13.167 -10.548  -7.228
  140    HE3  LYS  16           HE1      LYS  16 -11.982  -9.546  -8.060
  141    HZ1  LYS  16           HZ1      LYS  16 -11.424 -12.282  -7.025
  142    HZ2  LYS  16           HZ2      LYS  16 -10.399 -11.322  -7.981
  143    HZ3  LYS  16           HZ3      LYS  16 -11.841 -11.922  -8.629
  144    H    GLY  17           HN       GLY  17 -16.441  -7.205  -4.592
  145    HA2  GLY  17           HA2      GLY  17 -18.345  -8.800  -5.839
  146    HA3  GLY  17           HA1      GLY  17 -18.598  -8.957  -4.105
  147    H    GLU  18           HN       GLU  18 -20.723  -7.966  -4.906
  148    HA   GLU  18           HA       GLU  18 -20.664  -5.218  -4.155
  149    HB2  GLU  18           HB2      GLU  18 -21.845  -4.396  -6.258
  150    HB3  GLU  18           HB1      GLU  18 -20.122  -4.688  -6.378
  151    HG2  GLU  18           HG2      GLU  18 -21.013  -5.509  -8.359
  152    HG3  GLU  18           HG1      GLU  18 -20.719  -6.938  -7.379
  153    H    THR  19           HN       THR  19 -22.754  -4.292  -3.828
  154    HA   THR  19           HA       THR  19 -25.051  -6.043  -3.969
  155    HB   THR  19           HB       THR  19 -23.904  -6.785  -1.885
  156    HG1  THR  19           HG1      THR  19 -25.995  -7.138  -1.591
  157   HG21  THR  19          HG21      THR  19 -24.372  -3.913  -1.034
  158   HG22  THR  19          HG22      THR  19 -22.822  -4.752  -1.147
  159   HG23  THR  19          HG23      THR  19 -23.998  -5.219   0.086
  160    H    THR  20           HN       THR  20 -26.863  -4.832  -2.523
  161    HA   THR  20           HA       THR  20 -26.752  -1.946  -3.008
  162    HB   THR  20           HB       THR  20 -29.075  -2.068  -3.959
  163    HG1  THR  20           HG1      THR  20 -29.235  -4.397  -3.208
  164   HG21  THR  20          HG21      THR  20 -28.362  -2.835  -6.241
  165   HG22  THR  20          HG22      THR  20 -26.842  -3.366  -5.526
  166   HG23  THR  20          HG23      THR  20 -27.277  -1.657  -5.505
  167    H    THR  21           HN       THR  21 -28.578  -0.802  -1.902
  168    HA   THR  21           HA       THR  21 -30.188  -2.353  -0.058
  169    HB   THR  21           HB       THR  21 -27.983  -1.985   1.166
  170    HG1  THR  21           HG1      THR  21 -29.083  -1.627   3.073
  171   HG21  THR  21          HG21      THR  21 -28.993   0.881   1.149
  172   HG22  THR  21          HG22      THR  21 -27.472   0.312   0.464
  173   HG23  THR  21          HG23      THR  21 -27.720   0.287   2.213
  174    H    GLU  22           HN       GLU  22 -31.819  -1.047   1.014
  175    HA   GLU  22           HA       GLU  22 -32.611   1.253  -0.634
  176    HB2  GLU  22           HB2      GLU  22 -34.127  -0.438   1.366
  177    HB3  GLU  22           HB1      GLU  22 -34.809   0.961   0.554
  178    HG2  GLU  22           HG2      GLU  22 -33.731  -1.469  -0.884
  179    HG3  GLU  22           HG1      GLU  22 -35.461  -1.234  -0.422
  180    H    ALA  23           HN       ALA  23 -31.576   3.047   0.176
  181    HA   ALA  23           HA       ALA  23 -32.056   3.604   3.050
  182    HB1  ALA  23           HB1      ALA  23 -29.551   4.418   1.552
  183    HB2  ALA  23           HB2      ALA  23 -29.659   3.046   2.654
  184    HB3  ALA  23           HB3      ALA  23 -29.900   4.684   3.259
  185    H    VAL  24           HN       VAL  24 -32.231   5.940   3.555
  186    HA   VAL  24           HA       VAL  24 -33.278   7.400   1.232
  187    HB   VAL  24           HB       VAL  24 -34.583   8.710   2.850
  188   HG11  VAL  24          HG11      VAL  24 -35.575   6.755   1.838
  189   HG12  VAL  24          HG12      VAL  24 -36.126   6.917   3.504
  190   HG13  VAL  24          HG13      VAL  24 -34.890   5.726   3.096
  191   HG21  VAL  24          HG21      VAL  24 -34.703   8.036   5.190
  192   HG22  VAL  24          HG22      VAL  24 -33.065   8.539   4.770
  193   HG23  VAL  24          HG23      VAL  24 -33.451   6.824   4.917
  194    H    ASP  25           HN       ASP  25 -30.427   7.322   2.686
  195    HA   ASP  25           HA       ASP  25 -29.862  10.072   2.158
  196    HB2  ASP  25           HB2      ASP  25 -30.807  10.234   4.436
  197    HB3  ASP  25           HB1      ASP  25 -29.566   9.125   5.013
  198    H    ALA  26           HN       ALA  26 -27.572  10.591   2.428
  199    HA   ALA  26           HA       ALA  26 -25.932   8.483   1.434
  200    HB1  ALA  26           HB1      ALA  26 -24.188  10.174   1.329
  201    HB2  ALA  26           HB2      ALA  26 -25.149  11.254   2.340
  202    HB3  ALA  26           HB3      ALA  26 -25.710  10.832   0.720
  203    H    ALA  27           HN       ALA  27 -26.080  10.267   4.510
  204    HA   ALA  27           HA       ALA  27 -23.762   9.094   5.644
  205    HB1  ALA  27           HB1      ALA  27 -24.778  11.179   6.470
  206    HB2  ALA  27           HB2      ALA  27 -24.555   9.989   7.752
  207    HB3  ALA  27           HB3      ALA  27 -26.157  10.256   7.064
  208    H    THR  28           HN       THR  28 -27.171   8.243   5.667
  209    HA   THR  28           HA       THR  28 -27.032   6.093   7.503
  210    HB   THR  28           HB       THR  28 -28.962   6.302   5.177
  211    HG1  THR  28           HG1      THR  28 -29.092   7.528   7.764
  212   HG21  THR  28          HG21      THR  28 -29.042   4.185   6.427
  213   HG22  THR  28          HG22      THR  28 -30.501   5.137   6.707
  214   HG23  THR  28          HG23      THR  28 -29.237   5.076   7.936
  215    H    ALA  29           HN       ALA  29 -26.326   6.335   4.075
  216    HA   ALA  29           HA       ALA  29 -26.410   3.515   3.548
  217    HB1  ALA  29           HB1      ALA  29 -25.102   5.738   1.977
  218    HB2  ALA  29           HB2      ALA  29 -26.759   5.174   1.769
  219    HB3  ALA  29           HB3      ALA  29 -25.409   4.100   1.396
  220    H    GLU  30           HN       GLU  30 -23.947   5.911   4.294
  221    HA   GLU  30           HA       GLU  30 -21.688   4.267   4.046
  222    HB2  GLU  30           HB2      GLU  30 -21.973   6.881   4.481
  223    HB3  GLU  30           HB1      GLU  30 -21.820   6.372   6.156
  224    HG2  GLU  30           HG2      GLU  30 -19.682   5.197   5.485
  225    HG3  GLU  30           HG1      GLU  30 -19.811   6.075   3.959
  226    H    LYS  31           HN       LYS  31 -23.422   5.272   6.981
  227    HA   LYS  31           HA       LYS  31 -22.124   3.802   8.869
  228    HB2  LYS  31           HB2      LYS  31 -25.057   4.503   8.739
  229    HB3  LYS  31           HB1      LYS  31 -24.279   3.817  10.160
  230    HG2  LYS  31           HG2      LYS  31 -23.577   6.433   8.853
  231    HG3  LYS  31           HG1      LYS  31 -24.507   6.230  10.340
  232    HD2  LYS  31           HD2      LYS  31 -22.456   4.955  11.209
  233    HD3  LYS  31           HD1      LYS  31 -21.598   5.672   9.844
  234    HE2  LYS  31           HE2      LYS  31 -21.250   7.076  11.745
  235    HE3  LYS  31           HE1      LYS  31 -22.347   7.913  10.654
  236    HZ1  LYS  31           HZ1      LYS  31 -24.210   7.211  12.031
  237    HZ2  LYS  31           HZ2      LYS  31 -23.076   8.075  12.958
  238    HZ3  LYS  31           HZ3      LYS  31 -23.153   6.387  13.071
  239    H    VAL  32           HN       VAL  32 -24.869   2.629   6.894
  240    HA   VAL  32           HA       VAL  32 -25.049   0.132   8.267
  241    HB   VAL  32           HB       VAL  32 -26.110   0.952   5.563
  242   HG11  VAL  32          HG11      VAL  32 -25.874  -1.490   5.739
  243   HG12  VAL  32          HG12      VAL  32 -27.563  -0.989   5.689
  244   HG13  VAL  32          HG13      VAL  32 -26.832  -1.464   7.220
  245   HG21  VAL  32          HG21      VAL  32 -27.043   2.239   7.414
  246   HG22  VAL  32          HG22      VAL  32 -27.451   0.747   8.261
  247   HG23  VAL  32          HG23      VAL  32 -28.255   1.149   6.743
  248    H    PHE  33           HN       PHE  33 -23.628   1.086   5.148
  249    HA   PHE  33           HA       PHE  33 -22.765  -1.555   4.516
  250    HB2  PHE  33           HB2      PHE  33 -22.279   1.146   3.330
  251    HB3  PHE  33           HB1      PHE  33 -21.256  -0.190   2.850
  252    HD1  PHE  33           HD1      PHE  33 -23.455   1.600   1.360
  253    HD2  PHE  33           HD2      PHE  33 -23.306  -2.373   2.883
  254    HE1  PHE  33           HE1      PHE  33 -25.185   0.917  -0.255
  255    HE2  PHE  33           HE2      PHE  33 -25.038  -3.061   1.278
  256    HZ   PHE  33           HZ       PHE  33 -25.885  -1.409  -0.415
  257    H    LYS  34           HN       LYS  34 -21.399   0.977   6.462
  258    HA   LYS  34           HA       LYS  34 -18.709   0.103   6.268
  259    HB2  LYS  34           HB2      LYS  34 -20.201   1.796   8.249
  260    HB3  LYS  34           HB1      LYS  34 -18.527   1.395   8.511
  261    HG2  LYS  34           HG2      LYS  34 -18.223   2.315   6.093
  262    HG3  LYS  34           HG1      LYS  34 -19.760   3.125   6.430
  263    HD2  LYS  34           HD2      LYS  34 -17.987   4.650   7.018
  264    HD3  LYS  34           HD1      LYS  34 -18.743   4.066   8.503
  265    HE2  LYS  34           HE2      LYS  34 -16.957   2.574   8.949
  266    HE3  LYS  34           HE1      LYS  34 -16.290   2.774   7.332
  267    HZ1  LYS  34           HZ1      LYS  34 -16.318   4.801   9.505
  268    HZ2  LYS  34           HZ2      LYS  34 -15.800   5.106   7.917
  269    HZ3  LYS  34           HZ3      LYS  34 -14.967   3.990   8.885
  270    H    GLN  35           HN       GLN  35 -21.331  -0.561   8.533
  271    HA   GLN  35           HA       GLN  35 -19.982  -2.378  10.206
  272    HB2  GLN  35           HB2      GLN  35 -22.384  -1.220  10.277
  273    HB3  GLN  35           HB1      GLN  35 -22.896  -2.658   9.468
  274    HG2  GLN  35           HG2      GLN  35 -21.641  -2.651  12.227
  275    HG3  GLN  35           HG1      GLN  35 -23.356  -2.699  11.868
  276   HE21  GLN  35          HE21      GLN  35 -20.401  -4.532  11.858
  277   HE22  GLN  35          HE22      GLN  35 -21.142  -6.059  11.520
  278    H    TYR  36           HN       TYR  36 -21.884  -2.656   7.335
  279    HA   TYR  36           HA       TYR  36 -21.895  -5.409   6.929
  280    HB2  TYR  36           HB2      TYR  36 -23.324  -4.099   5.584
  281    HB3  TYR  36           HB1      TYR  36 -22.019  -3.037   5.093
  282    HD1  TYR  36           HD1      TYR  36 -21.194  -3.274   2.930
  283    HD2  TYR  36           HD2      TYR  36 -23.004  -6.592   4.851
  284    HE1  TYR  36           HE1      TYR  36 -20.945  -4.592   0.870
  285    HE2  TYR  36           HE2      TYR  36 -22.761  -7.940   2.811
  286    HH   TYR  36           HH       TYR  36 -20.833  -6.911   0.172
  287    H    ALA  37           HN       ALA  37 -19.600  -3.007   5.636
  288    HA   ALA  37           HA       ALA  37 -17.913  -4.941   4.418
  289    HB1  ALA  37           HB1      ALA  37 -16.366  -3.101   4.068
  290    HB2  ALA  37           HB2      ALA  37 -17.242  -2.114   5.237
  291    HB3  ALA  37           HB3      ALA  37 -18.014  -2.570   3.718
  292    H    ASN  38           HN       ASN  38 -17.999  -3.414   7.560
  293    HA   ASN  38           HA       ASN  38 -15.419  -4.079   8.450
  294    HB2  ASN  38           HB2      ASN  38 -16.912  -2.435   9.625
  295    HB3  ASN  38           HB1      ASN  38 -17.947  -3.766  10.131
  296   HD21  ASN  38          HD21      ASN  38 -15.154  -1.904  10.867
  297   HD22  ASN  38          HD22      ASN  38 -14.617  -2.851  12.276
  298    H    ASP  39           HN       ASP  39 -18.472  -5.843   8.600
  299    HA   ASP  39           HA       ASP  39 -17.534  -8.001  10.163
  300    HB2  ASP  39           HB2      ASP  39 -19.927  -7.515   9.850
  301    HB3  ASP  39           HB1      ASP  39 -19.796  -7.952   8.151
  302    H    ASN  40           HN       ASN  40 -17.193  -7.232   6.812
  303    HA   ASN  40           HA       ASN  40 -16.413  -9.951   6.109
  304    HB2  ASN  40           HB2      ASN  40 -17.050  -7.486   4.534
  305    HB3  ASN  40           HB1      ASN  40 -16.060  -8.740   3.804
  306   HD21  ASN  40          HD21      ASN  40 -19.237  -7.858   4.878
  307   HD22  ASN  40          HD22      ASN  40 -20.052  -9.285   4.226
  308    H    GLY  41           HN       GLY  41 -15.048  -7.281   7.440
  309    HA2  GLY  41           HA2      GLY  41 -12.849  -6.972   8.069
  310    HA3  GLY  41           HA1      GLY  41 -12.388  -8.295   7.009
  311    H    VAL  42           HN       VAL  42 -14.291  -5.879   5.492
  312    HA   VAL  42           HA       VAL  42 -11.943  -5.096   3.988
  313    HB   VAL  42           HB       VAL  42 -14.871  -4.497   3.447
  314   HG11  VAL  42          HG11      VAL  42 -13.453  -2.751   2.530
  315   HG12  VAL  42          HG12      VAL  42 -13.996  -3.795   1.211
  316   HG13  VAL  42          HG13      VAL  42 -12.358  -3.952   1.849
  317   HG21  VAL  42          HG21      VAL  42 -14.595  -6.110   1.618
  318   HG22  VAL  42          HG22      VAL  42 -14.301  -6.859   3.191
  319   HG23  VAL  42          HG23      VAL  42 -12.942  -6.425   2.151
  320    H    ASP  43           HN       ASP  43 -10.934  -3.284   4.314
  321    HA   ASP  43           HA       ASP  43 -12.321  -0.954   5.399
  322    HB2  ASP  43           HB2      ASP  43 -11.243  -2.103   7.346
  323    HB3  ASP  43           HB1      ASP  43  -9.692  -1.987   6.524
  324    H    GLY  44           HN       GLY  44 -11.593   0.952   4.427
  325    HA2  GLY  44           HA2      GLY  44  -9.129   1.332   3.199
  326    HA3  GLY  44           HA1      GLY  44 -10.200   0.649   1.979
  327    H    GLU  45           HN       GLU  45  -9.612   2.852   1.034
  328    HA   GLU  45           HA       GLU  45 -10.841   5.177   2.167
  329    HB2  GLU  45           HB2      GLU  45  -8.997   4.622   0.102
  330    HB3  GLU  45           HB1      GLU  45 -10.351   5.451  -0.650
  331    HG2  GLU  45           HG2      GLU  45  -8.826   6.450   1.747
  332    HG3  GLU  45           HG1      GLU  45  -8.562   6.977   0.085
  333    H    TRP  46           HN       TRP  46 -12.585   6.356   1.259
  334    HA   TRP  46           HA       TRP  46 -14.566   4.586  -0.015
  335    HB2  TRP  46           HB2      TRP  46 -14.885   6.550   2.243
  336    HB3  TRP  46           HB1      TRP  46 -16.247   6.235   1.181
  337    HD1  TRP  46           HD1      TRP  46 -13.665   3.989   3.005
  338    HE1  TRP  46           HE1      TRP  46 -14.901   2.042   4.123
  339    HE3  TRP  46           HE3      TRP  46 -18.503   5.153   1.669
  340    HZ2  TRP  46           HZ2      TRP  46 -17.519   1.119   4.417
  341    HZ3  TRP  46           HZ3      TRP  46 -20.297   3.674   2.444
  342    HH2  TRP  46           HH2      TRP  46 -19.815   1.692   3.784
  343    H    THR  47           HN       THR  47 -15.727   5.317  -1.676
  344    HA   THR  47           HA       THR  47 -15.422   8.106  -2.532
  345    HB   THR  47           HB       THR  47 -15.432   6.780  -4.937
  346    HG1  THR  47           HG1      THR  47 -14.240   5.162  -2.978
  347   HG21  THR  47          HG21      THR  47 -14.016   8.687  -4.288
  348   HG22  THR  47          HG22      THR  47 -13.095   7.422  -5.100
  349   HG23  THR  47          HG23      THR  47 -12.995   7.593  -3.350
  350    H    TYR  48           HN       TYR  48 -17.054   8.610  -4.345
  351    HA   TYR  48           HA       TYR  48 -19.431   6.994  -4.341
  352    HB2  TYR  48           HB2      TYR  48 -20.009   7.951  -2.285
  353    HB3  TYR  48           HB1      TYR  48 -19.297   9.502  -2.659
  354    HD1  TYR  48           HD1      TYR  48 -22.246   7.359  -3.003
  355    HD2  TYR  48           HD2      TYR  48 -20.623  11.202  -3.915
  356    HE1  TYR  48           HE1      TYR  48 -24.498   8.193  -3.532
  357    HE2  TYR  48           HE2      TYR  48 -22.866  12.028  -4.438
  358    HH   TYR  48           HH       TYR  48 -25.035  11.185  -5.097
  359    H    ASP  49           HN       ASP  49 -20.978   7.685  -5.909
  360    HA   ASP  49           HA       ASP  49 -19.966   9.849  -7.673
  361    HB2  ASP  49           HB2      ASP  49 -20.221   8.633  -9.653
  362    HB3  ASP  49           HB1      ASP  49 -19.796   7.303  -8.597
  363    H    ASP  50           HN       ASP  50 -21.705  10.926  -8.880
  364    HA   ASP  50           HA       ASP  50 -24.007  11.168  -7.072
  365    HB2  ASP  50           HB2      ASP  50 -22.779  13.227  -7.623
  366    HB3  ASP  50           HB1      ASP  50 -23.043  12.937  -9.341
  367    H    ALA  51           HN       ALA  51 -23.362   9.736 -10.121
  368    HA   ALA  51           HA       ALA  51 -26.067  10.211 -11.075
  369    HB1  ALA  51           HB1      ALA  51 -24.391  10.356 -12.755
  370    HB2  ALA  51           HB2      ALA  51 -25.341   8.905 -13.075
  371    HB3  ALA  51           HB3      ALA  51 -23.740   8.773 -12.350
  372    H    THR  52           HN       THR  52 -24.098   7.348 -10.124
  373    HA   THR  52           HA       THR  52 -26.604   5.830 -10.167
  374    HB   THR  52           HB       THR  52 -25.031   3.821 -10.032
  375    HG1  THR  52           HG1      THR  52 -23.218   5.699  -9.719
  376   HG21  THR  52          HG21      THR  52 -26.183   4.409 -12.087
  377   HG22  THR  52          HG22      THR  52 -24.521   3.946 -12.456
  378   HG23  THR  52          HG23      THR  52 -24.975   5.651 -12.437
  379    H    LYS  53           HN       LYS  53 -24.654   7.385  -7.979
  380    HA   LYS  53           HA       LYS  53 -24.500   7.382  -5.683
  381    HB2  LYS  53           HB2      LYS  53 -27.015   5.749  -6.049
  382    HB3  LYS  53           HB1      LYS  53 -26.343   6.049  -4.456
  383    HG2  LYS  53           HG2      LYS  53 -28.078   7.647  -4.876
  384    HG3  LYS  53           HG1      LYS  53 -26.527   8.480  -4.860
  385    HD2  LYS  53           HD2      LYS  53 -26.522   8.473  -7.324
  386    HD3  LYS  53           HD1      LYS  53 -28.102   7.687  -7.316
  387    HE2  LYS  53           HE2      LYS  53 -29.059   9.589  -6.141
  388    HE3  LYS  53           HE1      LYS  53 -27.483  10.373  -6.106
  389    HZ1  LYS  53           HZ1      LYS  53 -28.859  11.259  -7.873
  390    HZ2  LYS  53           HZ2      LYS  53 -29.053   9.718  -8.546
  391    HZ3  LYS  53           HZ3      LYS  53 -27.522  10.449  -8.534
  392    H    THR  54           HN       THR  54 -22.951   5.614  -7.200
  393    HA   THR  54           HA       THR  54 -22.885   3.056  -5.854
  394    HB   THR  54           HB       THR  54 -20.958   4.203  -7.893
  395    HG1  THR  54           HG1      THR  54 -22.672   3.901  -9.126
  396   HG21  THR  54          HG21      THR  54 -21.406   1.266  -7.449
  397   HG22  THR  54          HG22      THR  54 -20.338   2.136  -6.341
  398   HG23  THR  54          HG23      THR  54 -19.976   2.101  -8.069
  399    H    TYR  55           HN       TYR  55 -22.117   3.027  -3.841
  400    HA   TYR  55           HA       TYR  55 -19.914   4.738  -3.023
  401    HB2  TYR  55           HB2      TYR  55 -21.675   2.787  -1.520
  402    HB3  TYR  55           HB1      TYR  55 -20.108   3.231  -0.863
  403    HD1  TYR  55           HD1      TYR  55 -19.716   5.322   0.133
  404    HD2  TYR  55           HD2      TYR  55 -23.432   4.579  -1.815
  405    HE1  TYR  55           HE1      TYR  55 -20.650   7.362   1.130
  406    HE2  TYR  55           HE2      TYR  55 -24.367   6.617  -0.811
  407    HH   TYR  55           HH       TYR  55 -22.410   8.941   0.783
  408    H    THR  56           HN       THR  56 -17.851   4.178  -3.108
  409    HA   THR  56           HA       THR  56 -17.253   1.343  -3.593
  410    HB   THR  56           HB       THR  56 -15.030   2.686  -4.527
  411    HG1  THR  56           HG1      THR  56 -15.674   4.697  -4.720
  412   HG21  THR  56          HG21      THR  56 -16.075   0.878  -5.741
  413   HG22  THR  56          HG22      THR  56 -15.944   2.272  -6.809
  414   HG23  THR  56          HG23      THR  56 -17.498   1.867  -6.083
  415    H    VAL  57           HN       VAL  57 -16.126   0.359  -2.090
  416    HA   VAL  57           HA       VAL  57 -14.369   1.966  -0.346
  417    HB   VAL  57           HB       VAL  57 -16.125   0.822   0.998
  418   HG11  VAL  57          HG11      VAL  57 -15.960  -1.668   1.303
  419   HG12  VAL  57          HG12      VAL  57 -14.985  -1.714  -0.160
  420   HG13  VAL  57          HG13      VAL  57 -16.657  -1.150  -0.227
  421   HG21  VAL  57          HG21      VAL  57 -13.992   1.261   2.028
  422   HG22  VAL  57          HG22      VAL  57 -13.335  -0.247   1.395
  423   HG23  VAL  57          HG23      VAL  57 -14.619  -0.282   2.604
  424    H    THR  58           HN       THR  58 -12.362   1.827  -0.954
  425    HA   THR  58           HA       THR  58 -11.545  -0.516  -2.528
  426    HB   THR  58           HB       THR  58 -10.158   2.166  -2.406
  427    HG1  THR  58           HG1      THR  58 -11.913   2.807  -3.440
  428   HG21  THR  58          HG21      THR  58 -10.062  -0.119  -4.385
  429   HG22  THR  58          HG22      THR  58  -8.787   0.341  -3.256
  430   HG23  THR  58          HG23      THR  58  -9.232   1.425  -4.573
  431    H    GLU  59           HN       GLU  59 -10.467  -1.975  -1.454
  432    HA   GLU  59           HA       GLU  59  -8.978  -1.464   0.935
  433    HB2  GLU  59           HB2      GLU  59 -10.117  -3.666   0.260
  434    HB3  GLU  59           HB1      GLU  59  -8.790  -3.881  -0.867
  435    HG2  GLU  59           HG2      GLU  59  -8.396  -3.634   2.096
  436    HG3  GLU  59           HG1      GLU  59  -8.637  -5.163   1.270
  437    H    GLY  60           HN       GLY  60  -7.104  -0.177   0.689
  438    HA2  GLY  60           HA2      GLY  60  -5.259  -1.094  -1.413
  439    HA3  GLY  60           HA1      GLY  60  -5.642   0.616  -1.279
  440    H    SER  61           HN       SER  61  -3.722  -1.923  -0.204
  441    HA   SER  61           HA       SER  61  -2.319  -0.082   1.604
  442    HB2  SER  61           HB2      SER  61  -3.492  -2.050   2.742
  443    HB3  SER  61           HB1      SER  61  -2.360  -3.101   1.895
  444    HG   SER  61           HG       SER  61  -1.709  -1.032   3.730
  445    H    GLY  62           HN       GLY  62  -1.968  -3.054  -0.324
  446    HA2  GLY  62           HA2      GLY  62  -0.503  -3.558  -2.011
  447    HA3  GLY  62           HA1      GLY  62  -0.004  -1.878  -2.007
  448    H    GLY  63           HN       GLY  63   2.038  -3.246  -2.518
  449    HA2  GLY  63           HA2      GLY  63   3.473  -3.572   0.037
  450    HA3  GLY  63           HA1      GLY  63   3.686  -4.712  -1.287
  451    H    ALA  64           HN       ALA  64   3.239  -1.349  -1.955
  452    HA   ALA  64           HA       ALA  64   5.944  -1.256  -3.054
  453    HB1  ALA  64           HB1      ALA  64   3.691   0.723  -3.391
  454    HB2  ALA  64           HB2      ALA  64   4.062  -0.593  -4.502
  455    HB3  ALA  64           HB3      ALA  64   5.224   0.711  -4.264
  456    H    GLY  65           HN       GLY  65   7.470   0.242  -2.433
  457    HA2  GLY  65           HA2      GLY  65   8.453   1.909  -1.164
  458    HA3  GLY  65           HA1      GLY  65   6.863   2.307  -0.522
  459    H    GLY  66           HN       GLY  66   8.314  -0.881  -0.414
  460    HA2  GLY  66           HA2      GLY  66   8.030  -0.943   2.459
  461    HA3  GLY  66           HA1      GLY  66   8.589  -2.260   1.432
  462    H    GLN  67           HN       GLN  67  10.538  -0.416   0.172
  463    HA   GLN  67           HA       GLN  67  12.701   0.204   0.335
  464    HB2  GLN  67           HB2      GLN  67  11.675   1.794   2.054
  465    HB3  GLN  67           HB1      GLN  67  12.240   0.653   3.300
  466    HG2  GLN  67           HG2      GLN  67  14.527   1.009   2.655
  467    HG3  GLN  67           HG1      GLN  67  14.032   2.007   1.286
  468   HE21  GLN  67          HE21      GLN  67  15.763   2.693   3.508
  469   HE22  GLN  67          HE22      GLN  67  15.042   4.068   4.276
  470    H    GLY  68           HN       GLY  68  13.482  -1.831  -0.152
  471    HA2  GLY  68           HA2      GLY  68  14.381  -3.391   2.190
  472    HA3  GLY  68           HA1      GLY  68  13.725  -4.166   0.756
  473    H    MET  69           HN       MET  69  16.136  -4.927   1.658
  474    HA   MET  69           HA       MET  69  18.132  -3.578  -0.041
  475    HB2  MET  69           HB2      MET  69  18.635  -5.617   2.158
  476    HB3  MET  69           HB1      MET  69  19.850  -4.740   1.246
  477    HG2  MET  69           HG2      MET  69  19.210  -2.665   2.225
  478    HG3  MET  69           HG1      MET  69  17.816  -3.405   3.009
  479    HE1  MET  69           HE1      MET  69  18.632  -2.241   5.305
  480    HE2  MET  69           HE2      MET  69  20.031  -1.577   4.458
  481    HE3  MET  69           HE3      MET  69  20.254  -2.462   5.967
  482    H    ILE  70           HN       ILE  70  18.428  -4.507  -1.997
  483    HA   ILE  70           HA       ILE  70  17.981  -7.413  -2.219
  484    HB   ILE  70           HB       ILE  70  17.315  -5.355  -4.364
  485   HG12  ILE  70          HG12      ILE  70  15.463  -7.048  -2.671
  486   HG13  ILE  70          HG11      ILE  70  15.757  -5.328  -2.429
  487   HG21  ILE  70          HG21      ILE  70  18.055  -7.566  -5.244
  488   HG22  ILE  70          HG22      ILE  70  16.372  -7.193  -5.629
  489   HG23  ILE  70          HG23      ILE  70  16.747  -8.326  -4.334
  490   HD11  ILE  70          HD11      ILE  70  13.668  -5.693  -3.594
  491   HD12  ILE  70          HD12      ILE  70  14.506  -6.596  -4.857
  492   HD13  ILE  70          HD13      ILE  70  14.820  -4.873  -4.649
  493    H    GLN  71           HN       GLN  71  19.790  -4.622  -3.275
  494    HA   GLN  71           HA       GLN  71  21.488  -6.074  -5.099
  495    HB2  GLN  71           HB2      GLN  71  20.788  -3.535  -5.094
  496    HB3  GLN  71           HB1      GLN  71  22.177  -3.359  -4.027
  497    HG2  GLN  71           HG2      GLN  71  22.789  -2.887  -6.321
  498    HG3  GLN  71           HG1      GLN  71  23.623  -4.323  -5.728
  499   HE21  GLN  71          HE21      GLN  71  23.999  -5.059  -7.826
  500   HE22  GLN  71          HE22      GLN  71  22.739  -5.733  -8.800
  501    H    GLU  72           HN       GLU  72  21.382  -6.889  -2.257
  502    HA   GLU  72           HA       GLU  72  23.607  -6.091  -0.775
  503    HB2  GLU  72           HB2      GLU  72  22.096  -8.699  -0.788
  504    HB3  GLU  72           HB1      GLU  72  23.337  -8.299   0.390
  505    HG2  GLU  72           HG2      GLU  72  20.680  -6.957  -0.013
  506    HG3  GLU  72           HG1      GLU  72  21.254  -7.840   1.398
  507    HA   PRO  73           HA       PRO  73  26.966  -8.053  -2.909
  508    HB2  PRO  73           HB2      PRO  73  28.860  -7.806  -1.000
  509    HB3  PRO  73           HB1      PRO  73  28.254  -6.388  -1.930
  510    HG2  PRO  73           HG2      PRO  73  27.502  -7.315   0.832
  511    HG3  PRO  73           HG1      PRO  73  27.826  -5.667   0.256
  512    HD2  PRO  73           HD2      PRO  73  25.313  -6.686   0.596
  513    HD3  PRO  73           HD1      PRO  73  25.712  -5.429  -0.621
  514    H    ALA  74           HN       ALA  74  28.645  -9.753  -2.446
  515    HA   ALA  74           HA       ALA  74  28.310 -11.545  -0.305
  516    HB1  ALA  74           HB1      ALA  74  26.239 -12.151  -1.406
  517    HB2  ALA  74           HB2      ALA  74  27.396 -13.476  -1.557
  518    HB3  ALA  74           HB3      ALA  74  27.092 -12.407  -2.927
  519    H    LEU  75           HN       LEU  75  29.678 -13.429  -0.486
  520    HA   LEU  75           HA       LEU  75  32.018 -12.907  -2.133
  521    HB2  LEU  75           HB2      LEU  75  31.480 -14.819   0.129
  522    HB3  LEU  75           HB1      LEU  75  32.927 -14.913  -0.844
  523    HG   LEU  75           HG       LEU  75  33.468 -13.775   1.183
  524   HD11  LEU  75          HD11      LEU  75  34.300 -11.638   0.330
  525   HD12  LEU  75          HD12      LEU  75  33.258 -11.795  -1.085
  526   HD13  LEU  75          HD13      LEU  75  34.566 -12.948  -0.823
  527   HD21  LEU  75          HD21      LEU  75  31.226 -13.029   1.816
  528   HD22  LEU  75          HD22      LEU  75  31.264 -11.818   0.532
  529   HD23  LEU  75          HD23      LEU  75  32.388 -11.704   1.884
  530    HA   PRO  76           HA       PRO  76  30.963 -16.092  -5.143
  531    HB2  PRO  76           HB2      PRO  76  33.781 -17.044  -4.903
  532    HB3  PRO  76           HB1      PRO  76  32.895 -16.602  -6.363
  533    HG2  PRO  76           HG2      PRO  76  34.793 -15.010  -5.333
  534    HG3  PRO  76           HG1      PRO  76  33.309 -14.341  -6.100
  535    HD2  PRO  76           HD2      PRO  76  34.041 -14.514  -3.208
  536    HD3  PRO  76           HD1      PRO  76  33.085 -13.308  -4.063
  537    HA   PRO  77           HA       PRO  77  29.890 -19.561  -2.629
  538    HB2  PRO  77           HB2      PRO  77  30.457 -21.006  -5.208
  539    HB3  PRO  77           HB1      PRO  77  29.083 -21.207  -4.108
  540    HG2  PRO  77           HG2      PRO  77  28.722 -19.801  -6.273
  541    HG3  PRO  77           HG1      PRO  77  28.157 -19.139  -4.721
  542    HD2  PRO  77           HD2      PRO  77  30.642 -18.411  -6.290
  543    HD3  PRO  77           HD1      PRO  77  29.470 -17.343  -5.427
  544    H    GLY  78           HN       GLY  78  31.132 -20.545  -1.209
  545    HA2  GLY  78           HA2      GLY  78  32.749 -22.122  -0.519
  546    HA3  GLY  78           HA1      GLY  78  33.494 -22.030  -2.106
  547    H    TRP  79           HN       TRP  79  33.464 -18.969  -1.855
  548    HA   TRP  79           HA       TRP  79  36.064 -18.829  -0.507
  549    HB2  TRP  79           HB2      TRP  79  34.520 -16.823  -2.181
  550    HB3  TRP  79           HB1      TRP  79  36.034 -16.441  -1.379
  551    HD1  TRP  79           HD1      TRP  79  34.654 -18.726  -4.174
  552    HE1  TRP  79           HE1      TRP  79  36.595 -19.311  -5.761
  553    HE3  TRP  79           HE3      TRP  79  38.496 -16.554  -1.579
  554    HZ2  TRP  79           HZ2      TRP  79  39.380 -18.890  -5.892
  555    HZ3  TRP  79           HZ3      TRP  79  40.769 -16.689  -2.511
  556    HH2  TRP  79           HH2      TRP  79  41.199 -17.832  -4.624
  557    H    GLU  80           HN       GLU  80  36.361 -17.983   1.509
  558    HA   GLU  80           HA       GLU  80  34.081 -16.658   2.806
  559    HB2  GLU  80           HB2      GLU  80  36.369 -18.314   3.870
  560    HB3  GLU  80           HB1      GLU  80  35.386 -17.312   4.922
  561    HG2  GLU  80           HG2      GLU  80  34.136 -19.377   3.154
  562    HG3  GLU  80           HG1      GLU  80  34.831 -19.805   4.716
  563    H    MET  81           HN       MET  81  34.370 -14.690   3.739
  564    HA   MET  81           HA       MET  81  37.012 -13.442   3.443
  565    HB2  MET  81           HB2      MET  81  35.119 -12.533   2.029
  566    HB3  MET  81           HB1      MET  81  34.332 -12.027   3.543
  567    HG2  MET  81           HG2      MET  81  37.094 -11.131   2.768
  568    HG3  MET  81           HG1      MET  81  35.647 -10.282   2.243
  569    HE1  MET  81           HE1      MET  81  33.881  -9.190   3.999
  570    HE2  MET  81           HE2      MET  81  34.119  -9.243   5.745
  571    HE3  MET  81           HE3      MET  81  33.801 -10.733   4.855
  572    H    LYS  82           HN       LYS  82  37.928 -12.568   5.302
  573    HA   LYS  82           HA       LYS  82  36.324 -12.255   7.677
  574    HB2  LYS  82           HB2      LYS  82  38.382 -14.485   7.502
  575    HB3  LYS  82           HB1      LYS  82  37.881 -13.787   9.026
  576    HG2  LYS  82           HG2      LYS  82  35.772 -14.688   8.938
  577    HG3  LYS  82           HG1      LYS  82  35.785 -14.770   7.151
  578    HD2  LYS  82           HD2      LYS  82  37.159 -16.688   7.159
  579    HD3  LYS  82           HD1      LYS  82  37.588 -16.485   8.858
  580    HE2  LYS  82           HE2      LYS  82  35.896 -18.307   8.283
  581    HE3  LYS  82           HE1      LYS  82  35.486 -17.207   9.590
  582    HZ1  LYS  82           HZ1      LYS  82  33.554 -17.068   8.472
  583    HZ2  LYS  82           HZ2      LYS  82  34.225 -17.545   6.991
  584    HZ3  LYS  82           HZ3      LYS  82  34.388 -15.943   7.518
  585    H    TYR  83           HN       TYR  83  37.526 -11.231   9.442
  586    HA   TYR  83           HA       TYR  83  39.861  -9.738   8.398
  587    HB2  TYR  83           HB2      TYR  83  37.797  -8.907  10.488
  588    HB3  TYR  83           HB1      TYR  83  39.213  -7.932  10.014
  589    HD1  TYR  83           HD1      TYR  83  39.275  -6.880   7.787
  590    HD2  TYR  83           HD2      TYR  83  35.840  -8.991   9.142
  591    HE1  TYR  83           HE1      TYR  83  37.943  -5.860   5.989
  592    HE2  TYR  83           HE2      TYR  83  34.499  -7.978   7.346
  593    HH   TYR  83           HH       TYR  83  35.799  -6.521   4.703
  594    H    THR  84           HN       THR  84  41.519  -9.184   9.939
  595    HA   THR  84           HA       THR  84  41.848 -11.167  12.059
  596    HB   THR  84           HB       THR  84  44.144 -10.468  12.219
  597    HG1  THR  84           HG1      THR  84  44.822  -8.601  10.869
  598   HG21  THR  84          HG21      THR  84  43.334 -10.411   9.307
  599   HG22  THR  84          HG22      THR  84  43.730 -11.837  10.262
  600   HG23  THR  84          HG23      THR  84  44.977 -10.645   9.905
  601    H    SER  85           HN       SER  85  42.758 -10.199  14.210
  602    HA   SER  85           HA       SER  85  40.769  -8.369  15.153
  603    HB2  SER  85           HB2      SER  85  42.168  -8.643  17.328
  604    HB3  SER  85           HB1      SER  85  41.308 -10.044  16.683
  605    HG   SER  85           HG       SER  85  43.148 -10.958  16.124
  606    H    GLU  86           HN       GLU  86  43.060  -7.497  13.282
  607    HA   GLU  86           HA       GLU  86  43.929  -5.138  14.858
  608    HB2  GLU  86           HB2      GLU  86  45.735  -6.869  14.238
  609    HB3  GLU  86           HB1      GLU  86  45.488  -6.367  12.570
  610    HG2  GLU  86           HG2      GLU  86  47.345  -5.165  13.369
  611    HG3  GLU  86           HG1      GLU  86  45.996  -4.031  13.307
  612    H    GLY  87           HN       GLY  87  41.965  -6.221  12.459
  613    HA2  GLY  87           HA2      GLY  87  40.662  -4.840  11.080
  614    HA3  GLY  87           HA1      GLY  87  41.893  -3.596  11.190
  615    H    VAL  88           HN       VAL  88  43.313  -6.568  10.481
  616    HA   VAL  88           HA       VAL  88  43.756  -5.728   7.729
  617    HB   VAL  88           HB       VAL  88  44.941  -8.068   9.245
  618   HG11  VAL  88          HG11      VAL  88  46.649  -8.053   7.459
  619   HG12  VAL  88          HG12      VAL  88  45.711  -6.826   6.607
  620   HG13  VAL  88          HG13      VAL  88  45.036  -8.436   6.856
  621   HG21  VAL  88          HG21      VAL  88  45.613  -6.018  10.299
  622   HG22  VAL  88          HG22      VAL  88  46.007  -5.297   8.742
  623   HG23  VAL  88          HG23      VAL  88  46.977  -6.635   9.362
  624    H    ARG  89           HN       ARG  89  43.254  -7.063   5.921
  625    HA   ARG  89           HA       ARG  89  40.945  -8.818   6.426
  626    HB2  ARG  89           HB2      ARG  89  40.818  -6.676   4.993
  627    HB3  ARG  89           HB1      ARG  89  41.703  -7.591   3.786
  628    HG2  ARG  89           HG2      ARG  89  39.916  -9.254   3.731
  629    HG3  ARG  89           HG1      ARG  89  39.022  -8.320   4.936
  630    HD2  ARG  89           HD2      ARG  89  39.178  -6.371   3.314
  631    HD3  ARG  89           HD1      ARG  89  39.722  -7.544   2.119
  632    HE   ARG  89           HE       ARG  89  37.378  -8.559   3.123
  633   HH11  ARG  89          HH11      ARG  89  38.383  -5.626   1.492
  634   HH12  ARG  89          HH12      ARG  89  36.812  -5.336   0.793
  635   HH21  ARG  89          HH21      ARG  89  35.306  -8.161   2.178
  636   HH22  ARG  89          HH22      ARG  89  35.095  -6.767   1.174
  637    H    TYR  90           HN       TYR  90  40.943 -10.911   5.739
  638    HA   TYR  90           HA       TYR  90  42.976 -11.763   3.831
  639    HB2  TYR  90           HB2      TYR  90  43.805 -13.580   5.185
  640    HB3  TYR  90           HB1      TYR  90  43.949 -12.096   6.105
  641    HD1  TYR  90           HD1      TYR  90  42.290 -11.638   7.944
  642    HD2  TYR  90           HD2      TYR  90  42.589 -15.423   6.037
  643    HE1  TYR  90           HE1      TYR  90  41.161 -12.681   9.860
  644    HE2  TYR  90           HE2      TYR  90  41.456 -16.480   7.945
  645    HH   TYR  90           HH       TYR  90  39.928 -14.655  10.435
  646    H    PHE  91           HN       PHE  91  42.438 -14.021   2.972
  647    HA   PHE  91           HA       PHE  91  39.531 -14.410   3.136
  648    HB2  PHE  91           HB2      PHE  91  41.359 -14.444   0.772
  649    HB3  PHE  91           HB1      PHE  91  39.934 -15.474   0.769
  650    HD1  PHE  91           HD1      PHE  91  37.983 -14.611  -0.125
  651    HD2  PHE  91           HD2      PHE  91  40.862 -11.943   1.534
  652    HE1  PHE  91           HE1      PHE  91  36.622 -12.695  -0.835
  653    HE2  PHE  91           HE2      PHE  91  39.490 -10.031   0.829
  654    HZ   PHE  91           HZ       PHE  91  37.301 -10.438  -0.322
  655    H    VAL  92           HN       VAL  92  38.729 -16.534   2.867
  656    HA   VAL  92           HA       VAL  92  40.657 -18.629   3.627
  657    HB   VAL  92           HB       VAL  92  37.864 -18.252   4.732
  658   HG11  VAL  92          HG11      VAL  92  39.953 -20.289   5.490
  659   HG12  VAL  92          HG12      VAL  92  38.496 -20.613   4.550
  660   HG13  VAL  92          HG13      VAL  92  38.364 -20.086   6.231
  661   HG21  VAL  92          HG21      VAL  92  38.948 -17.757   6.853
  662   HG22  VAL  92          HG22      VAL  92  39.427 -16.601   5.608
  663   HG23  VAL  92          HG23      VAL  92  40.529 -17.893   6.084
  664    H    ASP  93           HN       ASP  93  40.626 -20.296   2.220
  665    HA   ASP  93           HA       ASP  93  38.372 -20.539   0.347
  666    HB2  ASP  93           HB2      ASP  93  41.179 -21.533   0.422
  667    HB3  ASP  93           HB1      ASP  93  40.008 -22.690  -0.201
  668    H    HIS  94           HN       HIS  94  36.591 -21.568   1.255
  669    HA   HIS  94           HA       HIS  94  36.854 -23.335   3.485
  670    HB2  HIS  94           HB2      HIS  94  34.893 -21.806   2.993
  671    HB3  HIS  94           HB1      HIS  94  34.398 -22.962   1.761
  672    HD1  HIS  94           HD1      HIS  94  32.410 -24.115   2.698
  673    HD2  HIS  94           HD2      HIS  94  35.458 -23.712   5.503
  674    HE1  HIS  94           HE1      HIS  94  31.618 -25.336   4.748
  675    HE2  HIS  94           HE2      HIS  94  33.380 -24.893   6.501
  676    H    ASN  95           HN       ASN  95  37.608 -23.951   0.400
  677    HA   ASN  95           HA       ASN  95  36.428 -26.614   0.260
  678    HB2  ASN  95           HB2      ASN  95  37.555 -26.740  -1.986
  679    HB3  ASN  95           HB1      ASN  95  36.419 -25.399  -1.846
  680   HD21  ASN  95          HD21      ASN  95  37.187 -23.309  -1.847
  681   HD22  ASN  95          HD22      ASN  95  38.825 -22.906  -2.262
  682    H    THR  96           HN       THR  96  39.715 -25.188   0.249
  683    HA   THR  96           HA       THR  96  40.751 -27.815   0.962
  684    HB   THR  96           HB       THR  96  43.009 -26.682   0.604
  685    HG1  THR  96           HG1      THR  96  41.750 -24.789  -1.002
  686   HG21  THR  96          HG21      THR  96  41.994 -28.188  -1.042
  687   HG22  THR  96          HG22      THR  96  42.850 -26.864  -1.832
  688   HG23  THR  96          HG23      THR  96  41.091 -26.837  -1.726
  689    H    ARG  97           HN       ARG  97  39.801 -24.952   2.422
  690    HA   ARG  97           HA       ARG  97  39.766 -24.309   4.624
  691    HB2  ARG  97           HB2      ARG  97  41.312 -26.845   5.198
  692    HB3  ARG  97           HB1      ARG  97  40.436 -25.854   6.362
  693    HG2  ARG  97           HG2      ARG  97  38.337 -26.415   5.369
  694    HG3  ARG  97           HG1      ARG  97  39.148 -27.216   4.025
  695    HD2  ARG  97           HD2      ARG  97  38.202 -28.730   5.818
  696    HD3  ARG  97           HD1      ARG  97  39.893 -28.989   5.387
  697    HE   ARG  97           HE       ARG  97  39.849 -27.210   7.519
  698   HH11  ARG  97          HH11      ARG  97  38.952 -30.527   6.893
  699   HH12  ARG  97          HH12      ARG  97  39.320 -31.067   8.506
  700   HH21  ARG  97          HH21      ARG  97  40.297 -27.907   9.644
  701   HH22  ARG  97          HH22      ARG  97  40.057 -29.568  10.066
  702    H    THR  98           HN       THR  98  41.760 -23.600   2.772
  703    HA   THR  98           HA       THR  98  44.180 -23.280   4.390
  704    HB   THR  98           HB       THR  98  45.090 -22.312   2.176
  705    HG1  THR  98           HG1      THR  98  43.226 -23.771   0.761
  706   HG21  THR  98          HG21      THR  98  44.191 -25.204   2.266
  707   HG22  THR  98          HG22      THR  98  45.673 -24.570   2.982
  708   HG23  THR  98          HG23      THR  98  45.464 -24.563   1.226
  709    H    THR  99           HN       THR  99  45.196 -21.126   4.555
  710    HA   THR  99           HA       THR  99  43.178 -18.962   4.525
  711    HB   THR  99           HB       THR  99  44.985 -17.853   6.076
  712    HG1  THR  99           HG1      THR  99  46.652 -19.066   6.501
  713   HG21  THR  99          HG21      THR  99  42.802 -18.587   6.965
  714   HG22  THR  99          HG22      THR  99  44.078 -19.069   8.089
  715   HG23  THR  99          HG23      THR  99  43.364 -20.259   7.003
  716    H    THR 100           HN       THR 100  43.410 -17.800   2.607
  717    HA   THR 100           HA       THR 100  46.160 -17.374   1.663
  718    HB   THR 100           HB       THR 100  44.667 -18.680   0.107
  719    HG1  THR 100           HG1      THR 100  45.415 -17.492  -1.708
  720   HG21  THR 100          HG21      THR 100  42.537 -17.645   0.271
  721   HG22  THR 100          HG22      THR 100  43.151 -17.190  -1.316
  722   HG23  THR 100          HG23      THR 100  43.215 -16.036   0.014
  723    H    PHE 101           HN       PHE 101  46.588 -15.341   0.592
  724    HA   PHE 101           HA       PHE 101  45.022 -13.160   1.798
  725    HB2  PHE 101           HB2      PHE 101  47.790 -13.737   2.027
  726    HB3  PHE 101           HB1      PHE 101  47.644 -12.290   0.939
  727    HD1  PHE 101           HD1      PHE 101  46.444 -10.281   1.790
  728    HD2  PHE 101           HD2      PHE 101  47.420 -13.550   4.322
  729    HE1  PHE 101           HE1      PHE 101  46.131  -8.833   3.762
  730    HE2  PHE 101           HE2      PHE 101  47.103 -12.117   6.293
  731    HZ   PHE 101           HZ       PHE 101  46.441  -9.746   6.003
  732    H    LYS 102           HN       LYS 102  43.660 -12.603   0.178
  733    HA   LYS 102           HA       LYS 102  44.901 -11.589  -2.267
  734    HB2  LYS 102           HB2      LYS 102  43.930 -13.865  -2.723
  735    HB3  LYS 102           HB1      LYS 102  42.350 -13.221  -2.290
  736    HG2  LYS 102           HG2      LYS 102  42.390 -11.702  -4.132
  737    HG3  LYS 102           HG1      LYS 102  44.065 -12.117  -4.498
  738    HD2  LYS 102           HD2      LYS 102  42.728 -13.284  -6.067
  739    HD3  LYS 102           HD1      LYS 102  43.275 -14.476  -4.890
  740    HE2  LYS 102           HE2      LYS 102  40.973 -14.894  -5.337
  741    HE3  LYS 102           HE1      LYS 102  41.088 -14.212  -3.716
  742    HZ1  LYS 102           HZ1      LYS 102  40.499 -12.542  -6.089
  743    HZ2  LYS 102           HZ2      LYS 102  40.272 -12.160  -4.454
  744    HZ3  LYS 102           HZ3      LYS 102  39.278 -13.311  -5.204
  745    H    ASP 103           HN       ASP 103  44.583  -9.483  -1.920
  746    HA   ASP 103           HA       ASP 103  42.022  -8.586  -0.801
  747    HB2  ASP 103           HB2      ASP 103  44.162  -7.846   0.268
  748    HB3  ASP 103           HB1      ASP 103  44.574  -7.014  -1.227
  749    HA   PRO 104           HA       PRO 104  40.473  -7.058  -4.669
  750    HB2  PRO 104           HB2      PRO 104  39.719  -4.573  -3.240
  751    HB3  PRO 104           HB1      PRO 104  38.680  -5.698  -4.114
  752    HG2  PRO 104           HG2      PRO 104  38.815  -5.495  -1.383
  753    HG3  PRO 104           HG1      PRO 104  38.268  -6.940  -2.246
  754    HD2  PRO 104           HD2      PRO 104  40.731  -6.486  -0.736
  755    HD3  PRO 104           HD1      PRO 104  40.014  -8.009  -1.283
  756    H    ARG 105           HN       ARG 105  42.586  -5.123  -2.643
  757    HA   ARG 105           HA       ARG 105  43.348  -3.384  -4.866
  758    HB2  ARG 105           HB2      ARG 105  43.776  -3.449  -1.951
  759    HB3  ARG 105           HB1      ARG 105  45.142  -2.888  -2.889
  760    HG2  ARG 105           HG2      ARG 105  43.835  -1.025  -2.131
  761    HG3  ARG 105           HG1      ARG 105  43.732  -1.147  -3.892
  762    HD2  ARG 105           HD2      ARG 105  41.525  -2.074  -3.762
  763    HD3  ARG 105           HD1      ARG 105  41.647  -2.250  -2.011
  764    HE   ARG 105           HE       ARG 105  42.029   0.421  -2.454
  765   HH11  ARG 105          HH11      ARG 105  39.473  -1.837  -3.299
  766   HH12  ARG 105          HH12      ARG 105  38.215  -0.645  -3.202
  767   HH21  ARG 105          HH21      ARG 105  40.393   1.978  -2.344
  768   HH22  ARG 105          HH22      ARG 105  38.748   1.547  -2.694
  769    HA   PRO 106           HA       PRO 106  46.590  -6.524  -5.593
  770    HB2  PRO 106           HB2      PRO 106  47.066  -5.332  -8.186
  771    HB3  PRO 106           HB1      PRO 106  46.367  -6.948  -7.793
  772    HG2  PRO 106           HG2      PRO 106  44.979  -4.819  -8.905
  773    HG3  PRO 106           HG1      PRO 106  44.251  -6.195  -8.067
  774    HD2  PRO 106           HD2      PRO 106  44.707  -3.412  -7.124
  775    HD3  PRO 106           HD1      PRO 106  43.420  -4.590  -6.697
  776    H    GLY 107           HN       GLY 107  48.638  -6.267  -4.958
  777    HA2  GLY 107           HA2      GLY 107  50.739  -5.390  -4.742
  778    HA3  GLY 107           HA1      GLY 107  50.348  -4.306  -6.092
  779    H    PHE 108           HN       PHE 108  48.283  -3.969  -3.292
  780    HA   PHE 108           HA       PHE 108  49.054  -1.287  -2.946
  781    HB2  PHE 108           HB2      PHE 108  47.706  -1.212  -0.916
  782    HB3  PHE 108           HB1      PHE 108  46.814  -2.098  -2.195
  783    HD1  PHE 108           HD1      PHE 108  46.569  -4.549  -2.007
  784    HD2  PHE 108           HD2      PHE 108  48.359  -2.281   1.121
  785    HE1  PHE 108           HE1      PHE 108  46.243  -6.430  -0.456
  786    HE2  PHE 108           HE2      PHE 108  48.035  -4.156   2.669
  787    HZ   PHE 108           HZ       PHE 108  47.003  -6.197   1.936
  788    H    GLU 109           HN       GLU 109  50.146  -4.237  -1.500
  789    HA   GLU 109           HA       GLU 109  51.985  -4.778  -0.299
  790    HB2  GLU 109           HB2      GLU 109  53.074  -3.183  -1.938
  791    HB3  GLU 109           HB1      GLU 109  52.922  -1.937  -0.713
  792    HG2  GLU 109           HG2      GLU 109  55.157  -2.913  -0.775
  793    HG3  GLU 109           HG1      GLU 109  54.368  -3.167   0.783
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1 -42.229   8.914   2.188
    2    H2   GLY   1           HT2      GLY   1 -43.491   8.583   1.109
    3    H3   GLY   1           HT3      GLY   1 -43.168  10.184   1.561
    4    HA2  GLY   1           HA1      GLY   1 -42.321   9.846  -0.624
    5    HA3  GLY   1           HA2      GLY   1 -40.976  10.039   0.491
    6    H    SER   2           HN       SER   2 -39.954   8.972  -1.462
    7    HA   SER   2           HA       SER   2 -40.334   6.060  -1.445
    8    HB2  SER   2           HB2      SER   2 -38.796   7.752  -3.427
    9    HB3  SER   2           HB1      SER   2 -39.216   6.047  -3.595
   10    HG   SER   2           HG       SER   2 -41.348   6.599  -3.838
   11    H    HIS   3           HN       HIS   3 -38.041   5.027  -2.142
   12    HA   HIS   3           HA       HIS   3 -36.106   5.985  -0.134
   13    HB2  HIS   3           HB2      HIS   3 -35.288   3.679   0.063
   14    HB3  HIS   3           HB1      HIS   3 -37.026   3.704   0.346
   15    HD1  HIS   3           HD1      HIS   3 -34.531   2.778  -2.364
   16    HD2  HIS   3           HD2      HIS   3 -38.467   2.029  -1.260
   17    HE1  HIS   3           HE1      HIS   3 -35.330   0.973  -3.920
   18    HE2  HIS   3           HE2      HIS   3 -37.626   0.367  -3.066
   19    H    MET   4           HN       MET   4 -33.790   5.513  -0.709
   20    HA   MET   4           HA       MET   4 -33.392   5.801  -3.619
   21    HB2  MET   4           HB2      MET   4 -31.502   6.631  -1.389
   22    HB3  MET   4           HB1      MET   4 -31.240   6.872  -3.104
   23    HG2  MET   4           HG2      MET   4 -33.212   8.344  -3.183
   24    HG3  MET   4           HG1      MET   4 -33.387   8.154  -1.441
   25    HE1  MET   4           HE1      MET   4 -31.131   9.571  -4.342
   26    HE2  MET   4           HE2      MET   4 -30.080   8.420  -3.519
   27    HE3  MET   4           HE3      MET   4 -29.731  10.145  -3.435
   28    H    GLN   5           HN       GLN   5 -32.117   4.337  -4.669
   29    HA   GLN   5           HA       GLN   5 -31.313   2.004  -3.104
   30    HB2  GLN   5           HB2      GLN   5 -32.613   1.600  -5.136
   31    HB3  GLN   5           HB1      GLN   5 -31.406   2.446  -6.098
   32    HG2  GLN   5           HG2      GLN   5 -29.746   0.716  -5.342
   33    HG3  GLN   5           HG1      GLN   5 -31.104  -0.168  -4.644
   34   HE21  GLN   5          HE21      GLN   5 -32.601  -1.151  -5.988
   35   HE22  GLN   5          HE22      GLN   5 -32.290  -1.401  -7.699
   36    H    TYR   6           HN       TYR   6 -29.293   1.888  -2.381
   37    HA   TYR   6           HA       TYR   6 -27.235   3.380  -3.852
   38    HB2  TYR   6           HB2      TYR   6 -27.343   2.560  -0.929
   39    HB3  TYR   6           HB1      TYR   6 -25.831   3.050  -1.686
   40    HD1  TYR   6           HD1      TYR   6 -25.500   5.371  -2.393
   41    HD2  TYR   6           HD2      TYR   6 -29.102   4.169  -0.454
   42    HE1  TYR   6           HE1      TYR   6 -26.057   7.729  -1.974
   43    HE2  TYR   6           HE2      TYR   6 -29.658   6.525  -0.033
   44    HH   TYR   6           HH       TYR   6 -28.449   8.702   0.177
   45    H    LYS   7           HN       LYS   7 -25.057   2.322  -3.847
   46    HA   LYS   7           HA       LYS   7 -25.238  -0.576  -3.977
   47    HB2  LYS   7           HB2      LYS   7 -25.858  -0.078  -6.234
   48    HB3  LYS   7           HB1      LYS   7 -24.616   1.168  -6.388
   49    HG2  LYS   7           HG2      LYS   7 -22.884  -0.512  -6.440
   50    HG3  LYS   7           HG1      LYS   7 -24.063  -1.792  -6.137
   51    HD2  LYS   7           HD2      LYS   7 -24.059   0.029  -8.540
   52    HD3  LYS   7           HD1      LYS   7 -23.446  -1.628  -8.517
   53    HE2  LYS   7           HE2      LYS   7 -25.722  -2.368  -7.780
   54    HE3  LYS   7           HE1      LYS   7 -26.284  -0.717  -8.045
   55    HZ1  LYS   7           HZ1      LYS   7 -26.756  -2.124  -9.937
   56    HZ2  LYS   7           HZ2      LYS   7 -25.113  -2.508 -10.107
   57    HZ3  LYS   7           HZ3      LYS   7 -25.646  -0.916 -10.371
   58    H    LEU   8           HN       LEU   8 -23.381  -1.587  -3.430
   59    HA   LEU   8           HA       LEU   8 -21.020   0.149  -2.996
   60    HB2  LEU   8           HB2      LEU   8 -22.231  -0.663  -0.892
   61    HB3  LEU   8           HB1      LEU   8 -21.747  -2.276  -1.344
   62    HG   LEU   8           HG       LEU   8 -19.356  -1.503  -1.230
   63   HD11  LEU   8          HD11      LEU   8 -20.704   0.927  -0.071
   64   HD12  LEU   8          HD12      LEU   8 -19.471   0.858  -1.332
   65   HD13  LEU   8          HD13      LEU   8 -19.049   0.480   0.333
   66   HD21  LEU   8          HD21      LEU   8 -20.149  -2.857   0.491
   67   HD22  LEU   8          HD22      LEU   8 -21.201  -1.592   1.116
   68   HD23  LEU   8          HD23      LEU   8 -19.452  -1.463   1.314
   69    H    ILE   9           HN       ILE   9 -19.043  -0.641  -3.597
   70    HA   ILE   9           HA       ILE   9 -18.947  -3.367  -4.726
   71    HB   ILE   9           HB       ILE   9 -17.236  -1.016  -5.609
   72   HG12  ILE   9          HG12      ILE   9 -19.460  -2.267  -7.262
   73   HG13  ILE   9          HG11      ILE   9 -19.708  -0.834  -6.209
   74   HG21  ILE   9          HG21      ILE   9 -17.619  -3.761  -6.765
   75   HG22  ILE   9          HG22      ILE   9 -16.178  -3.170  -5.930
   76   HG23  ILE   9          HG23      ILE   9 -16.654  -2.478  -7.482
   77   HD11  ILE   9          HD11      ILE   9 -19.320  -0.257  -8.581
   78   HD12  ILE   9          HD12      ILE   9 -17.721  -1.000  -8.480
   79   HD13  ILE   9          HD13      ILE   9 -18.096   0.423  -7.509
   80    H    LEU  10           HN       LEU  10 -17.637  -4.681  -3.636
   81    HA   LEU  10           HA       LEU  10 -15.748  -3.445  -1.778
   82    HB2  LEU  10           HB2      LEU  10 -16.509  -6.357  -1.921
   83    HB3  LEU  10           HB1      LEU  10 -15.475  -5.620  -0.727
   84    HG   LEU  10           HG       LEU  10 -17.399  -5.849   0.461
   85   HD11  LEU  10          HD11      LEU  10 -16.752  -3.521   0.497
   86   HD12  LEU  10          HD12      LEU  10 -18.479  -3.765   0.756
   87   HD13  LEU  10          HD13      LEU  10 -17.900  -3.200  -0.814
   88   HD21  LEU  10          HD21      LEU  10 -18.689  -6.710  -1.512
   89   HD22  LEU  10          HD22      LEU  10 -19.121  -5.035  -1.863
   90   HD23  LEU  10          HD23      LEU  10 -19.626  -5.778  -0.347
   91    H    ASN  11           HN       ASN  11 -13.985  -2.916  -2.845
   92    HA   ASN  11           HA       ASN  11 -12.810  -4.890  -4.663
   93    HB2  ASN  11           HB2      ASN  11 -11.560  -2.200  -4.129
   94    HB3  ASN  11           HB1      ASN  11 -11.550  -3.147  -5.607
   95   HD21  ASN  11          HD21      ASN  11 -13.348  -0.932  -3.646
   96   HD22  ASN  11          HD22      ASN  11 -14.479  -0.478  -4.869
   97    H    GLY  12           HN       GLY  12 -12.163  -6.368  -3.086
   98    HA2  GLY  12           HA2      GLY  12  -9.648  -5.639  -1.781
   99    HA3  GLY  12           HA1      GLY  12 -10.948  -6.239  -0.730
  100    H    LYS  13           HN       LYS  13  -8.223  -7.258  -1.963
  101    HA   LYS  13           HA       LYS  13  -8.605  -9.393  -3.649
  102    HB2  LYS  13           HB2      LYS  13  -6.600  -9.172  -1.402
  103    HB3  LYS  13           HB1      LYS  13  -6.489 -10.299  -2.746
  104    HG2  LYS  13           HG2      LYS  13  -6.327  -8.418  -4.301
  105    HG3  LYS  13           HG1      LYS  13  -6.425  -7.295  -2.945
  106    HD2  LYS  13           HD2      LYS  13  -4.263  -9.353  -3.385
  107    HD3  LYS  13           HD1      LYS  13  -4.111  -7.623  -3.681
  108    HE2  LYS  13           HE2      LYS  13  -3.167  -7.755  -1.605
  109    HE3  LYS  13           HE1      LYS  13  -4.844  -7.465  -1.156
  110    HZ1  LYS  13           HZ1      LYS  13  -4.128  -9.216   0.197
  111    HZ2  LYS  13           HZ2      LYS  13  -3.332 -10.008  -1.070
  112    HZ3  LYS  13           HZ3      LYS  13  -5.026  -9.986  -1.021
  113    H    THR  14           HN       THR  14  -9.171  -9.279  -0.193
  114    HA   THR  14           HA       THR  14  -9.445 -12.155   0.054
  115    HB   THR  14           HB       THR  14 -10.222 -10.084   2.113
  116    HG1  THR  14           HG1      THR  14  -7.848 -10.772   2.738
  117   HG21  THR  14          HG21      THR  14 -10.871 -12.400   2.594
  118   HG22  THR  14          HG22      THR  14  -9.601 -11.864   3.693
  119   HG23  THR  14          HG23      THR  14  -9.207 -12.928   2.343
  120    H    LEU  15           HN       LEU  15 -11.547  -9.550  -0.767
  121    HA   LEU  15           HA       LEU  15 -13.810 -11.304  -0.876
  122    HB2  LEU  15           HB2      LEU  15 -13.772 -10.573   1.525
  123    HB3  LEU  15           HB1      LEU  15 -13.889  -8.919   0.984
  124    HG   LEU  15           HG       LEU  15 -16.008 -10.143   1.831
  125   HD11  LEU  15          HD11      LEU  15 -17.363  -8.891   0.070
  126   HD12  LEU  15          HD12      LEU  15 -15.797  -8.408  -0.596
  127   HD13  LEU  15          HD13      LEU  15 -16.233  -7.959   1.056
  128   HD21  LEU  15          HD21      LEU  15 -17.270 -11.215   0.013
  129   HD22  LEU  15          HD22      LEU  15 -15.814 -12.109   0.448
  130   HD23  LEU  15          HD23      LEU  15 -15.836 -11.115  -1.007
  131    H    LYS  16           HN       LYS  16 -14.273 -10.862  -2.924
  132    HA   LYS  16           HA       LYS  16 -14.508  -8.043  -3.751
  133    HB2  LYS  16           HB2      LYS  16 -13.669 -10.450  -5.389
  134    HB3  LYS  16           HB1      LYS  16 -13.950  -8.842  -6.043
  135    HG2  LYS  16           HG2      LYS  16 -11.988  -8.052  -5.298
  136    HG3  LYS  16           HG1      LYS  16 -12.036  -8.984  -3.806
  137    HD2  LYS  16           HD2      LYS  16 -11.212  -9.849  -6.545
  138    HD3  LYS  16           HD1      LYS  16 -10.222  -9.775  -5.087
  139    HE2  LYS  16           HE2      LYS  16 -11.539 -11.565  -4.084
  140    HE3  LYS  16           HE1      LYS  16 -12.554 -11.646  -5.522
  141    HZ1  LYS  16           HZ1      LYS  16 -10.851 -13.376  -5.498
  142    HZ2  LYS  16           HZ2      LYS  16  -9.636 -12.200  -5.443
  143    HZ3  LYS  16           HZ3      LYS  16 -10.634 -12.328  -6.810
  144    H    GLY  17           HN       GLY  17 -16.444  -7.434  -4.414
  145    HA2  GLY  17           HA2      GLY  17 -18.255  -8.879  -5.919
  146    HA3  GLY  17           HA1      GLY  17 -18.684  -9.168  -4.237
  147    H    GLU  18           HN       GLU  18 -20.681  -8.092  -5.158
  148    HA   GLU  18           HA       GLU  18 -20.515  -5.234  -4.519
  149    HB2  GLU  18           HB2      GLU  18 -21.855  -6.438  -6.939
  150    HB3  GLU  18           HB1      GLU  18 -22.296  -4.864  -6.313
  151    HG2  GLU  18           HG2      GLU  18 -20.062  -4.031  -6.720
  152    HG3  GLU  18           HG1      GLU  18 -19.550  -5.626  -7.271
  153    H    THR  19           HN       THR  19 -22.664  -4.313  -3.985
  154    HA   THR  19           HA       THR  19 -24.816  -6.121  -3.448
  155    HB   THR  19           HB       THR  19 -23.344  -6.639  -1.523
  156    HG1  THR  19           HG1      THR  19 -25.033  -6.662  -0.156
  157   HG21  THR  19          HG21      THR  19 -23.797  -3.734  -0.755
  158   HG22  THR  19          HG22      THR  19 -22.259  -4.414  -1.291
  159   HG23  THR  19          HG23      THR  19 -22.981  -4.945   0.230
  160    H    THR  20           HN       THR  20 -26.643  -4.948  -2.324
  161    HA   THR  20           HA       THR  20 -26.574  -2.060  -2.861
  162    HB   THR  20           HB       THR  20 -28.911  -2.310  -3.835
  163    HG1  THR  20           HG1      THR  20 -28.955  -4.597  -2.987
  164   HG21  THR  20          HG21      THR  20 -27.103  -1.856  -5.376
  165   HG22  THR  20          HG22      THR  20 -28.117  -3.114  -6.084
  166   HG23  THR  20          HG23      THR  20 -26.581  -3.540  -5.328
  167    H    THR  21           HN       THR  21 -28.371  -0.911  -1.824
  168    HA   THR  21           HA       THR  21 -30.023  -2.337   0.036
  169    HB   THR  21           HB       THR  21 -27.821  -2.051   1.294
  170    HG1  THR  21           HG1      THR  21 -29.878  -0.632   2.614
  171   HG21  THR  21          HG21      THR  21 -28.725   0.857   1.297
  172   HG22  THR  21          HG22      THR  21 -27.236   0.243   0.573
  173   HG23  THR  21          HG23      THR  21 -27.456   0.198   2.327
  174    H    GLU  22           HN       GLU  22 -31.842  -1.151   0.594
  175    HA   GLU  22           HA       GLU  22 -32.142   1.403  -0.795
  176    HB2  GLU  22           HB2      GLU  22 -34.298  -0.052   0.754
  177    HB3  GLU  22           HB1      GLU  22 -34.499   1.108  -0.547
  178    HG2  GLU  22           HG2      GLU  22 -35.053  -0.832  -1.625
  179    HG3  GLU  22           HG1      GLU  22 -33.290  -0.780  -1.985
  180    H    ALA  23           HN       ALA  23 -31.902   3.279   0.245
  181    HA   ALA  23           HA       ALA  23 -32.682   3.462   3.075
  182    HB1  ALA  23           HB1      ALA  23 -29.971   4.376   2.076
  183    HB2  ALA  23           HB2      ALA  23 -30.263   2.962   3.090
  184    HB3  ALA  23           HB3      ALA  23 -30.606   4.579   3.709
  185    H    VAL  24           HN       VAL  24 -33.001   5.740   3.753
  186    HA   VAL  24           HA       VAL  24 -33.665   7.402   1.430
  187    HB   VAL  24           HB       VAL  24 -35.084   8.698   3.013
  188   HG11  VAL  24          HG11      VAL  24 -35.649   5.737   2.885
  189   HG12  VAL  24          HG12      VAL  24 -36.033   6.921   1.637
  190   HG13  VAL  24          HG13      VAL  24 -36.836   7.000   3.205
  191   HG21  VAL  24          HG21      VAL  24 -34.348   6.505   4.947
  192   HG22  VAL  24          HG22      VAL  24 -35.584   7.736   5.210
  193   HG23  VAL  24          HG23      VAL  24 -33.887   8.202   5.075
  194    H    ASP  25           HN       ASP  25 -31.080   7.143   3.362
  195    HA   ASP  25           HA       ASP  25 -30.565  10.030   3.246
  196    HB2  ASP  25           HB2      ASP  25 -29.530   8.330   5.515
  197    HB3  ASP  25           HB1      ASP  25 -29.517  10.082   5.379
  198    H    ALA  26           HN       ALA  26 -28.423  10.563   2.653
  199    HA   ALA  26           HA       ALA  26 -26.915   8.530   1.351
  200    HB1  ALA  26           HB1      ALA  26 -26.926  10.891   0.597
  201    HB2  ALA  26           HB2      ALA  26 -25.295  10.278   0.870
  202    HB3  ALA  26           HB3      ALA  26 -26.048  11.340   2.060
  203    H    ALA  27           HN       ALA  27 -26.691  10.190   4.428
  204    HA   ALA  27           HA       ALA  27 -24.141   9.166   5.157
  205    HB1  ALA  27           HB1      ALA  27 -26.303  10.314   6.912
  206    HB2  ALA  27           HB2      ALA  27 -25.051  11.245   6.087
  207    HB3  ALA  27           HB3      ALA  27 -24.609  10.094   7.349
  208    H    THR  28           HN       THR  28 -27.469   8.156   5.774
  209    HA   THR  28           HA       THR  28 -26.854   6.159   7.668
  210    HB   THR  28           HB       THR  28 -29.231   6.121   5.787
  211    HG1  THR  28           HG1      THR  28 -30.202   7.559   7.150
  212   HG21  THR  28          HG21      THR  28 -28.795   5.046   8.585
  213   HG22  THR  28          HG22      THR  28 -28.960   4.093   7.110
  214   HG23  THR  28          HG23      THR  28 -30.330   5.026   7.717
  215    H    ALA  29           HN       ALA  29 -26.831   6.129   4.156
  216    HA   ALA  29           HA       ALA  29 -26.767   3.278   3.885
  217    HB1  ALA  29           HB1      ALA  29 -27.514   4.660   2.034
  218    HB2  ALA  29           HB2      ALA  29 -26.083   3.745   1.557
  219    HB3  ALA  29           HB3      ALA  29 -25.942   5.455   1.964
  220    H    GLU  30           HN       GLU  30 -24.458   5.860   4.168
  221    HA   GLU  30           HA       GLU  30 -22.088   4.467   3.608
  222    HB2  GLU  30           HB2      GLU  30 -22.576   7.019   3.951
  223    HB3  GLU  30           HB1      GLU  30 -22.281   6.660   5.639
  224    HG2  GLU  30           HG2      GLU  30 -20.054   5.776   5.024
  225    HG3  GLU  30           HG1      GLU  30 -20.357   6.325   3.375
  226    H    LYS  31           HN       LYS  31 -23.509   5.365   6.733
  227    HA   LYS  31           HA       LYS  31 -21.790   4.007   8.395
  228    HB2  LYS  31           HB2      LYS  31 -24.712   4.543   8.890
  229    HB3  LYS  31           HB1      LYS  31 -23.505   4.189  10.114
  230    HG2  LYS  31           HG2      LYS  31 -23.646   6.617   8.348
  231    HG3  LYS  31           HG1      LYS  31 -23.920   6.538  10.089
  232    HD2  LYS  31           HD2      LYS  31 -21.596   5.900  10.444
  233    HD3  LYS  31           HD1      LYS  31 -21.309   5.922   8.702
  234    HE2  LYS  31           HE2      LYS  31 -20.486   7.966   9.705
  235    HE3  LYS  31           HE1      LYS  31 -21.872   8.323   8.681
  236    HZ1  LYS  31           HZ1      LYS  31 -23.275   8.472  10.599
  237    HZ2  LYS  31           HZ2      LYS  31 -21.929   9.483  10.836
  238    HZ3  LYS  31           HZ3      LYS  31 -22.015   7.980  11.619
  239    H    VAL  32           HN       VAL  32 -24.801   2.774   6.938
  240    HA   VAL  32           HA       VAL  32 -24.785   0.334   8.411
  241    HB   VAL  32           HB       VAL  32 -26.187   1.033   5.823
  242   HG11  VAL  32          HG11      VAL  32 -25.886  -1.397   6.057
  243   HG12  VAL  32          HG12      VAL  32 -27.578  -0.931   6.223
  244   HG13  VAL  32          HG13      VAL  32 -26.626  -1.329   7.656
  245   HG21  VAL  32          HG21      VAL  32 -27.178   0.915   8.673
  246   HG22  VAL  32          HG22      VAL  32 -28.171   1.246   7.255
  247   HG23  VAL  32          HG23      VAL  32 -26.905   2.379   7.728
  248    H    PHE  33           HN       PHE  33 -23.682   1.249   5.172
  249    HA   PHE  33           HA       PHE  33 -22.879  -1.394   4.440
  250    HB2  PHE  33           HB2      PHE  33 -22.631   1.298   3.234
  251    HB3  PHE  33           HB1      PHE  33 -21.392   0.153   2.787
  252    HD1  PHE  33           HD1      PHE  33 -23.489   1.477   1.026
  253    HD2  PHE  33           HD2      PHE  33 -23.374  -2.271   3.032
  254    HE1  PHE  33           HE1      PHE  33 -25.001   0.532  -0.668
  255    HE2  PHE  33           HE2      PHE  33 -24.891  -3.225   1.347
  256    HZ   PHE  33           HZ       PHE  33 -25.703  -1.823  -0.510
  257    H    LYS  34           HN       LYS  34 -21.360   1.050   6.373
  258    HA   LYS  34           HA       LYS  34 -18.694   0.078   5.902
  259    HB2  LYS  34           HB2      LYS  34 -19.894   1.999   7.892
  260    HB3  LYS  34           HB1      LYS  34 -18.236   1.513   8.026
  261    HG2  LYS  34           HG2      LYS  34 -17.984   2.367   5.605
  262    HG3  LYS  34           HG1      LYS  34 -19.548   3.137   5.875
  263    HD2  LYS  34           HD2      LYS  34 -17.667   4.687   6.307
  264    HD3  LYS  34           HD1      LYS  34 -18.615   4.374   7.769
  265    HE2  LYS  34           HE2      LYS  34 -16.164   4.353   8.154
  266    HE3  LYS  34           HE1      LYS  34 -16.936   2.823   8.565
  267    HZ1  LYS  34           HZ1      LYS  34 -16.174   1.917   6.458
  268    HZ2  LYS  34           HZ2      LYS  34 -14.862   2.505   7.350
  269    HZ3  LYS  34           HZ3      LYS  34 -15.463   3.402   6.051
  270    H    GLN  35           HN       GLN  35 -21.252  -0.415   8.247
  271    HA   GLN  35           HA       GLN  35 -19.722  -2.201   9.867
  272    HB2  GLN  35           HB2      GLN  35 -21.748  -1.022  10.723
  273    HB3  GLN  35           HB1      GLN  35 -22.741  -1.991   9.641
  274    HG2  GLN  35           HG2      GLN  35 -22.726  -2.835  11.954
  275    HG3  GLN  35           HG1      GLN  35 -22.118  -4.013  10.792
  276   HE21  GLN  35          HE21      GLN  35 -20.930  -5.152  12.294
  277   HE22  GLN  35          HE22      GLN  35 -19.485  -4.532  13.011
  278    H    TYR  36           HN       TYR  36 -21.738  -2.451   7.038
  279    HA   TYR  36           HA       TYR  36 -21.950  -5.259   6.888
  280    HB2  TYR  36           HB2      TYR  36 -23.347  -3.981   5.438
  281    HB3  TYR  36           HB1      TYR  36 -21.985  -3.064   4.812
  282    HD1  TYR  36           HD1      TYR  36 -20.726  -3.851   2.945
  283    HD2  TYR  36           HD2      TYR  36 -23.627  -6.346   4.786
  284    HE1  TYR  36           HE1      TYR  36 -20.557  -5.430   1.065
  285    HE2  TYR  36           HE2      TYR  36 -23.482  -7.929   2.928
  286    HH   TYR  36           HH       TYR  36 -21.005  -7.751   0.556
  287    H    ALA  37           HN       ALA  37 -19.642  -2.980   5.448
  288    HA   ALA  37           HA       ALA  37 -17.955  -4.919   4.275
  289    HB1  ALA  37           HB1      ALA  37 -17.365  -2.084   5.151
  290    HB2  ALA  37           HB2      ALA  37 -17.930  -2.598   3.563
  291    HB3  ALA  37           HB3      ALA  37 -16.324  -3.067   4.122
  292    H    ASN  38           HN       ASN  38 -18.167  -3.497   7.459
  293    HA   ASN  38           HA       ASN  38 -15.692  -4.245   8.540
  294    HB2  ASN  38           HB2      ASN  38 -17.192  -2.716   9.759
  295    HB3  ASN  38           HB1      ASN  38 -18.407  -3.983   9.899
  296   HD21  ASN  38          HD21      ASN  38 -15.604  -2.574  11.332
  297   HD22  ASN  38          HD22      ASN  38 -15.443  -3.736  12.669
  298    H    ASP  39           HN       ASP  39 -18.730  -6.019   8.276
  299    HA   ASP  39           HA       ASP  39 -17.913  -8.275   9.770
  300    HB2  ASP  39           HB2      ASP  39 -20.267  -7.793   9.349
  301    HB3  ASP  39           HB1      ASP  39 -20.028  -8.030   7.621
  302    H    ASN  40           HN       ASN  40 -17.166  -7.247   6.596
  303    HA   ASN  40           HA       ASN  40 -16.272  -9.942   5.840
  304    HB2  ASN  40           HB2      ASN  40 -16.844  -7.483   4.175
  305    HB3  ASN  40           HB1      ASN  40 -15.949  -8.860   3.542
  306   HD21  ASN  40          HD21      ASN  40 -19.068  -7.657   4.507
  307   HD22  ASN  40          HD22      ASN  40 -19.987  -9.070   3.975
  308    H    GLY  41           HN       GLY  41 -15.114  -7.396   7.432
  309    HA2  GLY  41           HA2      GLY  41 -12.985  -6.773   8.031
  310    HA3  GLY  41           HA1      GLY  41 -12.398  -8.136   7.093
  311    H    VAL  42           HN       VAL  42 -14.358  -5.735   5.507
  312    HA   VAL  42           HA       VAL  42 -11.961  -4.825   4.089
  313    HB   VAL  42           HB       VAL  42 -14.850  -4.833   3.171
  314   HG11  VAL  42          HG11      VAL  42 -13.519  -2.981   2.262
  315   HG12  VAL  42          HG12      VAL  42 -13.943  -4.152   1.010
  316   HG13  VAL  42          HG13      VAL  42 -12.314  -4.129   1.686
  317   HG21  VAL  42          HG21      VAL  42 -12.496  -6.569   2.421
  318   HG22  VAL  42          HG22      VAL  42 -14.058  -6.573   1.596
  319   HG23  VAL  42          HG23      VAL  42 -13.950  -7.070   3.285
  320    H    ASP  43           HN       ASP  43 -11.319  -2.864   4.492
  321    HA   ASP  43           HA       ASP  43 -13.220  -0.718   4.833
  322    HB2  ASP  43           HB2      ASP  43 -12.895  -1.557   7.185
  323    HB3  ASP  43           HB1      ASP  43 -11.181  -1.188   7.028
  324    H    GLY  44           HN       GLY  44 -12.394   0.288   3.055
  325    HA2  GLY  44           HA2      GLY  44  -9.578   1.109   3.189
  326    HA3  GLY  44           HA1      GLY  44 -10.299   0.517   1.702
  327    H    GLU  45           HN       GLU  45  -9.457   2.656   0.987
  328    HA   GLU  45           HA       GLU  45 -10.498   5.111   1.836
  329    HB2  GLU  45           HB2      GLU  45  -9.657   4.257  -0.944
  330    HB3  GLU  45           HB1      GLU  45  -9.867   5.921  -0.412
  331    HG2  GLU  45           HG2      GLU  45  -8.033   5.752   1.098
  332    HG3  GLU  45           HG1      GLU  45  -7.924   4.012   0.858
  333    H    TRP  46           HN       TRP  46 -12.387   6.097   1.550
  334    HA   TRP  46           HA       TRP  46 -14.474   4.610   0.118
  335    HB2  TRP  46           HB2      TRP  46 -14.572   6.331   2.562
  336    HB3  TRP  46           HB1      TRP  46 -15.961   6.388   1.494
  337    HD1  TRP  46           HD1      TRP  46 -13.792   3.623   3.158
  338    HE1  TRP  46           HE1      TRP  46 -15.314   1.694   3.887
  339    HE3  TRP  46           HE3      TRP  46 -18.333   5.463   1.568
  340    HZ2  TRP  46           HZ2      TRP  46 -18.028   1.038   3.834
  341    HZ3  TRP  46           HZ3      TRP  46 -20.334   4.104   1.992
  342    HH2  TRP  46           HH2      TRP  46 -20.180   1.935   3.084
  343    H    THR  47           HN       THR  47 -14.939   5.298  -1.818
  344    HA   THR  47           HA       THR  47 -14.850   8.188  -2.397
  345    HB   THR  47           HB       THR  47 -14.577   7.430  -4.822
  346    HG1  THR  47           HG1      THR  47 -14.139   5.350  -5.239
  347   HG21  THR  47          HG21      THR  47 -12.406   6.790  -2.823
  348   HG22  THR  47          HG22      THR  47 -12.695   8.338  -3.620
  349   HG23  THR  47          HG23      THR  47 -12.153   6.951  -4.560
  350    H    TYR  48           HN       TYR  48 -16.473   8.878  -4.103
  351    HA   TYR  48           HA       TYR  48 -18.844   7.197  -4.216
  352    HB2  TYR  48           HB2      TYR  48 -19.256   8.341  -2.144
  353    HB3  TYR  48           HB1      TYR  48 -18.889   9.897  -2.830
  354    HD1  TYR  48           HD1      TYR  48 -21.402   7.137  -2.785
  355    HD2  TYR  48           HD2      TYR  48 -20.567  11.148  -4.008
  356    HE1  TYR  48           HE1      TYR  48 -23.759   7.468  -3.330
  357    HE2  TYR  48           HE2      TYR  48 -22.939  11.466  -4.535
  358    HH   TYR  48           HH       TYR  48 -24.902  10.099  -5.114
  359    H    ASP  49           HN       ASP  49 -20.492   8.024  -5.648
  360    HA   ASP  49           HA       ASP  49 -19.598  10.053  -7.592
  361    HB2  ASP  49           HB2      ASP  49 -18.834   7.933  -8.626
  362    HB3  ASP  49           HB1      ASP  49 -20.434   7.240  -8.473
  363    H    ASP  50           HN       ASP  50 -21.342  11.320  -8.252
  364    HA   ASP  50           HA       ASP  50 -23.765  10.885  -6.680
  365    HB2  ASP  50           HB2      ASP  50 -24.313  13.180  -7.235
  366    HB3  ASP  50           HB1      ASP  50 -22.555  13.186  -7.031
  367    H    ALA  51           HN       ALA  51 -22.776  10.434  -9.979
  368    HA   ALA  51           HA       ALA  51 -25.443  10.530 -11.037
  369    HB1  ALA  51           HB1      ALA  51 -23.537  11.083 -12.440
  370    HB2  ALA  51           HB2      ALA  51 -24.442   9.726 -13.115
  371    HB3  ALA  51           HB3      ALA  51 -22.921   9.441 -12.271
  372    H    THR  52           HN       THR  52 -23.261   7.966  -9.960
  373    HA   THR  52           HA       THR  52 -25.227   5.955 -10.731
  374    HB   THR  52           HB       THR  52 -23.385   4.351  -9.944
  375    HG1  THR  52           HG1      THR  52 -21.881   6.785 -10.077
  376   HG21  THR  52          HG21      THR  52 -22.080   4.690 -12.026
  377   HG22  THR  52          HG22      THR  52 -22.866   6.255 -12.241
  378   HG23  THR  52          HG23      THR  52 -23.820   4.774 -12.309
  379    H    LYS  53           HN       LYS  53 -24.317   7.690  -7.967
  380    HA   LYS  53           HA       LYS  53 -24.932   7.601  -5.743
  381    HB2  LYS  53           HB2      LYS  53 -26.850   5.411  -6.545
  382    HB3  LYS  53           HB1      LYS  53 -26.915   6.383  -5.086
  383    HG2  LYS  53           HG2      LYS  53 -27.372   7.317  -7.904
  384    HG3  LYS  53           HG1      LYS  53 -28.576   7.156  -6.624
  385    HD2  LYS  53           HD2      LYS  53 -27.442   8.910  -5.347
  386    HD3  LYS  53           HD1      LYS  53 -26.227   9.053  -6.622
  387    HE2  LYS  53           HE2      LYS  53 -28.137   9.577  -8.189
  388    HE3  LYS  53           HE1      LYS  53 -29.162   9.708  -6.762
  389    HZ1  LYS  53           HZ1      LYS  53 -26.798  11.371  -7.430
  390    HZ2  LYS  53           HZ2      LYS  53 -27.578  11.409  -5.927
  391    HZ3  LYS  53           HZ3      LYS  53 -28.417  11.878  -7.328
  392    H    THR  54           HN       THR  54 -23.136   5.553  -7.185
  393    HA   THR  54           HA       THR  54 -23.151   3.297  -5.403
  394    HB   THR  54           HB       THR  54 -21.173   4.013  -7.588
  395    HG1  THR  54           HG1      THR  54 -23.687   3.341  -7.816
  396   HG21  THR  54          HG21      THR  54 -20.636   1.585  -7.551
  397   HG22  THR  54          HG22      THR  54 -21.671   1.395  -6.138
  398   HG23  THR  54          HG23      THR  54 -20.220   2.389  -6.035
  399    H    TYR  55           HN       TYR  55 -21.907   2.964  -3.680
  400    HA   TYR  55           HA       TYR  55 -19.820   4.923  -3.010
  401    HB2  TYR  55           HB2      TYR  55 -21.350   2.915  -1.344
  402    HB3  TYR  55           HB1      TYR  55 -19.799   3.520  -0.801
  403    HD1  TYR  55           HD1      TYR  55 -19.574   5.729   0.087
  404    HD2  TYR  55           HD2      TYR  55 -23.297   4.445  -1.524
  405    HE1  TYR  55           HE1      TYR  55 -20.678   7.684   1.091
  406    HE2  TYR  55           HE2      TYR  55 -24.407   6.399  -0.520
  407    HH   TYR  55           HH       TYR  55 -23.967   7.945   1.465
  408    H    THR  56           HN       THR  56 -17.700   4.323  -3.078
  409    HA   THR  56           HA       THR  56 -17.217   1.518  -3.845
  410    HB   THR  56           HB       THR  56 -15.657   3.925  -4.821
  411    HG1  THR  56           HG1      THR  56 -18.027   3.457  -5.495
  412   HG21  THR  56          HG21      THR  56 -14.789   2.345  -6.499
  413   HG22  THR  56          HG22      THR  56 -15.706   1.044  -5.738
  414   HG23  THR  56          HG23      THR  56 -14.389   1.826  -4.861
  415    H    VAL  57           HN       VAL  57 -16.162   0.489  -2.268
  416    HA   VAL  57           HA       VAL  57 -14.290   2.031  -0.594
  417    HB   VAL  57           HB       VAL  57 -16.036   0.942   0.799
  418   HG11  VAL  57          HG11      VAL  57 -15.944  -1.566   1.073
  419   HG12  VAL  57          HG12      VAL  57 -15.024  -1.614  -0.427
  420   HG13  VAL  57          HG13      VAL  57 -16.675  -0.997  -0.423
  421   HG21  VAL  57          HG21      VAL  57 -14.549  -0.170   2.374
  422   HG22  VAL  57          HG22      VAL  57 -13.801   1.283   1.712
  423   HG23  VAL  57          HG23      VAL  57 -13.307  -0.308   1.130
  424    H    THR  58           HN       THR  58 -12.269   1.840  -1.193
  425    HA   THR  58           HA       THR  58 -11.500  -0.582  -2.706
  426    HB   THR  58           HB       THR  58 -10.077   2.066  -2.836
  427    HG1  THR  58           HG1      THR  58 -12.335   2.292  -3.397
  428   HG21  THR  58          HG21      THR  58 -10.300  -0.276  -4.740
  429   HG22  THR  58          HG22      THR  58  -8.896   0.138  -3.759
  430   HG23  THR  58          HG23      THR  58  -9.411   1.216  -5.056
  431    H    GLU  59           HN       GLU  59 -10.126  -1.895  -1.788
  432    HA   GLU  59           HA       GLU  59  -8.683  -1.236   0.602
  433    HB2  GLU  59           HB2      GLU  59  -8.546  -3.655  -1.212
  434    HB3  GLU  59           HB1      GLU  59  -7.532  -3.474   0.195
  435    HG2  GLU  59           HG2      GLU  59 -10.533  -3.444   0.310
  436    HG3  GLU  59           HG1      GLU  59  -9.542  -4.881   0.551
  437    H    GLY  60           HN       GLY  60  -6.304  -1.158   0.795
  438    HA2  GLY  60           HA2      GLY  60  -4.368  -1.280  -1.047
  439    HA3  GLY  60           HA1      GLY  60  -5.153   0.226  -1.508
  440    H    SER  61           HN       SER  61  -2.528  -0.726  -0.138
  441    HA   SER  61           HA       SER  61  -2.229   1.632   1.470
  442    HB2  SER  61           HB2      SER  61  -1.377   0.232   3.463
  443    HB3  SER  61           HB1      SER  61  -3.124   0.318   3.239
  444    HG   SER  61           HG       SER  61  -3.034  -1.775   3.212
  445    H    GLY  62           HN       GLY  62  -0.871  -1.481   0.488
  446    HA2  GLY  62           HA2      GLY  62   1.804  -0.284   0.428
  447    HA3  GLY  62           HA1      GLY  62   1.438  -2.000   0.328
  448    H    GLY  63           HN       GLY  63   0.553   0.943  -1.495
  449    HA2  GLY  63           HA2      GLY  63   0.700  -0.625  -3.962
  450    HA3  GLY  63           HA1      GLY  63   0.038   0.997  -3.798
  451    H    ALA  64           HN       ALA  64   2.982   0.601  -2.213
  452    HA   ALA  64           HA       ALA  64   4.611   1.403  -4.480
  453    HB1  ALA  64           HB1      ALA  64   3.669   3.509  -3.615
  454    HB2  ALA  64           HB2      ALA  64   5.419   3.428  -3.406
  455    HB3  ALA  64           HB3      ALA  64   4.353   3.141  -2.031
  456    H    GLY  65           HN       GLY  65   6.939   1.973  -3.408
  457    HA2  GLY  65           HA2      GLY  65   7.568  -0.407  -1.810
  458    HA3  GLY  65           HA1      GLY  65   8.718   0.510  -2.773
  459    H    GLY  66           HN       GLY  66   7.112   0.208   0.268
  460    HA2  GLY  66           HA2      GLY  66   8.190   2.704   1.296
  461    HA3  GLY  66           HA1      GLY  66   7.199   1.550   2.177
  462    H    GLN  67           HN       GLN  67   9.988   0.538   0.422
  463    HA   GLN  67           HA       GLN  67  11.929   0.682   2.444
  464    HB2  GLN  67           HB2      GLN  67  10.710  -0.961   3.683
  465    HB3  GLN  67           HB1      GLN  67  10.406  -1.940   2.224
  466    HG2  GLN  67           HG2      GLN  67  12.076  -3.001   3.586
  467    HG3  GLN  67           HG1      GLN  67  12.814  -2.425   2.093
  468   HE21  GLN  67          HE21      GLN  67  14.869  -2.298   2.855
  469   HE22  GLN  67          HE22      GLN  67  15.376  -1.172   4.072
  470    H    GLY  68           HN       GLY  68  10.773  -1.535  -0.098
  471    HA2  GLY  68           HA2      GLY  68  11.715  -1.934  -2.183
  472    HA3  GLY  68           HA1      GLY  68  13.027  -0.842  -1.766
  473    H    MET  69           HN       MET  69  12.102  -3.436   0.331
  474    HA   MET  69           HA       MET  69  13.135  -5.319   1.044
  475    HB2  MET  69           HB2      MET  69  14.326  -5.279  -1.734
  476    HB3  MET  69           HB1      MET  69  14.518  -6.608  -0.596
  477    HG2  MET  69           HG2      MET  69  11.894  -5.610  -1.683
  478    HG3  MET  69           HG1      MET  69  12.769  -7.028  -2.258
  479    HE1  MET  69           HE1      MET  69  10.526  -8.442  -1.920
  480    HE2  MET  69           HE2      MET  69   9.693  -7.023  -1.285
  481    HE3  MET  69           HE3      MET  69   9.655  -8.542  -0.389
  482    H    ILE  70           HN       ILE  70  15.712  -6.287   0.620
  483    HA   ILE  70           HA       ILE  70  17.845  -6.078   1.340
  484    HB   ILE  70           HB       ILE  70  17.627  -3.144   0.570
  485   HG12  ILE  70          HG12      ILE  70  18.432  -5.484  -1.179
  486   HG13  ILE  70          HG11      ILE  70  16.876  -4.661  -1.263
  487   HG21  ILE  70          HG21      ILE  70  20.063  -4.965   0.547
  488   HG22  ILE  70          HG22      ILE  70  19.691  -3.823   1.841
  489   HG23  ILE  70          HG23      ILE  70  20.032  -3.234   0.213
  490   HD11  ILE  70          HD11      ILE  70  18.031  -2.594  -1.904
  491   HD12  ILE  70          HD12      ILE  70  18.364  -3.913  -3.026
  492   HD13  ILE  70          HD13      ILE  70  19.576  -3.440  -1.832
  493    H    GLN  71           HN       GLN  71  15.987  -6.045   3.296
  494    HA   GLN  71           HA       GLN  71  16.878  -3.944   5.157
  495    HB2  GLN  71           HB2      GLN  71  14.369  -4.292   4.676
  496    HB3  GLN  71           HB1      GLN  71  14.517  -5.762   5.640
  497    HG2  GLN  71           HG2      GLN  71  15.283  -4.433   7.548
  498    HG3  GLN  71           HG1      GLN  71  15.130  -2.964   6.586
  499   HE21  GLN  71          HE21      GLN  71  13.101  -2.147   6.143
  500   HE22  GLN  71          HE22      GLN  71  11.684  -2.684   6.977
  501    H    GLU  72           HN       GLU  72  17.964  -6.679   4.275
  502    HA   GLU  72           HA       GLU  72  18.041  -8.372   6.492
  503    HB2  GLU  72           HB2      GLU  72  19.967  -9.434   5.492
  504    HB3  GLU  72           HB1      GLU  72  18.795  -9.054   4.241
  505    HG2  GLU  72           HG2      GLU  72  20.106  -7.160   3.525
  506    HG3  GLU  72           HG1      GLU  72  21.230  -7.410   4.861
  507    HA   PRO  73           HA       PRO  73  20.489  -5.962   9.241
  508    HB2  PRO  73           HB2      PRO  73  20.835  -7.744  11.219
  509    HB3  PRO  73           HB1      PRO  73  19.213  -7.044  10.854
  510    HG2  PRO  73           HG2      PRO  73  20.371  -9.705  10.029
  511    HG3  PRO  73           HG1      PRO  73  18.758  -9.340  10.679
  512    HD2  PRO  73           HD2      PRO  73  19.270  -9.675   8.015
  513    HD3  PRO  73           HD1      PRO  73  17.957  -8.625   8.642
  514    H    ALA  74           HN       ALA  74  22.459  -6.054  10.489
  515    HA   ALA  74           HA       ALA  74  24.457  -8.010  10.011
  516    HB1  ALA  74           HB1      ALA  74  26.062  -6.549   8.851
  517    HB2  ALA  74           HB2      ALA  74  24.823  -5.299   8.712
  518    HB3  ALA  74           HB3      ALA  74  24.625  -6.836   7.871
  519    H    LEU  75           HN       LEU  75  26.066  -7.833  11.580
  520    HA   LEU  75           HA       LEU  75  25.509  -5.766  13.574
  521    HB2  LEU  75           HB2      LEU  75  26.834  -8.443  13.814
  522    HB3  LEU  75           HB1      LEU  75  26.928  -7.250  15.081
  523    HG   LEU  75           HG       LEU  75  25.225  -8.815  15.667
  524   HD11  LEU  75          HD11      LEU  75  24.769  -6.481  16.192
  525   HD12  LEU  75          HD12      LEU  75  23.286  -7.379  15.882
  526   HD13  LEU  75          HD13      LEU  75  23.932  -6.291  14.650
  527   HD21  LEU  75          HD21      LEU  75  23.246  -9.209  14.261
  528   HD22  LEU  75          HD22      LEU  75  24.736  -9.760  13.498
  529   HD23  LEU  75          HD23      LEU  75  23.987  -8.251  12.976
  530    HA   PRO  76           HA       PRO  76  29.401  -3.823  12.432
  531    HB2  PRO  76           HB2      PRO  76  28.992  -2.444  15.050
  532    HB3  PRO  76           HB1      PRO  76  29.263  -1.720  13.459
  533    HG2  PRO  76           HG2      PRO  76  26.848  -1.612  14.561
  534    HG3  PRO  76           HG1      PRO  76  27.035  -2.005  12.806
  535    HD2  PRO  76           HD2      PRO  76  26.547  -3.925  15.120
  536    HD3  PRO  76           HD1      PRO  76  25.753  -3.843  13.530
  537    HA   PRO  77           HA       PRO  77  32.512  -6.097  14.602
  538    HB2  PRO  77           HB2      PRO  77  33.850  -3.402  14.731
  539    HB3  PRO  77           HB1      PRO  77  34.557  -4.970  14.305
  540    HG2  PRO  77           HG2      PRO  77  33.951  -3.366  12.352
  541    HG3  PRO  77           HG1      PRO  77  33.395  -5.054  12.262
  542    HD2  PRO  77           HD2      PRO  77  31.805  -2.598  13.028
  543    HD3  PRO  77           HD1      PRO  77  31.353  -3.962  11.938
  544    H    GLY  78           HN       GLY  78  32.291  -6.727  16.626
  545    HA2  GLY  78           HA2      GLY  78  32.658  -6.448  18.956
  546    HA3  GLY  78           HA1      GLY  78  32.361  -4.727  18.783
  547    H    TRP  79           HN       TRP  79  29.850  -5.264  17.181
  548    HA   TRP  79           HA       TRP  79  28.117  -5.589  19.509
  549    HB2  TRP  79           HB2      TRP  79  27.544  -4.927  16.611
  550    HB3  TRP  79           HB1      TRP  79  26.270  -5.258  17.770
  551    HD1  TRP  79           HD1      TRP  79  29.019  -2.655  17.052
  552    HE1  TRP  79           HE1      TRP  79  28.409  -0.475  18.269
  553    HE3  TRP  79           HE3      TRP  79  24.924  -4.285  19.684
  554    HZ2  TRP  79           HZ2      TRP  79  26.482   0.434  20.108
  555    HZ3  TRP  79           HZ3      TRP  79  23.777  -2.685  21.161
  556    HH2  TRP  79           HH2      TRP  79  24.537  -0.381  21.363
  557    H    GLU  80           HN       GLU  80  27.158  -7.498  20.083
  558    HA   GLU  80           HA       GLU  80  27.056  -9.613  18.046
  559    HB2  GLU  80           HB2      GLU  80  27.505  -9.913  21.025
  560    HB3  GLU  80           HB1      GLU  80  27.324 -11.255  19.903
  561    HG2  GLU  80           HG2      GLU  80  29.329 -10.350  18.687
  562    HG3  GLU  80           HG1      GLU  80  29.562  -9.252  20.050
  563    H    MET  81           HN       MET  81  25.179 -10.691  17.789
  564    HA   MET  81           HA       MET  81  22.921  -9.837  19.465
  565    HB2  MET  81           HB2      MET  81  22.649  -9.370  17.057
  566    HB3  MET  81           HB1      MET  81  22.889 -11.103  16.708
  567    HG2  MET  81           HG2      MET  81  20.862 -11.648  17.904
  568    HG3  MET  81           HG1      MET  81  20.641  -9.965  18.375
  569    HE1  MET  81           HE1      MET  81  20.343 -11.478  14.022
  570    HE2  MET  81           HE2      MET  81  20.733 -12.508  15.402
  571    HE3  MET  81           HE3      MET  81  21.878 -11.279  14.868
  572    H    LYS  82           HN       LYS  82  21.980 -11.361  20.783
  573    HA   LYS  82           HA       LYS  82  22.464 -14.169  20.257
  574    HB2  LYS  82           HB2      LYS  82  23.442 -12.895  22.843
  575    HB3  LYS  82           HB1      LYS  82  23.335 -14.620  22.552
  576    HG2  LYS  82           HG2      LYS  82  25.032 -14.585  20.921
  577    HG3  LYS  82           HG1      LYS  82  24.966 -12.803  20.802
  578    HD2  LYS  82           HD2      LYS  82  25.894 -12.589  23.013
  579    HD3  LYS  82           HD1      LYS  82  25.846 -14.339  23.252
  580    HE2  LYS  82           HE2      LYS  82  27.500 -14.684  21.550
  581    HE3  LYS  82           HE1      LYS  82  27.418 -12.998  21.050
  582    HZ1  LYS  82           HZ1      LYS  82  29.347 -13.818  22.535
  583    HZ2  LYS  82           HZ2      LYS  82  28.232 -13.645  23.807
  584    HZ3  LYS  82           HZ3      LYS  82  28.640 -12.312  22.843
  585    H    TYR  83           HN       TYR  83  21.045 -15.562  21.533
  586    HA   TYR  83           HA       TYR  83  18.678 -14.052  22.461
  587    HB2  TYR  83           HB2      TYR  83  18.774 -16.716  20.981
  588    HB3  TYR  83           HB1      TYR  83  17.280 -15.933  21.565
  589    HD1  TYR  83           HD1      TYR  83  19.861 -15.989  18.996
  590    HD2  TYR  83           HD2      TYR  83  16.488 -13.873  20.474
  591    HE1  TYR  83           HE1      TYR  83  19.702 -14.775  16.865
  592    HE2  TYR  83           HE2      TYR  83  16.319 -12.645  18.354
  593    HH   TYR  83           HH       TYR  83  18.192 -13.511  15.566
  594    H    THR  84           HN       THR  84  17.304 -15.138  24.007
  595    HA   THR  84           HA       THR  84  18.848 -16.781  25.874
  596    HB   THR  84           HB       THR  84  17.289 -16.183  27.573
  597    HG1  THR  84           HG1      THR  84  15.296 -15.143  27.068
  598   HG21  THR  84          HG21      THR  84  17.630 -13.770  25.785
  599   HG22  THR  84          HG22      THR  84  18.767 -14.339  27.007
  600   HG23  THR  84          HG23      THR  84  17.187 -13.722  27.490
  601    H    SER  85           HN       SER  85  17.404 -18.538  27.000
  602    HA   SER  85           HA       SER  85  16.529 -20.308  24.942
  603    HB2  SER  85           HB2      SER  85  17.802 -21.020  26.954
  604    HB3  SER  85           HB1      SER  85  16.360 -20.686  27.881
  605    HG   SER  85           HG       SER  85  16.952 -22.936  26.730
  606    H    GLU  86           HN       GLU  86  14.944 -17.788  25.773
  607    HA   GLU  86           HA       GLU  86  12.317 -19.147  26.102
  608    HB2  GLU  86           HB2      GLU  86  13.105 -16.403  27.160
  609    HB3  GLU  86           HB1      GLU  86  11.546 -17.189  27.384
  610    HG2  GLU  86           HG2      GLU  86  12.489 -18.845  28.792
  611    HG3  GLU  86           HG1      GLU  86  14.129 -18.339  28.388
  612    H    GLY  87           HN       GLY  87  14.217 -17.694  23.949
  613    HA2  GLY  87           HA2      GLY  87  13.708 -16.839  21.865
  614    HA3  GLY  87           HA1      GLY  87  12.019 -16.764  22.343
  615    H    VAL  88           HN       VAL  88  14.332 -15.298  24.429
  616    HA   VAL  88           HA       VAL  88  13.256 -12.670  23.729
  617    HB   VAL  88           HB       VAL  88  14.877 -13.527  26.140
  618   HG11  VAL  88          HG11      VAL  88  14.380 -11.334  27.065
  619   HG12  VAL  88          HG12      VAL  88  13.517 -10.892  25.592
  620   HG13  VAL  88          HG13      VAL  88  15.259 -11.167  25.547
  621   HG21  VAL  88          HG21      VAL  88  11.969 -12.795  25.907
  622   HG22  VAL  88          HG22      VAL  88  12.819 -13.256  27.384
  623   HG23  VAL  88          HG23      VAL  88  12.601 -14.428  26.088
  624    H    ARG  89           HN       ARG  89  14.577 -10.968  23.169
  625    HA   ARG  89           HA       ARG  89  17.136 -11.755  21.982
  626    HB2  ARG  89           HB2      ARG  89  15.007 -10.388  20.961
  627    HB3  ARG  89           HB1      ARG  89  16.029  -9.065  21.499
  628    HG2  ARG  89           HG2      ARG  89  17.871  -9.993  20.140
  629    HG3  ARG  89           HG1      ARG  89  16.758 -11.230  19.539
  630    HD2  ARG  89           HD2      ARG  89  15.253  -9.192  18.935
  631    HD3  ARG  89           HD1      ARG  89  16.757  -8.277  19.053
  632    HE   ARG  89           HE       ARG  89  17.383 -10.364  17.422
  633   HH11  ARG  89          HH11      ARG  89  14.973  -7.829  17.419
  634   HH12  ARG  89          HH12      ARG  89  14.768  -7.859  15.688
  635   HH21  ARG  89          HH21      ARG  89  17.120 -10.424  15.158
  636   HH22  ARG  89          HH22      ARG  89  15.983  -9.363  14.397
  637    H    TYR  90           HN       TYR  90  19.048 -11.007  22.805
  638    HA   TYR  90           HA       TYR  90  18.984  -8.439  24.167
  639    HB2  TYR  90           HB2      TYR  90  20.348  -9.117  26.015
  640    HB3  TYR  90           HB1      TYR  90  18.961 -10.177  25.943
  641    HD1  TYR  90           HD1      TYR  90  22.525  -9.999  26.074
  642    HD2  TYR  90           HD2      TYR  90  19.274 -12.496  24.942
  643    HE1  TYR  90           HE1      TYR  90  24.030 -11.948  26.078
  644    HE2  TYR  90           HE2      TYR  90  20.758 -14.450  24.951
  645    HH   TYR  90           HH       TYR  90  23.157 -14.937  24.704
  646    H    PHE  91           HN       PHE  91  21.135  -7.351  24.132
  647    HA   PHE  91           HA       PHE  91  22.751  -8.419  21.920
  648    HB2  PHE  91           HB2      PHE  91  21.875  -5.597  22.446
  649    HB3  PHE  91           HB1      PHE  91  23.364  -5.923  21.574
  650    HD1  PHE  91           HD1      PHE  91  19.774  -7.033  21.512
  651    HD2  PHE  91           HD2      PHE  91  23.270  -6.011  19.303
  652    HE1  PHE  91           HE1      PHE  91  18.542  -7.348  19.417
  653    HE2  PHE  91           HE2      PHE  91  22.031  -6.315  17.198
  654    HZ   PHE  91           HZ       PHE  91  19.663  -6.989  17.252
  655    H    VAL  92           HN       VAL  92  24.965  -8.180  22.037
  656    HA   VAL  92           HA       VAL  92  25.955  -7.677  24.772
  657    HB   VAL  92           HB       VAL  92  27.071  -9.583  22.703
  658   HG11  VAL  92          HG11      VAL  92  28.438 -10.443  24.544
  659   HG12  VAL  92          HG12      VAL  92  27.817  -9.169  25.595
  660   HG13  VAL  92          HG13      VAL  92  28.797  -8.754  24.187
  661   HG21  VAL  92          HG21      VAL  92  25.441 -10.153  25.173
  662   HG22  VAL  92          HG22      VAL  92  26.236 -11.367  24.170
  663   HG23  VAL  92          HG23      VAL  92  24.937 -10.383  23.496
  664    H    ASP  93           HN       ASP  93  26.977  -5.753  24.787
  665    HA   ASP  93           HA       ASP  93  28.454  -4.735  22.486
  666    HB2  ASP  93           HB2      ASP  93  27.830  -3.742  25.238
  667    HB3  ASP  93           HB1      ASP  93  29.426  -3.312  24.639
  668    H    HIS  94           HN       HIS  94  29.973  -6.428  22.026
  669    HA   HIS  94           HA       HIS  94  31.475  -7.634  24.156
  670    HB2  HIS  94           HB2      HIS  94  30.751  -8.714  21.927
  671    HB3  HIS  94           HB1      HIS  94  32.135  -7.882  21.232
  672    HD1  HIS  94           HD1      HIS  94  33.702  -9.777  20.799
  673    HD2  HIS  94           HD2      HIS  94  32.122  -9.863  24.644
  674    HE1  HIS  94           HE1      HIS  94  34.936 -11.608  21.996
  675    HE2  HIS  94           HE2      HIS  94  34.120 -11.486  24.380
  676    H    ASN  95           HN       ASN  95  31.773  -4.698  22.718
  677    HA   ASN  95           HA       ASN  95  34.638  -4.586  22.511
  678    HB2  ASN  95           HB2      ASN  95  34.279  -2.103  22.311
  679    HB3  ASN  95           HB1      ASN  95  33.341  -3.043  21.152
  680   HD21  ASN  95          HD21      ASN  95  31.127  -3.151  21.362
  681   HD22  ASN  95          HD22      ASN  95  30.227  -2.076  22.375
  682    H    THR  96           HN       THR  96  32.224  -3.528  24.897
  683    HA   THR  96           HA       THR  96  34.380  -3.100  26.833
  684    HB   THR  96           HB       THR  96  32.474  -2.162  28.264
  685    HG1  THR  96           HG1      THR  96  30.624  -2.827  27.316
  686   HG21  THR  96          HG21      THR  96  34.059  -0.701  27.138
  687   HG22  THR  96          HG22      THR  96  32.437  -0.014  27.069
  688   HG23  THR  96          HG23      THR  96  33.120  -0.800  25.646
  689    H    ARG  97           HN       ARG  97  32.094  -5.325  25.863
  690    HA   ARG  97           HA       ARG  97  31.354  -7.322  26.606
  691    HB2  ARG  97           HB2      ARG  97  33.579  -6.956  28.599
  692    HB3  ARG  97           HB1      ARG  97  32.547  -8.382  28.571
  693    HG2  ARG  97           HG2      ARG  97  33.179  -8.713  26.199
  694    HG3  ARG  97           HG1      ARG  97  34.334  -7.392  26.367
  695    HD2  ARG  97           HD2      ARG  97  35.472  -9.508  26.644
  696    HD3  ARG  97           HD1      ARG  97  35.456  -8.622  28.165
  697    HE   ARG  97           HE       ARG  97  33.392 -10.648  27.726
  698   HH11  ARG  97          HH11      ARG  97  36.335  -9.653  29.322
  699   HH12  ARG  97          HH12      ARG  97  36.256 -10.900  30.534
  700   HH21  ARG  97          HH21      ARG  97  33.262 -12.265  29.328
  701   HH22  ARG  97          HH22      ARG  97  34.486 -12.366  30.556
  702    H    THR  98           HN       THR  98  29.564  -5.940  26.945
  703    HA   THR  98           HA       THR  98  28.519  -6.272  29.659
  704    HB   THR  98           HB       THR  98  27.349  -3.944  29.247
  705    HG1  THR  98           HG1      THR  98  28.307  -2.639  27.838
  706   HG21  THR  98          HG21      THR  98  29.180  -2.797  30.451
  707   HG22  THR  98          HG22      THR  98  30.256  -4.142  30.071
  708   HG23  THR  98          HG23      THR  98  28.868  -4.397  31.129
  709    H    THR  99           HN       THR  99  26.108  -6.253  29.679
  710    HA   THR  99           HA       THR  99  25.100  -7.112  27.029
  711    HB   THR  99           HB       THR  99  23.245  -8.224  28.477
  712    HG1  THR  99           HG1      THR  99  24.243  -6.942  30.387
  713   HG21  THR  99          HG21      THR  99  25.016  -9.572  27.370
  714   HG22  THR  99          HG22      THR  99  24.697 -10.203  28.989
  715   HG23  THR  99          HG23      THR  99  26.128  -9.217  28.694
  716    H    THR 100           HN       THR 100  23.127  -6.266  26.241
  717    HA   THR 100           HA       THR 100  21.658  -4.364  27.861
  718    HB   THR 100           HB       THR 100  23.472  -3.002  26.867
  719    HG1  THR 100           HG1      THR 100  22.060  -1.411  25.984
  720   HG21  THR 100          HG21      THR 100  23.487  -2.573  24.444
  721   HG22  THR 100          HG22      THR 100  22.251  -3.812  24.219
  722   HG23  THR 100          HG23      THR 100  23.852  -4.260  24.807
  723    H    PHE 101           HN       PHE 101  19.637  -3.677  26.785
  724    HA   PHE 101           HA       PHE 101  18.735  -5.703  24.851
  725    HB2  PHE 101           HB2      PHE 101  17.277  -4.215  27.048
  726    HB3  PHE 101           HB1      PHE 101  16.393  -5.015  25.683
  727    HD1  PHE 101           HD1      PHE 101  16.048  -7.343  25.689
  728    HD2  PHE 101           HD2      PHE 101  18.682  -5.598  28.537
  729    HE1  PHE 101           HE1      PHE 101  16.149  -9.477  26.901
  730    HE2  PHE 101           HE2      PHE 101  18.783  -7.726  29.765
  731    HZ   PHE 101           HZ       PHE 101  17.449  -9.693  28.917
  732    H    LYS 102           HN       LYS 102  18.772  -4.873  22.853
  733    HA   LYS 102           HA       LYS 102  17.558  -2.252  22.405
  734    HB2  LYS 102           HB2      LYS 102  20.249  -3.127  21.357
  735    HB3  LYS 102           HB1      LYS 102  19.366  -1.741  20.754
  736    HG2  LYS 102           HG2      LYS 102  19.546  -0.625  22.877
  737    HG3  LYS 102           HG1      LYS 102  20.282  -2.057  23.600
  738    HD2  LYS 102           HD2      LYS 102  21.970  -0.374  23.032
  739    HD3  LYS 102           HD1      LYS 102  22.190  -1.857  22.102
  740    HE2  LYS 102           HE2      LYS 102  22.479  -0.025  20.607
  741    HE3  LYS 102           HE1      LYS 102  20.933  -0.787  20.235
  742    HZ1  LYS 102           HZ1      LYS 102  19.827   0.963  21.501
  743    HZ2  LYS 102           HZ2      LYS 102  20.739   1.606  20.230
  744    HZ3  LYS 102           HZ3      LYS 102  21.323   1.695  21.819
  745    H    ASP 103           HN       ASP 103  15.778  -3.066  21.338
  746    HA   ASP 103           HA       ASP 103  16.277  -4.765  19.015
  747    HB2  ASP 103           HB2      ASP 103  13.988  -4.353  20.799
  748    HB3  ASP 103           HB1      ASP 103  13.547  -4.351  19.096
  749    HA   PRO 104           HA       PRO 104  16.216  -1.503  16.136
  750    HB2  PRO 104           HB2      PRO 104  14.578  -3.119  14.296
  751    HB3  PRO 104           HB1      PRO 104  16.236  -2.575  14.102
  752    HG2  PRO 104           HG2      PRO 104  15.568  -5.151  14.569
  753    HG3  PRO 104           HG1      PRO 104  17.103  -4.451  15.122
  754    HD2  PRO 104           HD2      PRO 104  14.629  -5.085  16.656
  755    HD3  PRO 104           HD1      PRO 104  16.324  -5.152  17.169
  756    H    ARG 105           HN       ARG 105  13.088  -2.947  16.879
  757    HA   ARG 105           HA       ARG 105  11.759  -0.632  15.686
  758    HB2  ARG 105           HB2      ARG 105  10.889  -3.411  16.273
  759    HB3  ARG 105           HB1      ARG 105   9.673  -2.151  16.445
  760    HG2  ARG 105           HG2      ARG 105   9.588  -3.159  14.247
  761    HG3  ARG 105           HG1      ARG 105  10.050  -1.457  14.143
  762    HD2  ARG 105           HD2      ARG 105  12.438  -2.197  13.979
  763    HD3  ARG 105           HD1      ARG 105  11.858  -3.860  13.887
  764    HE   ARG 105           HE       ARG 105  10.814  -1.942  11.949
  765   HH11  ARG 105          HH11      ARG 105  12.950  -4.652  12.604
  766   HH12  ARG 105          HH12      ARG 105  13.160  -5.050  10.932
  767   HH21  ARG 105          HH21      ARG 105  11.083  -2.476   9.743
  768   HH22  ARG 105          HH22      ARG 105  12.089  -3.828   9.303
  769    HA   PRO 106           HA       PRO 106  11.183   1.016  19.792
  770    HB2  PRO 106           HB2      PRO 106   9.219   2.858  19.227
  771    HB3  PRO 106           HB1      PRO 106  10.976   3.126  18.935
  772    HG2  PRO 106           HG2      PRO 106   8.816   2.403  17.016
  773    HG3  PRO 106           HG1      PRO 106  10.238   3.414  16.774
  774    HD2  PRO 106           HD2      PRO 106   9.950   0.827  15.902
  775    HD3  PRO 106           HD1      PRO 106  11.507   1.644  16.216
  776    H    GLY 107           HN       GLY 107  10.098  -0.063  21.323
  777    HA2  GLY 107           HA2      GLY 107   8.307  -0.898  22.508
  778    HA3  GLY 107           HA1      GLY 107   7.222  -0.354  21.210
  779    H    PHE 108           HN       PHE 108   8.813  -1.823  19.172
  780    HA   PHE 108           HA       PHE 108   8.708  -3.848  18.058
  781    HB2  PHE 108           HB2      PHE 108  10.199  -4.305  20.201
  782    HB3  PHE 108           HB1      PHE 108   8.790  -5.299  20.703
  783    HD1  PHE 108           HD1      PHE 108   8.413  -7.422  19.740
  784    HD2  PHE 108           HD2      PHE 108  11.411  -4.881  18.088
  785    HE1  PHE 108           HE1      PHE 108   9.255  -9.292  18.391
  786    HE2  PHE 108           HE2      PHE 108  12.244  -6.753  16.736
  787    HZ   PHE 108           HZ       PHE 108  11.178  -8.958  16.880
  788    H    GLU 109           HN       GLU 109   6.259  -2.587  18.944
  789    HA   GLU 109           HA       GLU 109   4.033  -2.935  18.727
  790    HB2  GLU 109           HB2      GLU 109   4.889  -4.645  16.977
  791    HB3  GLU 109           HB1      GLU 109   4.538  -5.860  18.191
  792    HG2  GLU 109           HG2      GLU 109   2.723  -5.694  16.612
  793    HG3  GLU 109           HG1      GLU 109   2.191  -5.170  18.213
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1 -38.412   8.888   4.093
    2    H2   GLY   1           HT2      GLY   1 -38.833  10.485   4.480
    3    H3   GLY   1           HT3      GLY   1 -37.927  10.161   3.084
    4    HA2  GLY   1           HA1      GLY   1 -40.722   9.291   3.561
    5    HA3  GLY   1           HA2      GLY   1 -40.235  10.632   2.532
    6    H    SER   2           HN       SER   2 -38.504   9.975   0.860
    7    HA   SER   2           HA       SER   2 -39.603   7.653  -0.533
    8    HB2  SER   2           HB2      SER   2 -39.422   9.913  -1.657
    9    HB3  SER   2           HB1      SER   2 -37.672   9.723  -1.603
   10    HG   SER   2           HG       SER   2 -38.960   9.021  -3.573
   11    H    HIS   3           HN       HIS   3 -38.408   5.879  -1.078
   12    HA   HIS   3           HA       HIS   3 -35.863   5.577   0.333
   13    HB2  HIS   3           HB2      HIS   3 -37.625   3.536  -1.051
   14    HB3  HIS   3           HB1      HIS   3 -36.121   3.157  -0.224
   15    HD1  HIS   3           HD1      HIS   3 -37.287   1.626   1.487
   16    HD2  HIS   3           HD2      HIS   3 -38.716   5.537   1.494
   17    HE1  HIS   3           HE1      HIS   3 -38.706   1.834   3.549
   18    HE2  HIS   3           HE2      HIS   3 -39.411   4.248   3.620
   19    H    MET   4           HN       MET   4 -33.949   5.830  -0.861
   20    HA   MET   4           HA       MET   4 -34.212   5.574  -3.773
   21    HB2  MET   4           HB2      MET   4 -32.363   7.123  -4.017
   22    HB3  MET   4           HB1      MET   4 -33.574   7.839  -2.968
   23    HG2  MET   4           HG2      MET   4 -32.264   7.349  -1.026
   24    HG3  MET   4           HG1      MET   4 -31.084   6.469  -1.998
   25    HE1  MET   4           HE1      MET   4 -32.570   9.927  -1.029
   26    HE2  MET   4           HE2      MET   4 -32.936   9.892  -2.754
   27    HE3  MET   4           HE3      MET   4 -31.743  11.032  -2.127
   28    H    GLN   5           HN       GLN   5 -32.881   4.201  -4.867
   29    HA   GLN   5           HA       GLN   5 -31.676   2.093  -3.406
   30    HB2  GLN   5           HB2      GLN   5 -32.701   1.719  -5.572
   31    HB3  GLN   5           HB1      GLN   5 -31.550   2.804  -6.337
   32    HG2  GLN   5           HG2      GLN   5 -29.729   1.259  -5.708
   33    HG3  GLN   5           HG1      GLN   5 -30.937   0.149  -5.056
   34   HE21  GLN   5          HE21      GLN   5 -29.592   1.576  -7.925
   35   HE22  GLN   5          HE22      GLN   5 -30.316   0.467  -9.065
   36    H    TYR   6           HN       TYR   6 -29.633   1.701  -2.861
   37    HA   TYR   6           HA       TYR   6 -27.509   3.488  -3.850
   38    HB2  TYR   6           HB2      TYR   6 -28.168   2.734  -1.026
   39    HB3  TYR   6           HB1      TYR   6 -26.461   2.781  -1.451
   40    HD1  TYR   6           HD1      TYR   6 -25.399   4.896  -2.083
   41    HD2  TYR   6           HD2      TYR   6 -29.487   4.758  -0.890
   42    HE1  TYR   6           HE1      TYR   6 -25.382   7.326  -1.742
   43    HE2  TYR   6           HE2      TYR   6 -29.475   7.190  -0.559
   44    HH   TYR   6           HH       TYR   6 -27.009   9.191  -1.712
   45    H    LYS   7           HN       LYS   7 -25.396   2.481  -3.928
   46    HA   LYS   7           HA       LYS   7 -25.458  -0.433  -3.850
   47    HB2  LYS   7           HB2      LYS   7 -24.209  -0.444  -6.077
   48    HB3  LYS   7           HB1      LYS   7 -25.942  -0.040  -6.148
   49    HG2  LYS   7           HG2      LYS   7 -25.387   2.322  -6.285
   50    HG3  LYS   7           HG1      LYS   7 -23.670   1.940  -6.192
   51    HD2  LYS   7           HD2      LYS   7 -24.266   2.327  -8.493
   52    HD3  LYS   7           HD1      LYS   7 -23.895   0.616  -8.276
   53    HE2  LYS   7           HE2      LYS   7 -26.259   0.084  -8.204
   54    HE3  LYS   7           HE1      LYS   7 -26.674   1.795  -8.310
   55    HZ1  LYS   7           HZ1      LYS   7 -25.144   0.351 -10.413
   56    HZ2  LYS   7           HZ2      LYS   7 -25.829   1.900 -10.512
   57    HZ3  LYS   7           HZ3      LYS   7 -26.831   0.538 -10.441
   58    H    LEU   8           HN       LEU   8 -23.438  -1.456  -3.730
   59    HA   LEU   8           HA       LEU   8 -21.113   0.269  -3.178
   60    HB2  LEU   8           HB2      LEU   8 -22.167  -0.211  -0.975
   61    HB3  LEU   8           HB1      LEU   8 -22.149  -1.908  -1.354
   62    HG   LEU   8           HG       LEU   8 -19.575  -1.608  -1.532
   63   HD11  LEU   8          HD11      LEU   8 -20.329   0.752   0.179
   64   HD12  LEU   8          HD12      LEU   8 -19.494   0.797  -1.374
   65   HD13  LEU   8          HD13      LEU   8 -18.707   0.073   0.028
   66   HD21  LEU   8          HD21      LEU   8 -20.402  -3.042   0.070
   67   HD22  LEU   8          HD22      LEU   8 -21.263  -1.760   0.909
   68   HD23  LEU   8          HD23      LEU   8 -19.502  -1.855   1.019
   69    H    ILE   9           HN       ILE   9 -19.225  -0.572  -3.833
   70    HA   ILE   9           HA       ILE   9 -19.184  -3.388  -4.691
   71    HB   ILE   9           HB       ILE   9 -17.546  -1.114  -5.873
   72   HG12  ILE   9          HG12      ILE   9 -19.735  -2.602  -7.347
   73   HG13  ILE   9          HG11      ILE   9 -20.076  -1.130  -6.379
   74   HG21  ILE   9          HG21      ILE   9 -16.484  -3.323  -5.967
   75   HG22  ILE   9          HG22      ILE   9 -16.911  -2.717  -7.566
   76   HG23  ILE   9          HG23      ILE   9 -17.910  -3.946  -6.798
   77   HD11  ILE   9          HD11      ILE   9 -18.529   0.140  -7.785
   78   HD12  ILE   9          HD12      ILE   9 -19.787  -0.625  -8.756
   79   HD13  ILE   9          HD13      ILE   9 -18.164  -1.314  -8.714
   80    H    LEU  10           HN       LEU  10 -17.736  -4.624  -3.662
   81    HA   LEU  10           HA       LEU  10 -15.922  -3.283  -1.804
   82    HB2  LEU  10           HB2      LEU  10 -16.532  -6.229  -2.047
   83    HB3  LEU  10           HB1      LEU  10 -15.462  -5.516  -0.867
   84    HG   LEU  10           HG       LEU  10 -17.371  -5.953   0.339
   85   HD11  LEU  10          HD11      LEU  10 -18.364  -3.897   0.973
   86   HD12  LEU  10          HD12      LEU  10 -17.848  -3.137  -0.530
   87   HD13  LEU  10          HD13      LEU  10 -16.646  -3.655   0.661
   88   HD21  LEU  10          HD21      LEU  10 -19.145  -4.806  -1.797
   89   HD22  LEU  10          HD22      LEU  10 -19.631  -5.683  -0.346
   90   HD23  LEU  10          HD23      LEU  10 -18.776  -6.522  -1.642
   91    H    ASN  11           HN       ASN  11 -14.104  -2.659  -2.738
   92    HA   ASN  11           HA       ASN  11 -12.904  -4.495  -4.676
   93    HB2  ASN  11           HB2      ASN  11 -13.332  -1.927  -5.079
   94    HB3  ASN  11           HB1      ASN  11 -11.839  -1.748  -4.165
   95   HD21  ASN  11          HD21      ASN  11 -12.422  -1.146  -6.950
   96   HD22  ASN  11          HD22      ASN  11 -11.318  -2.074  -7.895
   97    H    GLY  12           HN       GLY  12 -12.182  -5.936  -3.108
   98    HA2  GLY  12           HA2      GLY  12  -9.601  -5.107  -1.976
   99    HA3  GLY  12           HA1      GLY  12 -10.758  -5.931  -0.911
  100    H    LYS  13           HN       LYS  13  -8.097  -6.508  -2.606
  101    HA   LYS  13           HA       LYS  13  -8.357  -8.393  -4.498
  102    HB2  LYS  13           HB2      LYS  13  -6.301  -8.460  -2.284
  103    HB3  LYS  13           HB1      LYS  13  -6.163  -9.284  -3.835
  104    HG2  LYS  13           HG2      LYS  13  -6.288  -7.057  -4.948
  105    HG3  LYS  13           HG1      LYS  13  -6.245  -6.308  -3.349
  106    HD2  LYS  13           HD2      LYS  13  -4.020  -6.314  -4.301
  107    HD3  LYS  13           HD1      LYS  13  -4.074  -7.426  -2.931
  108    HE2  LYS  13           HE2      LYS  13  -2.855  -8.427  -4.758
  109    HE3  LYS  13           HE1      LYS  13  -4.360  -9.302  -4.493
  110    HZ1  LYS  13           HZ1      LYS  13  -3.666  -7.464  -6.699
  111    HZ2  LYS  13           HZ2      LYS  13  -5.278  -7.804  -6.325
  112    HZ3  LYS  13           HZ3      LYS  13  -4.238  -9.059  -6.787
  113    H    THR  14           HN       THR  14  -8.544  -9.106  -1.022
  114    HA   THR  14           HA       THR  14  -8.774 -11.951  -1.495
  115    HB   THR  14           HB       THR  14  -9.421 -10.486   1.067
  116    HG1  THR  14           HG1      THR  14  -7.005 -11.294   1.311
  117   HG21  THR  14          HG21      THR  14 -10.003 -12.890   0.954
  118   HG22  THR  14          HG22      THR  14  -8.727 -12.561   2.126
  119   HG23  THR  14          HG23      THR  14  -8.324 -13.257   0.557
  120    H    LEU  15           HN       LEU  15 -11.042  -9.292  -1.073
  121    HA   LEU  15           HA       LEU  15 -13.245 -11.185  -1.340
  122    HB2  LEU  15           HB2      LEU  15 -12.800  -9.115   0.740
  123    HB3  LEU  15           HB1      LEU  15 -14.428  -9.443   0.225
  124    HG   LEU  15           HG       LEU  15 -12.545 -11.570   1.226
  125   HD11  LEU  15          HD11      LEU  15 -14.648 -10.046   2.730
  126   HD12  LEU  15          HD12      LEU  15 -12.904  -9.878   2.924
  127   HD13  LEU  15          HD13      LEU  15 -13.697 -11.398   3.348
  128   HD21  LEU  15          HD21      LEU  15 -14.387 -12.383  -0.133
  129   HD22  LEU  15          HD22      LEU  15 -15.536 -11.498   0.867
  130   HD23  LEU  15          HD23      LEU  15 -14.614 -12.836   1.555
  131    H    LYS  16           HN       LYS  16 -14.045 -10.677  -3.294
  132    HA   LYS  16           HA       LYS  16 -14.479  -7.831  -3.890
  133    HB2  LYS  16           HB2      LYS  16 -13.502  -9.976  -5.788
  134    HB3  LYS  16           HB1      LYS  16 -13.938  -8.340  -6.258
  135    HG2  LYS  16           HG2      LYS  16 -12.088  -7.409  -5.321
  136    HG3  LYS  16           HG1      LYS  16 -11.897  -8.666  -4.109
  137    HD2  LYS  16           HD2      LYS  16 -11.054  -8.613  -6.969
  138    HD3  LYS  16           HD1      LYS  16 -10.111  -9.003  -5.530
  139    HE2  LYS  16           HE2      LYS  16 -12.321 -10.729  -6.640
  140    HE3  LYS  16           HE1      LYS  16 -10.607 -10.979  -6.964
  141    HZ1  LYS  16           HZ1      LYS  16 -10.303 -11.211  -4.521
  142    HZ2  LYS  16           HZ2      LYS  16 -11.264 -12.428  -5.210
  143    HZ3  LYS  16           HZ3      LYS  16 -11.988 -11.168  -4.342
  144    H    GLY  17           HN       GLY  17 -16.437  -7.303  -4.548
  145    HA2  GLY  17           HA2      GLY  17 -18.285  -8.824  -5.931
  146    HA3  GLY  17           HA1      GLY  17 -18.587  -9.120  -4.221
  147    H    GLU  18           HN       GLU  18 -20.705  -8.069  -4.921
  148    HA   GLU  18           HA       GLU  18 -20.608  -5.315  -4.081
  149    HB2  GLU  18           HB2      GLU  18 -22.087  -4.676  -6.158
  150    HB3  GLU  18           HB1      GLU  18 -20.341  -4.667  -6.280
  151    HG2  GLU  18           HG2      GLU  18 -21.263  -5.638  -8.253
  152    HG3  GLU  18           HG1      GLU  18 -20.437  -6.893  -7.342
  153    H    THR  19           HN       THR  19 -22.805  -4.389  -3.783
  154    HA   THR  19           HA       THR  19 -25.064  -6.162  -3.861
  155    HB   THR  19           HB       THR  19 -23.879  -6.939  -1.800
  156    HG1  THR  19           HG1      THR  19 -26.207  -5.667  -0.876
  157   HG21  THR  19          HG21      THR  19 -22.875  -4.812  -1.084
  158   HG22  THR  19          HG22      THR  19 -23.902  -5.466   0.198
  159   HG23  THR  19          HG23      THR  19 -24.486  -4.143  -0.807
  160    H    THR  20           HN       THR  20 -27.031  -5.029  -2.958
  161    HA   THR  20           HA       THR  20 -26.707  -2.107  -3.046
  162    HB   THR  20           HB       THR  20 -28.915  -1.994  -4.236
  163    HG1  THR  20           HG1      THR  20 -28.905  -4.329  -5.464
  164   HG21  THR  20          HG21      THR  20 -26.555  -3.275  -5.607
  165   HG22  THR  20          HG22      THR  20 -27.007  -1.569  -5.602
  166   HG23  THR  20          HG23      THR  20 -27.980  -2.739  -6.489
  167    H    THR  21           HN       THR  21 -28.433  -0.892  -2.036
  168    HA   THR  21           HA       THR  21 -30.361  -2.272  -0.402
  169    HB   THR  21           HB       THR  21 -28.172  -2.249   0.994
  170    HG1  THR  21           HG1      THR  21 -29.545  -2.443   2.588
  171   HG21  THR  21          HG21      THR  21 -27.493   0.090   0.518
  172   HG22  THR  21          HG22      THR  21 -27.789  -0.125   2.248
  173   HG23  THR  21          HG23      THR  21 -28.994   0.674   1.236
  174    H    GLU  22           HN       GLU  22 -31.827  -0.730   0.635
  175    HA   GLU  22           HA       GLU  22 -31.995   1.754  -0.946
  176    HB2  GLU  22           HB2      GLU  22 -34.415   1.711  -0.320
  177    HB3  GLU  22           HB1      GLU  22 -33.961   0.266  -1.222
  178    HG2  GLU  22           HG2      GLU  22 -33.841  -1.019   0.828
  179    HG3  GLU  22           HG1      GLU  22 -34.236   0.456   1.788
  180    H    ALA  23           HN       ALA  23 -32.089   3.727   0.058
  181    HA   ALA  23           HA       ALA  23 -32.435   3.846   2.974
  182    HB1  ALA  23           HB1      ALA  23 -30.022   3.449   2.684
  183    HB2  ALA  23           HB2      ALA  23 -30.341   5.057   3.332
  184    HB3  ALA  23           HB3      ALA  23 -29.918   4.862   1.633
  185    H    VAL  24           HN       VAL  24 -32.759   6.109   3.720
  186    HA   VAL  24           HA       VAL  24 -33.690   7.828   1.563
  187    HB   VAL  24           HB       VAL  24 -34.777   9.154   3.363
  188   HG11  VAL  24          HG11      VAL  24 -36.463   7.461   3.932
  189   HG12  VAL  24          HG12      VAL  24 -35.365   6.194   3.386
  190   HG13  VAL  24          HG13      VAL  24 -35.996   7.370   2.233
  191   HG21  VAL  24          HG21      VAL  24 -34.872   8.195   5.629
  192   HG22  VAL  24          HG22      VAL  24 -33.238   8.690   5.185
  193   HG23  VAL  24          HG23      VAL  24 -33.684   6.983   5.150
  194    H    ASP  25           HN       ASP  25 -30.877   7.548   3.351
  195    HA   ASP  25           HA       ASP  25 -30.165  10.313   2.769
  196    HB2  ASP  25           HB2      ASP  25 -29.672   9.013   5.465
  197    HB3  ASP  25           HB1      ASP  25 -28.917  10.506   4.930
  198    H    ALA  26           HN       ALA  26 -27.898  10.628   2.479
  199    HA   ALA  26           HA       ALA  26 -26.568   8.396   1.333
  200    HB1  ALA  26           HB1      ALA  26 -26.260  10.687   0.502
  201    HB2  ALA  26           HB2      ALA  26 -24.721   9.950   0.943
  202    HB3  ALA  26           HB3      ALA  26 -25.472  11.131   2.016
  203    H    ALA  27           HN       ALA  27 -26.229  10.164   4.359
  204    HA   ALA  27           HA       ALA  27 -23.874   8.892   5.251
  205    HB1  ALA  27           HB1      ALA  27 -24.424   9.789   7.441
  206    HB2  ALA  27           HB2      ALA  27 -26.067  10.143   6.903
  207    HB3  ALA  27           HB3      ALA  27 -24.700  11.002   6.191
  208    H    THR  28           HN       THR  28 -27.285   8.074   5.544
  209    HA   THR  28           HA       THR  28 -26.987   6.019   7.462
  210    HB   THR  28           HB       THR  28 -29.155   6.094   5.362
  211    HG1  THR  28           HG1      THR  28 -30.192   7.421   7.157
  212   HG21  THR  28          HG21      THR  28 -29.135   5.223   8.264
  213   HG22  THR  28          HG22      THR  28 -29.132   4.140   6.872
  214   HG23  THR  28          HG23      THR  28 -30.531   5.169   7.186
  215    H    ALA  29           HN       ALA  29 -26.647   6.096   3.965
  216    HA   ALA  29           HA       ALA  29 -26.717   3.251   3.593
  217    HB1  ALA  29           HB1      ALA  29 -27.239   4.782   1.747
  218    HB2  ALA  29           HB2      ALA  29 -25.886   3.727   1.342
  219    HB3  ALA  29           HB3      ALA  29 -25.590   5.405   1.800
  220    H    GLU  30           HN       GLU  30 -24.335   5.691   4.223
  221    HA   GLU  30           HA       GLU  30 -22.017   4.111   3.856
  222    HB2  GLU  30           HB2      GLU  30 -22.317   6.700   4.131
  223    HB3  GLU  30           HB1      GLU  30 -22.222   6.340   5.846
  224    HG2  GLU  30           HG2      GLU  30 -20.038   5.171   5.373
  225    HG3  GLU  30           HG1      GLU  30 -20.132   5.881   3.760
  226    H    LYS  31           HN       LYS  31 -23.760   5.117   6.794
  227    HA   LYS  31           HA       LYS  31 -22.291   3.773   8.677
  228    HB2  LYS  31           HB2      LYS  31 -25.265   4.278   8.698
  229    HB3  LYS  31           HB1      LYS  31 -24.329   3.784  10.097
  230    HG2  LYS  31           HG2      LYS  31 -24.172   6.373   8.582
  231    HG3  LYS  31           HG1      LYS  31 -24.651   6.122  10.262
  232    HD2  LYS  31           HD2      LYS  31 -21.896   5.726   9.092
  233    HD3  LYS  31           HD1      LYS  31 -22.408   7.027  10.170
  234    HE2  LYS  31           HE2      LYS  31 -22.768   5.478  11.963
  235    HE3  LYS  31           HE1      LYS  31 -22.470   4.103  10.899
  236    HZ1  LYS  31           HZ1      LYS  31 -20.480   4.384  12.031
  237    HZ2  LYS  31           HZ2      LYS  31 -20.538   6.079  11.948
  238    HZ3  LYS  31           HZ3      LYS  31 -20.193   5.173  10.560
  239    H    VAL  32           HN       VAL  32 -24.979   2.457   6.755
  240    HA   VAL  32           HA       VAL  32 -25.066  -0.010   8.201
  241    HB   VAL  32           HB       VAL  32 -26.199   0.693   5.484
  242   HG11  VAL  32          HG11      VAL  32 -26.750  -1.702   7.240
  243   HG12  VAL  32          HG12      VAL  32 -25.896  -1.721   5.699
  244   HG13  VAL  32          HG13      VAL  32 -27.606  -1.297   5.752
  245   HG21  VAL  32          HG21      VAL  32 -27.111   1.994   7.375
  246   HG22  VAL  32          HG22      VAL  32 -27.561   0.483   8.167
  247   HG23  VAL  32          HG23      VAL  32 -28.310   0.934   6.635
  248    H    PHE  33           HN       PHE  33 -23.767   0.888   5.001
  249    HA   PHE  33           HA       PHE  33 -22.789  -1.712   4.422
  250    HB2  PHE  33           HB2      PHE  33 -22.300   1.005   3.276
  251    HB3  PHE  33           HB1      PHE  33 -21.276  -0.325   2.792
  252    HD1  PHE  33           HD1      PHE  33 -23.281  -2.525   2.682
  253    HD2  PHE  33           HD2      PHE  33 -23.514   1.517   1.375
  254    HE1  PHE  33           HE1      PHE  33 -24.938  -3.175   0.987
  255    HE2  PHE  33           HE2      PHE  33 -25.180   0.871  -0.323
  256    HZ   PHE  33           HZ       PHE  33 -25.894  -1.475  -0.529
  257    H    LYS  34           HN       LYS  34 -21.498   0.874   6.354
  258    HA   LYS  34           HA       LYS  34 -18.780   0.085   6.178
  259    HB2  LYS  34           HB2      LYS  34 -20.313   1.798   8.130
  260    HB3  LYS  34           HB1      LYS  34 -18.613   1.483   8.342
  261    HG2  LYS  34           HG2      LYS  34 -18.390   2.348   5.910
  262    HG3  LYS  34           HG1      LYS  34 -19.991   3.035   6.197
  263    HD2  LYS  34           HD2      LYS  34 -18.432   4.754   6.750
  264    HD3  LYS  34           HD1      LYS  34 -19.062   4.114   8.267
  265    HE2  LYS  34           HE2      LYS  34 -17.074   2.769   8.577
  266    HE3  LYS  34           HE1      LYS  34 -16.454   3.286   7.009
  267    HZ1  LYS  34           HZ1      LYS  34 -15.386   4.582   8.678
  268    HZ2  LYS  34           HZ2      LYS  34 -16.863   4.970   9.419
  269    HZ3  LYS  34           HZ3      LYS  34 -16.488   5.605   7.890
  270    H    GLN  35           HN       GLN  35 -21.386  -0.562   8.499
  271    HA   GLN  35           HA       GLN  35 -19.895  -2.309  10.146
  272    HB2  GLN  35           HB2      GLN  35 -22.054  -1.250  10.806
  273    HB3  GLN  35           HB1      GLN  35 -22.886  -2.277   9.652
  274    HG2  GLN  35           HG2      GLN  35 -23.131  -3.184  11.853
  275    HG3  GLN  35           HG1      GLN  35 -22.127  -4.258  10.879
  276   HE21  GLN  35          HE21      GLN  35 -21.175  -5.199  12.666
  277   HE22  GLN  35          HE22      GLN  35 -20.027  -4.369  13.659
  278    H    TYR  36           HN       TYR  36 -21.644  -2.632   7.175
  279    HA   TYR  36           HA       TYR  36 -21.770  -5.452   6.985
  280    HB2  TYR  36           HB2      TYR  36 -23.222  -4.247   5.586
  281    HB3  TYR  36           HB1      TYR  36 -21.957  -3.141   5.084
  282    HD1  TYR  36           HD1      TYR  36 -22.838  -6.723   4.885
  283    HD2  TYR  36           HD2      TYR  36 -21.081  -3.390   2.932
  284    HE1  TYR  36           HE1      TYR  36 -22.527  -8.099   2.879
  285    HE2  TYR  36           HE2      TYR  36 -20.767  -4.739   0.895
  286    HH   TYR  36           HH       TYR  36 -22.262  -7.712   0.399
  287    H    ALA  37           HN       ALA  37 -19.493  -3.056   5.664
  288    HA   ALA  37           HA       ALA  37 -17.735  -4.972   4.500
  289    HB1  ALA  37           HB1      ALA  37 -17.159  -2.113   5.287
  290    HB2  ALA  37           HB2      ALA  37 -17.913  -2.606   3.773
  291    HB3  ALA  37           HB3      ALA  37 -16.252  -3.090   4.130
  292    H    ASN  38           HN       ASN  38 -18.015  -3.462   7.615
  293    HA   ASN  38           HA       ASN  38 -15.470  -4.026   8.668
  294    HB2  ASN  38           HB2      ASN  38 -17.070  -2.489   9.801
  295    HB3  ASN  38           HB1      ASN  38 -18.136  -3.854  10.129
  296   HD21  ASN  38          HD21      ASN  38 -15.464  -2.027  11.272
  297   HD22  ASN  38          HD22      ASN  38 -15.080  -3.049  12.669
  298    H    ASP  39           HN       ASP  39 -18.484  -5.886   8.727
  299    HA   ASP  39           HA       ASP  39 -17.540  -8.067  10.235
  300    HB2  ASP  39           HB2      ASP  39 -19.928  -7.655   9.889
  301    HB3  ASP  39           HB1      ASP  39 -19.751  -7.957   8.166
  302    H    ASN  40           HN       ASN  40 -17.051  -7.176   6.947
  303    HA   ASN  40           HA       ASN  40 -16.206  -9.865   6.188
  304    HB2  ASN  40           HB2      ASN  40 -16.842  -7.376   4.645
  305    HB3  ASN  40           HB1      ASN  40 -15.835  -8.620   3.923
  306   HD21  ASN  40          HD21      ASN  40 -19.012  -7.707   4.924
  307   HD22  ASN  40          HD22      ASN  40 -19.844  -9.134   4.274
  308    H    GLY  41           HN       GLY  41 -14.923  -7.131   7.548
  309    HA2  GLY  41           HA2      GLY  41 -12.747  -6.661   8.132
  310    HA3  GLY  41           HA1      GLY  41 -12.253  -8.105   7.258
  311    H    VAL  42           HN       VAL  42 -14.107  -5.607   5.655
  312    HA   VAL  42           HA       VAL  42 -11.721  -4.926   4.114
  313    HB   VAL  42           HB       VAL  42 -14.641  -4.440   3.430
  314   HG11  VAL  42          HG11      VAL  42 -13.045  -2.796   2.475
  315   HG12  VAL  42          HG12      VAL  42 -13.798  -3.797   1.231
  316   HG13  VAL  42          HG13      VAL  42 -12.143  -4.125   1.745
  317   HG21  VAL  42          HG21      VAL  42 -14.240  -6.200   1.716
  318   HG22  VAL  42          HG22      VAL  42 -14.139  -6.800   3.373
  319   HG23  VAL  42          HG23      VAL  42 -12.664  -6.500   2.449
  320    H    ASP  43           HN       ASP  43 -10.817  -3.040   4.403
  321    HA   ASP  43           HA       ASP  43 -12.318  -0.801   5.508
  322    HB2  ASP  43           HB2      ASP  43 -11.500  -2.042   7.518
  323    HB3  ASP  43           HB1      ASP  43  -9.857  -1.911   6.900
  324    H    GLY  44           HN       GLY  44 -11.867   0.475   3.732
  325    HA2  GLY  44           HA2      GLY  44  -9.099   1.217   3.270
  326    HA3  GLY  44           HA1      GLY  44  -9.932   0.460   1.919
  327    H    GLU  45           HN       GLU  45  -9.407   2.570   0.914
  328    HA   GLU  45           HA       GLU  45 -10.523   5.031   1.786
  329    HB2  GLU  45           HB2      GLU  45  -9.393   3.992  -0.777
  330    HB3  GLU  45           HB1      GLU  45 -10.255   5.520  -0.792
  331    HG2  GLU  45           HG2      GLU  45  -8.011   5.026   1.128
  332    HG3  GLU  45           HG1      GLU  45  -7.720   5.549  -0.528
  333    H    TRP  46           HN       TRP  46 -12.361   6.110   1.142
  334    HA   TRP  46           HA       TRP  46 -14.447   4.415  -0.074
  335    HB2  TRP  46           HB2      TRP  46 -14.580   6.331   2.231
  336    HB3  TRP  46           HB1      TRP  46 -15.998   6.167   1.212
  337    HD1  TRP  46           HD1      TRP  46 -13.557   3.734   2.989
  338    HE1  TRP  46           HE1      TRP  46 -14.914   1.847   4.076
  339    HE3  TRP  46           HE3      TRP  46 -18.290   5.147   1.562
  340    HZ2  TRP  46           HZ2      TRP  46 -17.589   1.060   4.315
  341    HZ3  TRP  46           HZ3      TRP  46 -20.178   3.762   2.282
  342    HH2  TRP  46           HH2      TRP  46 -19.840   1.758   3.621
  343    H    THR  47           HN       THR  47 -14.939   5.016  -2.047
  344    HA   THR  47           HA       THR  47 -14.855   7.870  -2.746
  345    HB   THR  47           HB       THR  47 -14.898   6.935  -5.144
  346    HG1  THR  47           HG1      THR  47 -14.525   4.829  -5.423
  347   HG21  THR  47          HG21      THR  47 -12.922   7.951  -4.127
  348   HG22  THR  47          HG22      THR  47 -12.474   6.588  -5.150
  349   HG23  THR  47          HG23      THR  47 -12.492   6.406  -3.394
  350    H    TYR  48           HN       TYR  48 -16.598   8.586  -4.295
  351    HA   TYR  48           HA       TYR  48 -19.017   7.008  -4.252
  352    HB2  TYR  48           HB2      TYR  48 -19.307   7.955  -2.096
  353    HB3  TYR  48           HB1      TYR  48 -18.810   9.548  -2.605
  354    HD1  TYR  48           HD1      TYR  48 -20.381  10.996  -3.821
  355    HD2  TYR  48           HD2      TYR  48 -21.622   7.133  -2.477
  356    HE1  TYR  48           HE1      TYR  48 -22.725  11.610  -4.199
  357    HE2  TYR  48           HE2      TYR  48 -23.967   7.759  -2.850
  358    HH   TYR  48           HH       TYR  48 -25.329   9.823  -2.996
  359    H    ASP  49           HN       ASP  49 -20.454   7.581  -5.866
  360    HA   ASP  49           HA       ASP  49 -19.691   9.943  -7.482
  361    HB2  ASP  49           HB2      ASP  49 -20.779   8.735  -9.431
  362    HB3  ASP  49           HB1      ASP  49 -19.285   7.999  -8.873
  363    H    ASP  50           HN       ASP  50 -21.474  11.081  -8.468
  364    HA   ASP  50           HA       ASP  50 -23.404  11.525  -6.355
  365    HB2  ASP  50           HB2      ASP  50 -23.009  12.946  -9.001
  366    HB3  ASP  50           HB1      ASP  50 -24.045  13.510  -7.695
  367    H    ALA  51           HN       ALA  51 -23.767  11.005  -9.876
  368    HA   ALA  51           HA       ALA  51 -26.583  11.034  -9.771
  369    HB1  ALA  51           HB1      ALA  51 -25.293  11.604 -11.775
  370    HB2  ALA  51           HB2      ALA  51 -26.525  10.381 -12.093
  371    HB3  ALA  51           HB3      ALA  51 -24.831   9.911 -11.946
  372    H    THR  52           HN       THR  52 -24.288   8.312  -9.695
  373    HA   THR  52           HA       THR  52 -26.582   6.501  -9.813
  374    HB   THR  52           HB       THR  52 -24.717   4.724 -10.008
  375    HG1  THR  52           HG1      THR  52 -23.086   6.433  -9.402
  376   HG21  THR  52          HG21      THR  52 -26.155   5.387 -11.870
  377   HG22  THR  52          HG22      THR  52 -24.491   5.183 -12.425
  378   HG23  THR  52          HG23      THR  52 -25.142   6.802 -12.164
  379    H    LYS  53           HN       LYS  53 -24.632   7.902  -7.475
  380    HA   LYS  53           HA       LYS  53 -24.406   7.578  -5.202
  381    HB2  LYS  53           HB2      LYS  53 -26.932   6.017  -5.727
  382    HB3  LYS  53           HB1      LYS  53 -26.265   6.197  -4.112
  383    HG2  LYS  53           HG2      LYS  53 -27.864   7.853  -4.236
  384    HG3  LYS  53           HG1      LYS  53 -26.371   8.719  -4.604
  385    HD2  LYS  53           HD2      LYS  53 -27.988   9.429  -6.165
  386    HD3  LYS  53           HD1      LYS  53 -26.891   8.368  -7.035
  387    HE2  LYS  53           HE2      LYS  53 -29.163   7.875  -7.664
  388    HE3  LYS  53           HE1      LYS  53 -28.510   6.527  -6.729
  389    HZ1  LYS  53           HZ1      LYS  53 -30.755   7.073  -6.032
  390    HZ2  LYS  53           HZ2      LYS  53 -30.292   8.673  -5.693
  391    HZ3  LYS  53           HZ3      LYS  53 -29.660   7.392  -4.778
  392    H    THR  54           HN       THR  54 -22.821   5.952  -6.831
  393    HA   THR  54           HA       THR  54 -22.914   3.286  -5.689
  394    HB   THR  54           HB       THR  54 -20.814   4.340  -7.593
  395    HG1  THR  54           HG1      THR  54 -22.506   4.608  -8.864
  396   HG21  THR  54          HG21      THR  54 -20.592   1.987  -8.209
  397   HG22  THR  54          HG22      THR  54 -21.936   1.552  -7.153
  398   HG23  THR  54          HG23      THR  54 -20.423   2.139  -6.458
  399    H    TYR  55           HN       TYR  55 -22.124   3.100  -3.670
  400    HA   TYR  55           HA       TYR  55 -19.797   4.646  -2.850
  401    HB2  TYR  55           HB2      TYR  55 -21.613   2.715  -1.384
  402    HB3  TYR  55           HB1      TYR  55 -20.019   3.089  -0.746
  403    HD1  TYR  55           HD1      TYR  55 -23.376   4.345  -1.369
  404    HD2  TYR  55           HD2      TYR  55 -19.517   5.335   0.110
  405    HE1  TYR  55           HE1      TYR  55 -24.307   6.367  -0.324
  406    HE2  TYR  55           HE2      TYR  55 -20.436   7.359   1.165
  407    HH   TYR  55           HH       TYR  55 -22.433   8.888   0.795
  408    H    THR  56           HN       THR  56 -17.750   3.917  -2.992
  409    HA   THR  56           HA       THR  56 -17.389   1.034  -3.471
  410    HB   THR  56           HB       THR  56 -15.855   3.274  -4.821
  411    HG1  THR  56           HG1      THR  56 -18.027   2.813  -5.592
  412   HG21  THR  56          HG21      THR  56 -14.792   1.456  -6.115
  413   HG22  THR  56          HG22      THR  56 -15.623   0.268  -5.111
  414   HG23  THR  56          HG23      THR  56 -14.417   1.335  -4.396
  415    H    VAL  57           HN       VAL  57 -16.127   0.096  -1.999
  416    HA   VAL  57           HA       VAL  57 -14.277   1.817  -0.477
  417    HB   VAL  57           HB       VAL  57 -15.913   0.712   1.036
  418   HG11  VAL  57          HG11      VAL  57 -14.792  -1.853  -0.085
  419   HG12  VAL  57          HG12      VAL  57 -16.478  -1.333  -0.057
  420   HG13  VAL  57          HG13      VAL  57 -15.665  -1.765   1.439
  421   HG21  VAL  57          HG21      VAL  57 -14.301  -0.240   2.604
  422   HG22  VAL  57          HG22      VAL  57 -13.678   1.229   1.854
  423   HG23  VAL  57          HG23      VAL  57 -13.105  -0.350   1.315
  424    H    THR  58           HN       THR  58 -12.293   1.703  -1.127
  425    HA   THR  58           HA       THR  58 -11.414  -0.719  -2.553
  426    HB   THR  58           HB       THR  58 -10.234   2.047  -2.763
  427    HG1  THR  58           HG1      THR  58 -12.567   1.396  -3.580
  428   HG21  THR  58          HG21      THR  58  -9.941  -0.442  -4.440
  429   HG22  THR  58          HG22      THR  58  -8.702   0.314  -3.435
  430   HG23  THR  58          HG23      THR  58  -9.300   1.140  -4.875
  431    H    GLU  59           HN       GLU  59  -9.946  -1.923  -1.606
  432    HA   GLU  59           HA       GLU  59  -8.744  -1.287   0.870
  433    HB2  GLU  59           HB2      GLU  59  -8.206  -3.488  -1.132
  434    HB3  GLU  59           HB1      GLU  59  -7.202  -3.299   0.269
  435    HG2  GLU  59           HG2      GLU  59 -10.171  -3.690   0.409
  436    HG3  GLU  59           HG1      GLU  59  -8.974  -4.975   0.566
  437    H    GLY  60           HN       GLY  60  -6.540  -0.754   1.384
  438    HA2  GLY  60           HA2      GLY  60  -5.289   0.893  -0.673
  439    HA3  GLY  60           HA1      GLY  60  -4.814   0.777   1.021
  440    H    SER  61           HN       SER  61  -2.616   0.637   0.142
  441    HA   SER  61           HA       SER  61  -1.944  -2.157  -0.408
  442    HB2  SER  61           HB2      SER  61  -0.320  -1.330  -2.210
  443    HB3  SER  61           HB1      SER  61  -2.034  -1.277  -2.632
  444    HG   SER  61           HG       SER  61  -1.525   0.724  -3.118
  445    H    GLY  62           HN       GLY  62  -0.442   1.070  -0.108
  446    HA2  GLY  62           HA2      GLY  62   1.120   1.755   1.500
  447    HA3  GLY  62           HA1      GLY  62   1.139   0.114   2.138
  448    H    GLY  63           HN       GLY  63   2.123   2.016  -0.680
  449    HA2  GLY  63           HA2      GLY  63   3.919   0.080  -1.714
  450    HA3  GLY  63           HA1      GLY  63   3.853   1.775  -2.161
  451    H    ALA  64           HN       ALA  64   4.207   2.525   0.720
  452    HA   ALA  64           HA       ALA  64   5.863   3.117   2.148
  453    HB1  ALA  64           HB1      ALA  64   7.238   0.627   1.140
  454    HB2  ALA  64           HB2      ALA  64   6.126   0.720   2.505
  455    HB3  ALA  64           HB3      ALA  64   7.684   1.540   2.581
  456    H    GLY  65           HN       GLY  65   8.629   3.133   1.991
  457    HA2  GLY  65           HA2      GLY  65   9.894   3.665  -0.375
  458    HA3  GLY  65           HA1      GLY  65   9.012   5.145  -0.029
  459    H    GLY  66           HN       GLY  66  10.999   2.817   1.800
  460    HA2  GLY  66           HA2      GLY  66  12.322   5.140   3.057
  461    HA3  GLY  66           HA1      GLY  66  12.178   3.545   3.782
  462    H    GLN  67           HN       GLN  67  13.046   3.920   0.427
  463    HA   GLN  67           HA       GLN  67  15.625   2.690   1.027
  464    HB2  GLN  67           HB2      GLN  67  14.237   3.210  -1.629
  465    HB3  GLN  67           HB1      GLN  67  15.780   2.343  -1.427
  466    HG2  GLN  67           HG2      GLN  67  14.631   0.616  -0.128
  467    HG3  GLN  67           HG1      GLN  67  13.106   1.483  -0.318
  468   HE21  GLN  67          HE21      GLN  67  13.807  -1.211  -1.153
  469   HE22  GLN  67          HE22      GLN  67  13.563  -1.274  -2.865
  470    H    GLY  68           HN       GLY  68  14.761   5.056  -1.499
  471    HA2  GLY  68           HA2      GLY  68  15.551   7.258  -1.753
  472    HA3  GLY  68           HA1      GLY  68  16.671   6.985  -0.419
  473    H    MET  69           HN       MET  69  18.319   7.964  -1.809
  474    HA   MET  69           HA       MET  69  19.611   5.916  -3.414
  475    HB2  MET  69           HB2      MET  69  20.067   7.517  -5.282
  476    HB3  MET  69           HB1      MET  69  18.392   7.016  -5.135
  477    HG2  MET  69           HG2      MET  69  17.826   9.125  -4.080
  478    HG3  MET  69           HG1      MET  69  19.514   9.628  -4.149
  479    HE1  MET  69           HE1      MET  69  20.134  10.060  -7.961
  480    HE2  MET  69           HE2      MET  69  20.481   8.640  -6.973
  481    HE3  MET  69           HE3      MET  69  20.800  10.255  -6.340
  482    H    ILE  70           HN       ILE  70  21.116   5.845  -1.755
  483    HA   ILE  70           HA       ILE  70  23.072   8.036  -1.833
  484    HB   ILE  70           HB       ILE  70  22.248   6.600   0.727
  485   HG12  ILE  70          HG12      ILE  70  20.649   8.347  -0.008
  486   HG13  ILE  70          HG11      ILE  70  21.450   8.752   1.507
  487   HG21  ILE  70          HG21      ILE  70  24.302   8.808   0.389
  488   HG22  ILE  70          HG22      ILE  70  24.693   7.100   0.599
  489   HG23  ILE  70          HG23      ILE  70  23.874   7.984   1.888
  490   HD11  ILE  70          HD11      ILE  70  21.266  10.702   0.085
  491   HD12  ILE  70          HD12      ILE  70  22.122   9.866  -1.210
  492   HD13  ILE  70          HD13      ILE  70  22.962  10.255   0.292
  493    H    GLN  71           HN       GLN  71  24.203   6.660  -3.329
  494    HA   GLN  71           HA       GLN  71  25.563   4.427  -1.998
  495    HB2  GLN  71           HB2      GLN  71  25.585   3.311  -4.316
  496    HB3  GLN  71           HB1      GLN  71  24.092   3.274  -3.393
  497    HG2  GLN  71           HG2      GLN  71  23.386   3.787  -5.539
  498    HG3  GLN  71           HG1      GLN  71  23.430   5.353  -4.740
  499   HE21  GLN  71          HE21      GLN  71  26.270   3.624  -5.842
  500   HE22  GLN  71          HE22      GLN  71  26.684   4.737  -7.105
  501    H    GLU  72           HN       GLU  72  26.195   7.313  -2.780
  502    HA   GLU  72           HA       GLU  72  28.619   6.750  -4.318
  503    HB2  GLU  72           HB2      GLU  72  28.741   9.069  -4.960
  504    HB3  GLU  72           HB1      GLU  72  27.172   8.425  -5.394
  505    HG2  GLU  72           HG2      GLU  72  26.238   9.502  -3.371
  506    HG3  GLU  72           HG1      GLU  72  27.812  10.240  -3.085
  507    HA   PRO  73           HA       PRO  73  30.952   7.269  -0.660
  508    HB2  PRO  73           HB2      PRO  73  33.343   8.091  -1.669
  509    HB3  PRO  73           HB1      PRO  73  32.730   6.402  -1.834
  510    HG2  PRO  73           HG2      PRO  73  32.622   8.662  -3.822
  511    HG3  PRO  73           HG1      PRO  73  33.070   6.962  -4.075
  512    HD2  PRO  73           HD2      PRO  73  30.620   7.910  -4.699
  513    HD3  PRO  73           HD1      PRO  73  30.874   6.245  -4.077
  514    H    ALA  74           HN       ALA  74  32.479   8.791   0.422
  515    HA   ALA  74           HA       ALA  74  32.331  11.557  -0.281
  516    HB1  ALA  74           HB1      ALA  74  30.162  11.302   0.801
  517    HB2  ALA  74           HB2      ALA  74  31.235  12.282   1.801
  518    HB3  ALA  74           HB3      ALA  74  30.937  10.595   2.218
  519    H    LEU  75           HN       LEU  75  33.456  12.895   1.437
  520    HA   LEU  75           HA       LEU  75  35.763  11.364   2.393
  521    HB2  LEU  75           HB2      LEU  75  35.387  14.291   1.765
  522    HB3  LEU  75           HB1      LEU  75  36.786  13.695   2.627
  523    HG   LEU  75           HG       LEU  75  37.405  14.013   0.347
  524   HD11  LEU  75          HD11      LEU  75  37.003  11.076   0.871
  525   HD12  LEU  75          HD12      LEU  75  38.352  12.062   1.432
  526   HD13  LEU  75          HD13      LEU  75  38.128  11.777  -0.295
  527   HD21  LEU  75          HD21      LEU  75  36.279  12.890  -1.513
  528   HD22  LEU  75          HD22      LEU  75  35.193  13.988  -0.662
  529   HD23  LEU  75          HD23      LEU  75  35.073  12.249  -0.395
  530    HA   PRO  76           HA       PRO  76  34.569  12.207   6.596
  531    HB2  PRO  76           HB2      PRO  76  37.319  12.416   7.501
  532    HB3  PRO  76           HB1      PRO  76  36.220  11.066   7.748
  533    HG2  PRO  76           HG2      PRO  76  38.424  10.881   6.172
  534    HG3  PRO  76           HG1      PRO  76  36.907   9.959   5.855
  535    HD2  PRO  76           HD2      PRO  76  37.853  12.536   4.539
  536    HD3  PRO  76           HD1      PRO  76  37.156  11.078   3.798
  537    HA   PRO  77           HA       PRO  77  34.838  16.487   7.566
  538    HB2  PRO  77           HB2      PRO  77  35.416  16.621  10.208
  539    HB3  PRO  77           HB1      PRO  77  33.852  16.037   9.612
  540    HG2  PRO  77           HG2      PRO  77  36.281  14.469  10.399
  541    HG3  PRO  77           HG1      PRO  77  34.604  14.233  10.940
  542    HD2  PRO  77           HD2      PRO  77  35.657  12.720   8.981
  543    HD3  PRO  77           HD1      PRO  77  33.963  13.300   8.852
  544    H    GLY  78           HN       GLY  78  36.308  17.976   7.109
  545    HA2  GLY  78           HA2      GLY  78  38.326  19.123   7.161
  546    HA3  GLY  78           HA1      GLY  78  38.921  17.941   8.311
  547    H    TRP  79           HN       TRP  79  37.986  15.967   5.877
  548    HA   TRP  79           HA       TRP  79  40.704  16.039   4.723
  549    HB2  TRP  79           HB2      TRP  79  38.586  13.883   4.784
  550    HB3  TRP  79           HB1      TRP  79  40.019  13.772   3.771
  551    HD1  TRP  79           HD1      TRP  79  38.999  13.836   7.487
  552    HE1  TRP  79           HE1      TRP  79  40.888  12.737   8.852
  553    HE3  TRP  79           HE3      TRP  79  42.438  13.174   3.745
  554    HZ2  TRP  79           HZ2      TRP  79  43.482  11.720   8.394
  555    HZ3  TRP  79           HZ3      TRP  79  44.589  12.134   4.295
  556    HH2  TRP  79           HH2      TRP  79  45.100  11.422   6.570
  557    H    GLU  80           HN       GLU  80  40.883  17.170   2.820
  558    HA   GLU  80           HA       GLU  80  38.631  17.055   0.943
  559    HB2  GLU  80           HB2      GLU  80  40.996  18.940   1.063
  560    HB3  GLU  80           HB1      GLU  80  39.732  19.008  -0.157
  561    HG2  GLU  80           HG2      GLU  80  38.083  19.439   1.618
  562    HG3  GLU  80           HG1      GLU  80  39.385  19.440   2.807
  563    H    MET  81           HN       MET  81  38.971  16.364  -1.193
  564    HA   MET  81           HA       MET  81  41.590  15.187  -1.762
  565    HB2  MET  81           HB2      MET  81  40.028  13.467  -0.796
  566    HB3  MET  81           HB1      MET  81  38.965  13.731  -2.200
  567    HG2  MET  81           HG2      MET  81  41.832  12.900  -2.511
  568    HG3  MET  81           HG1      MET  81  40.555  11.726  -2.225
  569    HE1  MET  81           HE1      MET  81  38.459  11.441  -3.821
  570    HE2  MET  81           HE2      MET  81  38.276  12.260  -5.371
  571    HE3  MET  81           HE3      MET  81  38.134  13.174  -3.869
  572    H    LYS  82           HN       LYS  82  42.223  15.368  -3.903
  573    HA   LYS  82           HA       LYS  82  40.395  15.812  -6.011
  574    HB2  LYS  82           HB2      LYS  82  41.606  18.154  -6.553
  575    HB3  LYS  82           HB1      LYS  82  40.105  18.069  -5.648
  576    HG2  LYS  82           HG2      LYS  82  41.250  18.362  -3.576
  577    HG3  LYS  82           HG1      LYS  82  42.844  18.215  -4.389
  578    HD2  LYS  82           HD2      LYS  82  42.381  20.245  -5.647
  579    HD3  LYS  82           HD1      LYS  82  40.778  20.366  -4.914
  580    HE2  LYS  82           HE2      LYS  82  41.760  20.681  -2.730
  581    HE3  LYS  82           HE1      LYS  82  43.379  20.427  -3.384
  582    HZ1  LYS  82           HZ1      LYS  82  43.142  22.727  -3.201
  583    HZ2  LYS  82           HZ2      LYS  82  41.563  22.724  -3.812
  584    HZ3  LYS  82           HZ3      LYS  82  42.870  22.415  -4.846
  585    H    TYR  83           HN       TYR  83  41.502  16.044  -8.109
  586    HA   TYR  83           HA       TYR  83  44.109  14.662  -7.960
  587    HB2  TYR  83           HB2      TYR  83  41.943  14.668 -10.084
  588    HB3  TYR  83           HB1      TYR  83  43.601  14.140 -10.452
  589    HD1  TYR  83           HD1      TYR  83  43.649  11.872 -10.696
  590    HD2  TYR  83           HD2      TYR  83  41.297  13.488  -7.539
  591    HE1  TYR  83           HE1      TYR  83  43.109   9.600  -9.936
  592    HE2  TYR  83           HE2      TYR  83  40.759  11.222  -6.765
  593    HH   TYR  83           HH       TYR  83  42.325   8.403  -8.122
  594    H    THR  84           HN       THR  84  45.844  15.311  -9.271
  595    HA   THR  84           HA       THR  84  45.864  18.149  -9.878
  596    HB   THR  84           HB       THR  84  48.229  17.993 -10.042
  597    HG1  THR  84           HG1      THR  84  49.291  15.919 -10.114
  598   HG21  THR  84          HG21      THR  84  47.264  16.089  -7.915
  599   HG22  THR  84          HG22      THR  84  47.535  17.824  -7.758
  600   HG23  THR  84          HG23      THR  84  48.902  16.738  -7.998
  601    H    SER  85           HN       SER  85  47.439  18.552 -11.963
  602    HA   SER  85           HA       SER  85  45.780  18.033 -14.176
  603    HB2  SER  85           HB2      SER  85  47.901  18.953 -15.416
  604    HB3  SER  85           HB1      SER  85  46.959  20.016 -14.366
  605    HG   SER  85           HG       SER  85  49.504  18.894 -13.984
  606    H    GLU  86           HN       GLU  86  48.790  16.539 -13.088
  607    HA   GLU  86           HA       GLU  86  49.006  14.895 -15.511
  608    HB2  GLU  86           HB2      GLU  86  50.637  15.234 -13.007
  609    HB3  GLU  86           HB1      GLU  86  50.909  13.853 -14.058
  610    HG2  GLU  86           HG2      GLU  86  52.424  15.807 -14.416
  611    HG3  GLU  86           HG1      GLU  86  51.587  15.225 -15.852
  612    H    GLY  87           HN       GLY  87  46.901  14.711 -13.112
  613    HA2  GLY  87           HA2      GLY  87  45.407  12.961 -12.757
  614    HA3  GLY  87           HA1      GLY  87  46.537  11.867 -13.536
  615    H    VAL  88           HN       VAL  88  47.902  13.802 -11.060
  616    HA   VAL  88           HA       VAL  88  48.213  11.412  -9.429
  617    HB   VAL  88           HB       VAL  88  49.409  14.175  -9.078
  618   HG11  VAL  88          HG11      VAL  88  49.235  13.003  -6.951
  619   HG12  VAL  88          HG12      VAL  88  50.916  13.101  -7.474
  620   HG13  VAL  88          HG13      VAL  88  50.027  11.589  -7.650
  621   HG21  VAL  88          HG21      VAL  88  50.652  11.620 -10.100
  622   HG22  VAL  88          HG22      VAL  88  51.472  13.168  -9.893
  623   HG23  VAL  88          HG23      VAL  88  50.187  13.002 -11.088
  624    H    ARG  89           HN       ARG  89  47.279  11.076  -7.514
  625    HA   ARG  89           HA       ARG  89  45.136  12.887  -6.720
  626    HB2  ARG  89           HB2      ARG  89  44.553  10.571  -7.017
  627    HB3  ARG  89           HB1      ARG  89  45.841  10.050  -5.953
  628    HG2  ARG  89           HG2      ARG  89  44.694  10.970  -4.039
  629    HG3  ARG  89           HG1      ARG  89  43.451  11.657  -5.089
  630    HD2  ARG  89           HD2      ARG  89  42.680   9.511  -5.739
  631    HD3  ARG  89           HD1      ARG  89  44.060   8.716  -4.989
  632    HE   ARG  89           HE       ARG  89  42.952   9.802  -2.859
  633   HH11  ARG  89          HH11      ARG  89  41.349   8.296  -5.576
  634   HH12  ARG  89          HH12      ARG  89  40.094   7.572  -4.610
  635   HH21  ARG  89          HH21      ARG  89  41.300   8.851  -1.575
  636   HH22  ARG  89          HH22      ARG  89  40.068   7.893  -2.332
  637    H    TYR  90           HN       TYR  90  45.255  14.159  -4.932
  638    HA   TYR  90           HA       TYR  90  47.291  13.476  -2.960
  639    HB2  TYR  90           HB2      TYR  90  48.189  15.665  -2.784
  640    HB3  TYR  90           HB1      TYR  90  48.208  15.242  -4.476
  641    HD1  TYR  90           HD1      TYR  90  46.281  16.210  -5.948
  642    HD2  TYR  90           HD2      TYR  90  47.328  17.676  -2.094
  643    HE1  TYR  90           HE1      TYR  90  45.250  18.374  -6.495
  644    HE2  TYR  90           HE2      TYR  90  46.305  19.839  -2.637
  645    HH   TYR  90           HH       TYR  90  45.755  21.163  -4.632
  646    H    PHE  91           HN       PHE  91  46.875  14.478  -0.797
  647    HA   PHE  91           HA       PHE  91  43.997  15.026  -0.490
  648    HB2  PHE  91           HB2      PHE  91  45.859  13.373   1.164
  649    HB3  PHE  91           HB1      PHE  91  44.508  14.182   1.939
  650    HD1  PHE  91           HD1      PHE  91  42.431  13.122   2.011
  651    HD2  PHE  91           HD2      PHE  91  45.291  11.940  -0.916
  652    HE1  PHE  91           HE1      PHE  91  40.969  11.277   1.322
  653    HE2  PHE  91           HE2      PHE  91  43.825  10.093  -1.606
  654    HZ   PHE  91           HZ       PHE  91  41.590   9.799  -0.448
  655    H    VAL  92           HN       VAL  92  43.357  16.577   0.949
  656    HA   VAL  92           HA       VAL  92  45.476  18.377   1.927
  657    HB   VAL  92           HB       VAL  92  42.705  19.194   1.040
  658   HG11  VAL  92          HG11      VAL  92  45.115  20.875   1.729
  659   HG12  VAL  92          HG12      VAL  92  43.707  20.634   2.762
  660   HG13  VAL  92          HG13      VAL  92  43.536  21.473   1.220
  661   HG21  VAL  92          HG21      VAL  92  43.857  20.262  -0.879
  662   HG22  VAL  92          HG22      VAL  92  43.905  18.500  -0.908
  663   HG23  VAL  92          HG23      VAL  92  45.331  19.414  -0.413
  664    H    ASP  93           HN       ASP  93  45.573  17.889   4.067
  665    HA   ASP  93           HA       ASP  93  43.198  17.294   5.628
  666    HB2  ASP  93           HB2      ASP  93  46.017  18.020   6.556
  667    HB3  ASP  93           HB1      ASP  93  44.727  17.422   7.586
  668    H    HIS  94           HN       HIS  94  41.792  19.075   5.454
  669    HA   HIS  94           HA       HIS  94  42.721  21.776   5.525
  670    HB2  HIS  94           HB2      HIS  94  40.658  20.856   4.326
  671    HB3  HIS  94           HB1      HIS  94  39.877  20.815   5.908
  672    HD1  HIS  94           HD1      HIS  94  40.403  22.957   3.058
  673    HD2  HIS  94           HD2      HIS  94  39.800  23.474   7.126
  674    HE1  HIS  94           HE1      HIS  94  39.686  25.360   3.326
  675    HE2  HIS  94           HE2      HIS  94  39.082  25.570   5.774
  676    H    ASN  95           HN       ASN  95  42.139  19.462   7.905
  677    HA   ASN  95           HA       ASN  95  41.166  21.209   9.957
  678    HB2  ASN  95           HB2      ASN  95  41.473  19.306  11.476
  679    HB3  ASN  95           HB1      ASN  95  40.705  18.760   9.988
  680   HD21  ASN  95          HD21      ASN  95  41.840  17.404   8.587
  681   HD22  ASN  95          HD22      ASN  95  43.290  16.595   9.068
  682    H    THR  96           HN       THR  96  44.333  20.049   8.913
  683    HA   THR  96           HA       THR  96  45.573  21.761  10.955
  684    HB   THR  96           HB       THR  96  47.681  20.437  10.236
  685    HG1  THR  96           HG1      THR  96  47.228  19.131   8.622
  686   HG21  THR  96          HG21      THR  96  46.601  20.174  12.414
  687   HG22  THR  96          HG22      THR  96  47.150  18.615  11.795
  688   HG23  THR  96          HG23      THR  96  45.442  19.048  11.710
  689    H    ARG  97           HN       ARG  97  44.850  21.592   7.703
  690    HA   ARG  97           HA       ARG  97  45.385  22.791   5.857
  691    HB2  ARG  97           HB2      ARG  97  46.607  24.613   7.916
  692    HB3  ARG  97           HB1      ARG  97  46.622  24.978   6.194
  693    HG2  ARG  97           HG2      ARG  97  44.144  24.727   6.211
  694    HG3  ARG  97           HG1      ARG  97  44.226  24.627   7.970
  695    HD2  ARG  97           HD2      ARG  97  45.085  26.941   6.233
  696    HD3  ARG  97           HD1      ARG  97  43.731  26.905   7.362
  697    HE   ARG  97           HE       ARG  97  45.821  26.377   8.965
  698   HH11  ARG  97          HH11      ARG  97  45.317  28.860   6.563
  699   HH12  ARG  97          HH12      ARG  97  46.325  30.025   7.364
  700   HH21  ARG  97          HH21      ARG  97  47.167  27.876  10.014
  701   HH22  ARG  97          HH22      ARG  97  47.378  29.463   9.335
  702    H    THR  98           HN       THR  98  46.575  20.909   5.402
  703    HA   THR  98           HA       THR  98  49.393  21.422   4.873
  704    HB   THR  98           HB       THR  98  49.802  18.961   5.752
  705    HG1  THR  98           HG1      THR  98  47.543  18.693   6.334
  706   HG21  THR  98          HG21      THR  98  50.963  20.924   6.656
  707   HG22  THR  98          HG22      THR  98  50.460  19.856   7.971
  708   HG23  THR  98          HG23      THR  98  49.549  21.327   7.628
  709    H    THR  99           HN       THR  99  50.253  19.880   3.257
  710    HA   THR  99           HA       THR  99  48.083  18.510   1.784
  711    HB   THR  99           HB       THR  99  49.784  18.681  -0.187
  712    HG1  THR  99           HG1      THR  99  51.598  19.661   0.270
  713   HG21  THR  99          HG21      THR  99  48.462  21.181   0.955
  714   HG22  THR  99          HG22      THR  99  47.741  20.048  -0.196
  715   HG23  THR  99          HG23      THR  99  49.103  21.063  -0.683
  716    H    THR 100           HN       THR 100  48.282  16.264   1.614
  717    HA   THR 100           HA       THR 100  50.947  15.140   2.086
  718    HB   THR 100           HB       THR 100  49.630  15.003   4.217
  719    HG1  THR 100           HG1      THR 100  50.817  13.283   4.515
  720   HG21  THR 100          HG21      THR 100  47.833  13.318   4.367
  721   HG22  THR 100          HG22      THR 100  47.902  13.114   2.617
  722   HG23  THR 100          HG23      THR 100  47.390  14.655   3.301
  723    H    PHE 101           HN       PHE 101  51.225  12.980   1.294
  724    HA   PHE 101           HA       PHE 101  49.411  12.383  -0.938
  725    HB2  PHE 101           HB2      PHE 101  52.397  12.211  -0.663
  726    HB3  PHE 101           HB1      PHE 101  51.537  11.064  -1.774
  727    HD1  PHE 101           HD1      PHE 101  50.585  11.844  -3.816
  728    HD2  PHE 101           HD2      PHE 101  52.340  14.599  -1.089
  729    HE1  PHE 101           HE1      PHE 101  50.565  13.583  -5.567
  730    HE2  PHE 101           HE2      PHE 101  52.332  16.332  -2.819
  731    HZ   PHE 101           HZ       PHE 101  51.347  15.814  -5.075
  732    H    LYS 102           HN       LYS 102  48.052  10.943  -0.079
  733    HA   LYS 102           HA       LYS 102  49.190   8.364   0.687
  734    HB2  LYS 102           HB2      LYS 102  47.122   9.917   2.245
  735    HB3  LYS 102           HB1      LYS 102  47.254   8.168   2.372
  736    HG2  LYS 102           HG2      LYS 102  49.587   8.412   3.097
  737    HG3  LYS 102           HG1      LYS 102  49.421  10.163   3.006
  738    HD2  LYS 102           HD2      LYS 102  47.655   8.445   4.736
  739    HD3  LYS 102           HD1      LYS 102  49.187   9.109   5.304
  740    HE2  LYS 102           HE2      LYS 102  48.354  11.378   4.791
  741    HE3  LYS 102           HE1      LYS 102  46.804  10.680   4.314
  742    HZ1  LYS 102           HZ1      LYS 102  46.459   9.896   6.532
  743    HZ2  LYS 102           HZ2      LYS 102  46.853  11.547   6.623
  744    HZ3  LYS 102           HZ3      LYS 102  48.015  10.373   7.013
  745    H    ASP 103           HN       ASP 103  48.647   7.263  -1.065
  746    HA   ASP 103           HA       ASP 103  45.893   7.480  -2.096
  747    HB2  ASP 103           HB2      ASP 103  47.650   8.215  -3.674
  748    HB3  ASP 103           HB1      ASP 103  48.423   6.640  -3.542
  749    HA   PRO 104           HA       PRO 104  45.139   3.326  -0.834
  750    HB2  PRO 104           HB2      PRO 104  43.454   2.987  -3.239
  751    HB3  PRO 104           HB1      PRO 104  42.975   2.940  -1.543
  752    HG2  PRO 104           HG2      PRO 104  42.348   4.984  -3.201
  753    HG3  PRO 104           HG1      PRO 104  42.586   5.207  -1.459
  754    HD2  PRO 104           HD2      PRO 104  44.371   5.900  -3.737
  755    HD3  PRO 104           HD1      PRO 104  44.175   6.705  -2.169
  756    H    ARG 105           HN       ARG 105  46.373   3.958  -4.057
  757    HA   ARG 105           HA       ARG 105  46.664   1.177  -4.740
  758    HB2  ARG 105           HB2      ARG 105  47.612   3.744  -5.932
  759    HB3  ARG 105           HB1      ARG 105  48.499   2.288  -6.342
  760    HG2  ARG 105           HG2      ARG 105  46.901   2.720  -8.047
  761    HG3  ARG 105           HG1      ARG 105  46.383   1.280  -7.164
  762    HD2  ARG 105           HD2      ARG 105  44.455   2.720  -7.610
  763    HD3  ARG 105           HD1      ARG 105  44.802   2.681  -5.876
  764    HE   ARG 105           HE       ARG 105  45.709   4.880  -6.034
  765   HH11  ARG 105          HH11      ARG 105  44.176   3.768  -9.001
  766   HH12  ARG 105          HH12      ARG 105  43.902   5.377  -9.607
  767   HH21  ARG 105          HH21      ARG 105  45.370   6.982  -6.830
  768   HH22  ARG 105          HH22      ARG 105  44.645   7.206  -8.404
  769    HA   PRO 106           HA       PRO 106  50.148   0.336  -2.184
  770    HB2  PRO 106           HB2      PRO 106  51.229  -1.820  -3.473
  771    HB3  PRO 106           HB1      PRO 106  49.699  -1.910  -2.516
  772    HG2  PRO 106           HG2      PRO 106  50.095  -1.647  -5.483
  773    HG3  PRO 106           HG1      PRO 106  48.962  -2.674  -4.589
  774    HD2  PRO 106           HD2      PRO 106  48.225  -0.339  -5.748
  775    HD3  PRO 106           HD1      PRO 106  47.471  -0.958  -4.235
  776    H    GLY 107           HN       GLY 107  51.886   1.618  -2.103
  777    HA2  GLY 107           HA2      GLY 107  54.004   2.382  -2.573
  778    HA3  GLY 107           HA1      GLY 107  54.054   1.273  -3.958
  779    H    PHE 108           HN       PHE 108  51.534   2.535  -5.065
  780    HA   PHE 108           HA       PHE 108  51.150   4.010  -6.817
  781    HB2  PHE 108           HB2      PHE 108  51.046   5.452  -4.645
  782    HB3  PHE 108           HB1      PHE 108  52.639   6.083  -5.197
  783    HD1  PHE 108           HD1      PHE 108  52.770   7.669  -6.959
  784    HD2  PHE 108           HD2      PHE 108  49.032   5.826  -6.058
  785    HE1  PHE 108           HE1      PHE 108  51.621   9.279  -8.424
  786    HE2  PHE 108           HE2      PHE 108  47.889   7.439  -7.522
  787    HZ   PHE 108           HZ       PHE 108  49.176   9.162  -8.707
  788    H    GLU 109           HN       GLU 109  52.929   2.540  -7.733
  789    HA   GLU 109           HA       GLU 109  55.108   4.242  -8.734
  790    HB2  GLU 109           HB2      GLU 109  55.831   2.416  -7.063
  791    HB3  GLU 109           HB1      GLU 109  55.276   1.250  -8.253
  792    HG2  GLU 109           HG2      GLU 109  57.644   1.464  -8.430
  793    HG3  GLU 109           HG1      GLU 109  56.903   2.146  -9.875
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1 -42.124   7.301  -4.520
    2    H2   GLY   1           HT2      GLY   1 -41.523   6.232  -5.692
    3    H3   GLY   1           HT3      GLY   1 -40.579   7.539  -5.174
    4    HA2  GLY   1           HA1      GLY   1 -41.440   5.323  -3.405
    5    HA3  GLY   1           HA2      GLY   1 -39.879   5.380  -4.216
    6    H    SER   2           HN       SER   2 -40.580   5.400  -1.334
    7    HA   SER   2           HA       SER   2 -39.707   8.046  -0.506
    8    HB2  SER   2           HB2      SER   2 -40.457   5.604   1.120
    9    HB3  SER   2           HB1      SER   2 -40.066   7.184   1.791
   10    HG   SER   2           HG       SER   2 -42.006   7.822   1.353
   11    H    HIS   3           HN       HIS   3 -38.172   5.269  -1.493
   12    HA   HIS   3           HA       HIS   3 -35.825   5.840   0.199
   13    HB2  HIS   3           HB2      HIS   3 -36.647   3.151  -0.937
   14    HB3  HIS   3           HB1      HIS   3 -35.165   3.463  -0.047
   15    HD1  HIS   3           HD1      HIS   3 -38.052   1.778   0.503
   16    HD2  HIS   3           HD2      HIS   3 -36.245   4.869   2.616
   17    HE1  HIS   3           HE1      HIS   3 -38.970   1.618   2.839
   18    HE2  HIS   3           HE2      HIS   3 -37.696   3.366   4.155
   19    H    MET   4           HN       MET   4 -33.738   5.365  -0.857
   20    HA   MET   4           HA       MET   4 -33.883   5.530  -3.798
   21    HB2  MET   4           HB2      MET   4 -31.708   6.741  -2.067
   22    HB3  MET   4           HB1      MET   4 -31.931   6.950  -3.797
   23    HG2  MET   4           HG2      MET   4 -34.072   8.115  -3.329
   24    HG3  MET   4           HG1      MET   4 -33.700   8.011  -1.610
   25    HE1  MET   4           HE1      MET   4 -31.355  10.499  -4.705
   26    HE2  MET   4           HE2      MET   4 -32.808   9.558  -5.047
   27    HE3  MET   4           HE3      MET   4 -31.291   8.738  -4.684
   28    H    GLN   5           HN       GLN   5 -32.528   4.099  -4.902
   29    HA   GLN   5           HA       GLN   5 -31.498   1.949  -3.279
   30    HB2  GLN   5           HB2      GLN   5 -32.792   1.403  -5.286
   31    HB3  GLN   5           HB1      GLN   5 -31.612   2.234  -6.286
   32    HG2  GLN   5           HG2      GLN   5 -29.936   0.600  -5.782
   33    HG3  GLN   5           HG1      GLN   5 -30.978  -0.179  -4.596
   34   HE21  GLN   5          HE21      GLN   5 -30.309   0.276  -7.970
   35   HE22  GLN   5          HE22      GLN   5 -31.370  -0.994  -8.542
   36    H    TYR   6           HN       TYR   6 -29.508   1.876  -2.556
   37    HA   TYR   6           HA       TYR   6 -27.435   3.374  -4.016
   38    HB2  TYR   6           HB2      TYR   6 -27.728   2.800  -1.052
   39    HB3  TYR   6           HB1      TYR   6 -26.153   3.184  -1.736
   40    HD1  TYR   6           HD1      TYR   6 -25.678   5.436  -2.548
   41    HD2  TYR   6           HD2      TYR   6 -29.489   4.464  -0.916
   42    HE1  TYR   6           HE1      TYR   6 -26.208   7.832  -2.368
   43    HE2  TYR   6           HE2      TYR   6 -30.031   6.860  -0.741
   44    HH   TYR   6           HH       TYR   6 -28.886   9.024  -0.607
   45    H    LYS   7           HN       LYS   7 -25.304   2.380  -4.043
   46    HA   LYS   7           HA       LYS   7 -25.374  -0.539  -3.766
   47    HB2  LYS   7           HB2      LYS   7 -24.055  -0.606  -5.977
   48    HB3  LYS   7           HB1      LYS   7 -25.799  -0.287  -6.085
   49    HG2  LYS   7           HG2      LYS   7 -25.352   2.094  -6.314
   50    HG3  LYS   7           HG1      LYS   7 -23.620   1.795  -6.205
   51    HD2  LYS   7           HD2      LYS   7 -24.065   1.982  -8.510
   52    HD3  LYS   7           HD1      LYS   7 -23.939   0.246  -8.215
   53    HE2  LYS   7           HE2      LYS   7 -25.829   0.595  -9.619
   54    HE3  LYS   7           HE1      LYS   7 -26.439   0.191  -8.012
   55    HZ1  LYS   7           HZ1      LYS   7 -26.325   2.872  -9.291
   56    HZ2  LYS   7           HZ2      LYS   7 -26.645   2.651  -7.644
   57    HZ3  LYS   7           HZ3      LYS   7 -27.704   2.014  -8.803
   58    H    LEU   8           HN       LEU   8 -23.326  -1.565  -3.628
   59    HA   LEU   8           HA       LEU   8 -21.028   0.189  -3.078
   60    HB2  LEU   8           HB2      LEU   8 -22.063  -0.369  -0.877
   61    HB3  LEU   8           HB1      LEU   8 -21.965  -2.055  -1.286
   62    HG   LEU   8           HG       LEU   8 -19.412  -1.645  -1.446
   63   HD11  LEU   8          HD11      LEU   8 -19.468   0.778  -1.319
   64   HD12  LEU   8          HD12      LEU   8 -18.628   0.118   0.085
   65   HD13  LEU   8          HD13      LEU   8 -20.288   0.697   0.238
   66   HD21  LEU   8          HD21      LEU   8 -20.227  -3.091   0.174
   67   HD22  LEU   8          HD22      LEU   8 -21.083  -1.803   1.016
   68   HD23  LEU   8          HD23      LEU   8 -19.320  -1.887   1.092
   69    H    ILE   9           HN       ILE   9 -19.052  -0.684  -3.505
   70    HA   ILE   9           HA       ILE   9 -19.032  -3.367  -4.710
   71    HB   ILE   9           HB       ILE   9 -17.520  -0.924  -5.685
   72   HG12  ILE   9          HG12      ILE   9 -19.604  -2.647  -7.099
   73   HG13  ILE   9          HG11      ILE   9 -19.937  -1.022  -6.399
   74   HG21  ILE   9          HG21      ILE   9 -16.086  -2.852  -5.831
   75   HG22  ILE   9          HG22      ILE   9 -16.655  -2.431  -7.451
   76   HG23  ILE   9          HG23      ILE   9 -17.372  -3.796  -6.595
   77   HD11  ILE   9          HD11      ILE   9 -18.027  -1.670  -8.667
   78   HD12  ILE   9          HD12      ILE   9 -18.304  -0.067  -7.986
   79   HD13  ILE   9          HD13      ILE   9 -19.613  -0.910  -8.816
   80    H    LEU  10           HN       LEU  10 -17.616  -4.705  -3.730
   81    HA   LEU  10           HA       LEU  10 -15.737  -3.494  -1.849
   82    HB2  LEU  10           HB2      LEU  10 -16.416  -6.413  -2.174
   83    HB3  LEU  10           HB1      LEU  10 -15.344  -5.745  -0.973
   84    HG   LEU  10           HG       LEU  10 -17.202  -6.112   0.277
   85   HD11  LEU  10          HD11      LEU  10 -17.810  -3.374  -0.752
   86   HD12  LEU  10          HD12      LEU  10 -16.614  -3.774   0.499
   87   HD13  LEU  10          HD13      LEU  10 -18.331  -4.073   0.782
   88   HD21  LEU  10          HD21      LEU  10 -18.613  -6.908  -1.567
   89   HD22  LEU  10          HD22      LEU  10 -18.994  -5.235  -1.978
   90   HD23  LEU  10          HD23      LEU  10 -19.503  -5.899  -0.428
   91    H    ASN  11           HN       ASN  11 -13.984  -2.873  -2.842
   92    HA   ASN  11           HA       ASN  11 -12.785  -4.606  -4.860
   93    HB2  ASN  11           HB2      ASN  11 -12.109  -1.790  -3.936
   94    HB3  ASN  11           HB1      ASN  11 -11.180  -2.675  -5.121
   95   HD21  ASN  11          HD21      ASN  11 -11.601  -2.106  -7.093
   96   HD22  ASN  11          HD22      ASN  11 -13.116  -1.568  -7.714
   97    H    GLY  12           HN       GLY  12 -12.223  -6.250  -3.360
   98    HA2  GLY  12           HA2      GLY  12  -9.664  -5.667  -2.028
   99    HA3  GLY  12           HA1      GLY  12 -10.955  -6.457  -1.094
  100    H    LYS  13           HN       LYS  13  -8.257  -7.320  -1.907
  101    HA   LYS  13           HA       LYS  13  -8.071  -9.094  -3.974
  102    HB2  LYS  13           HB2      LYS  13  -6.813  -9.396  -1.234
  103    HB3  LYS  13           HB1      LYS  13  -6.264 -10.174  -2.712
  104    HG2  LYS  13           HG2      LYS  13  -5.515  -8.154  -3.632
  105    HG3  LYS  13           HG1      LYS  13  -6.441  -7.190  -2.479
  106    HD2  LYS  13           HD2      LYS  13  -4.992  -8.055  -0.663
  107    HD3  LYS  13           HD1      LYS  13  -4.030  -8.900  -1.879
  108    HE2  LYS  13           HE2      LYS  13  -3.023  -6.755  -1.208
  109    HE3  LYS  13           HE1      LYS  13  -3.436  -6.799  -2.921
  110    HZ1  LYS  13           HZ1      LYS  13  -5.019  -5.471  -0.770
  111    HZ2  LYS  13           HZ2      LYS  13  -5.460  -5.555  -2.403
  112    HZ3  LYS  13           HZ3      LYS  13  -4.074  -4.699  -1.950
  113    H    THR  14           HN       THR  14  -9.275  -9.817  -0.686
  114    HA   THR  14           HA       THR  14 -10.048 -12.505  -1.625
  115    HB   THR  14           HB       THR  14 -10.390 -12.922   0.870
  116    HG1  THR  14           HG1      THR  14 -10.236 -11.143   2.008
  117   HG21  THR  14          HG21      THR  14  -7.606 -12.275  -0.101
  118   HG22  THR  14          HG22      THR  14  -8.459 -13.797  -0.362
  119   HG23  THR  14          HG23      THR  14  -8.003 -13.307   1.272
  120    H    LEU  15           HN       LEU  15 -11.405  -9.696  -1.787
  121    HA   LEU  15           HA       LEU  15 -14.067 -10.627  -1.186
  122    HB2  LEU  15           HB2      LEU  15 -12.748  -9.083   0.728
  123    HB3  LEU  15           HB1      LEU  15 -13.734  -7.929  -0.132
  124    HG   LEU  15           HG       LEU  15 -14.963  -8.628   1.765
  125   HD11  LEU  15          HD11      LEU  15 -16.935  -9.637   0.794
  126   HD12  LEU  15          HD12      LEU  15 -15.996 -10.135  -0.615
  127   HD13  LEU  15          HD13      LEU  15 -16.247  -8.422  -0.285
  128   HD21  LEU  15          HD21      LEU  15 -15.441 -10.947   2.298
  129   HD22  LEU  15          HD22      LEU  15 -13.701 -10.660   2.269
  130   HD23  LEU  15          HD23      LEU  15 -14.482 -11.483   0.921
  131    H    LYS  16           HN       LYS  16 -14.491 -10.448  -3.331
  132    HA   LYS  16           HA       LYS  16 -14.558  -7.736  -4.416
  133    HB2  LYS  16           HB2      LYS  16 -13.429 -10.235  -5.642
  134    HB3  LYS  16           HB1      LYS  16 -14.048  -8.955  -6.667
  135    HG2  LYS  16           HG2      LYS  16 -12.442  -7.430  -5.862
  136    HG3  LYS  16           HG1      LYS  16 -11.887  -8.521  -4.579
  137    HD2  LYS  16           HD2      LYS  16 -11.105 -10.048  -6.318
  138    HD3  LYS  16           HD1      LYS  16 -11.681  -8.905  -7.543
  139    HE2  LYS  16           HE2      LYS  16 -10.142  -7.212  -6.709
  140    HE3  LYS  16           HE1      LYS  16  -9.569  -8.328  -5.473
  141    HZ1  LYS  16           HZ1      LYS  16  -9.333  -8.802  -8.403
  142    HZ2  LYS  16           HZ2      LYS  16  -8.668  -9.752  -7.165
  143    HZ3  LYS  16           HZ3      LYS  16  -8.098  -8.177  -7.423
  144    H    GLY  17           HN       GLY  17 -16.602  -7.259  -4.733
  145    HA2  GLY  17           HA2      GLY  17 -18.384  -8.639  -6.334
  146    HA3  GLY  17           HA1      GLY  17 -18.717  -9.133  -4.677
  147    H    GLU  18           HN       GLU  18 -20.832  -8.008  -5.370
  148    HA   GLU  18           HA       GLU  18 -20.648  -5.194  -4.543
  149    HB2  GLU  18           HB2      GLU  18 -22.448  -6.160  -6.776
  150    HB3  GLU  18           HB1      GLU  18 -22.203  -4.499  -6.259
  151    HG2  GLU  18           HG2      GLU  18 -20.000  -4.468  -7.151
  152    HG3  GLU  18           HG1      GLU  18 -20.018  -6.209  -7.431
  153    H    THR  19           HN       THR  19 -22.814  -4.318  -3.962
  154    HA   THR  19           HA       THR  19 -24.903  -6.181  -3.305
  155    HB   THR  19           HB       THR  19 -23.318  -6.539  -1.409
  156    HG1  THR  19           HG1      THR  19 -25.195  -6.933  -0.517
  157   HG21  THR  19          HG21      THR  19 -23.903  -3.622  -0.810
  158   HG22  THR  19          HG22      THR  19 -22.336  -4.280  -1.290
  159   HG23  THR  19          HG23      THR  19 -23.047  -4.730   0.262
  160    H    THR  20           HN       THR  20 -26.760  -5.004  -2.280
  161    HA   THR  20           HA       THR  20 -26.697  -2.119  -2.783
  162    HB   THR  20           HB       THR  20 -28.999  -2.374  -3.859
  163    HG1  THR  20           HG1      THR  20 -29.711  -4.361  -4.079
  164   HG21  THR  20          HG21      THR  20 -26.514  -3.345  -5.283
  165   HG22  THR  20          HG22      THR  20 -27.191  -1.712  -5.291
  166   HG23  THR  20          HG23      THR  20 -28.034  -3.023  -6.111
  167    H    THR  21           HN       THR  21 -28.467  -0.958  -1.836
  168    HA   THR  21           HA       THR  21 -30.359  -2.319  -0.146
  169    HB   THR  21           HB       THR  21 -28.241  -2.159   1.289
  170    HG1  THR  21           HG1      THR  21 -30.199  -0.637   2.567
  171   HG21  THR  21          HG21      THR  21 -27.479   0.092   0.641
  172   HG22  THR  21          HG22      THR  21 -27.882   0.090   2.362
  173   HG23  THR  21          HG23      THR  21 -29.005   0.782   1.193
  174    H    GLU  22           HN       GLU  22 -31.945  -0.831   0.715
  175    HA   GLU  22           HA       GLU  22 -32.085   1.629  -0.894
  176    HB2  GLU  22           HB2      GLU  22 -34.550   1.510  -0.421
  177    HB3  GLU  22           HB1      GLU  22 -33.972   0.097  -1.301
  178    HG2  GLU  22           HG2      GLU  22 -33.809  -1.071   0.938
  179    HG3  GLU  22           HG1      GLU  22 -34.749   0.314   1.599
  180    H    ALA  23           HN       ALA  23 -31.898   3.551   0.077
  181    HA   ALA  23           HA       ALA  23 -32.446   3.729   2.976
  182    HB1  ALA  23           HB1      ALA  23 -29.910   4.789   1.693
  183    HB2  ALA  23           HB2      ALA  23 -30.008   3.352   2.710
  184    HB3  ALA  23           HB3      ALA  23 -30.373   4.939   3.389
  185    H    VAL  24           HN       VAL  24 -32.854   5.964   3.670
  186    HA   VAL  24           HA       VAL  24 -34.060   7.536   1.610
  187    HB   VAL  24           HB       VAL  24 -35.341   7.230   3.580
  188   HG11  VAL  24          HG11      VAL  24 -34.533   7.963   5.816
  189   HG12  VAL  24          HG12      VAL  24 -32.937   8.220   5.115
  190   HG13  VAL  24          HG13      VAL  24 -33.631   6.600   5.157
  191   HG21  VAL  24          HG21      VAL  24 -34.133   9.960   3.630
  192   HG22  VAL  24          HG22      VAL  24 -35.661   9.500   4.378
  193   HG23  VAL  24          HG23      VAL  24 -35.475   9.429   2.626
  194    H    ASP  25           HN       ASP  25 -31.089   7.573   3.436
  195    HA   ASP  25           HA       ASP  25 -30.382  10.104   2.151
  196    HB2  ASP  25           HB2      ASP  25 -31.065  10.547   4.564
  197    HB3  ASP  25           HB1      ASP  25 -29.670   9.591   5.052
  198    H    ALA  26           HN       ALA  26 -28.026  10.432   2.073
  199    HA   ALA  26           HA       ALA  26 -26.751   7.981   1.299
  200    HB1  ALA  26           HB1      ALA  26 -26.428  10.080   0.050
  201    HB2  ALA  26           HB2      ALA  26 -24.898   9.399   0.608
  202    HB3  ALA  26           HB3      ALA  26 -25.614  10.773   1.452
  203    H    ALA  27           HN       ALA  27 -26.511  10.238   3.996
  204    HA   ALA  27           HA       ALA  27 -24.096   9.283   5.105
  205    HB1  ALA  27           HB1      ALA  27 -24.779  10.403   7.143
  206    HB2  ALA  27           HB2      ALA  27 -26.441  10.508   6.564
  207    HB3  ALA  27           HB3      ALA  27 -25.166  11.417   5.752
  208    H    THR  28           HN       THR  28 -27.419   8.244   5.362
  209    HA   THR  28           HA       THR  28 -27.021   6.344   7.454
  210    HB   THR  28           HB       THR  28 -29.221   6.217   5.383
  211    HG1  THR  28           HG1      THR  28 -28.895   8.035   7.564
  212   HG21  THR  28          HG21      THR  28 -29.094   4.387   7.022
  213   HG22  THR  28          HG22      THR  28 -30.538   5.369   7.287
  214   HG23  THR  28          HG23      THR  28 -29.135   5.555   8.341
  215    H    ALA  29           HN       ALA  29 -26.555   6.331   4.008
  216    HA   ALA  29           HA       ALA  29 -26.759   3.475   3.689
  217    HB1  ALA  29           HB1      ALA  29 -26.016   3.869   1.416
  218    HB2  ALA  29           HB2      ALA  29 -25.600   5.536   1.814
  219    HB3  ALA  29           HB3      ALA  29 -27.286   5.016   1.842
  220    H    GLU  30           HN       GLU  30 -24.235   5.883   4.077
  221    HA   GLU  30           HA       GLU  30 -22.036   4.209   3.636
  222    HB2  GLU  30           HB2      GLU  30 -22.174   6.827   4.003
  223    HB3  GLU  30           HB1      GLU  30 -21.918   6.383   5.684
  224    HG2  GLU  30           HG2      GLU  30 -19.931   4.981   4.712
  225    HG3  GLU  30           HG1      GLU  30 -20.062   6.134   3.384
  226    H    LYS  31           HN       LYS  31 -23.462   5.335   6.671
  227    HA   LYS  31           HA       LYS  31 -21.993   3.972   8.485
  228    HB2  LYS  31           HB2      LYS  31 -24.868   4.802   8.595
  229    HB3  LYS  31           HB1      LYS  31 -24.050   4.083   9.976
  230    HG2  LYS  31           HG2      LYS  31 -23.355   6.653   8.578
  231    HG3  LYS  31           HG1      LYS  31 -23.945   6.444  10.229
  232    HD2  LYS  31           HD2      LYS  31 -21.901   5.258  10.824
  233    HD3  LYS  31           HD1      LYS  31 -21.315   5.424   9.171
  234    HE2  LYS  31           HE2      LYS  31 -20.252   7.095  10.509
  235    HE3  LYS  31           HE1      LYS  31 -21.417   7.891   9.450
  236    HZ1  LYS  31           HZ1      LYS  31 -21.993   7.164  12.267
  237    HZ2  LYS  31           HZ2      LYS  31 -22.928   8.147  11.245
  238    HZ3  LYS  31           HZ3      LYS  31 -21.415   8.684  11.785
  239    H    VAL  32           HN       VAL  32 -24.886   2.682   6.865
  240    HA   VAL  32           HA       VAL  32 -24.919   0.262   8.370
  241    HB   VAL  32           HB       VAL  32 -26.136   0.842   5.657
  242   HG11  VAL  32          HG11      VAL  32 -25.955  -1.535   5.966
  243   HG12  VAL  32          HG12      VAL  32 -27.639  -1.049   6.174
  244   HG13  VAL  32          HG13      VAL  32 -26.648  -1.415   7.586
  245   HG21  VAL  32          HG21      VAL  32 -27.292   1.011   8.437
  246   HG22  VAL  32          HG22      VAL  32 -28.230   1.143   6.950
  247   HG23  VAL  32          HG23      VAL  32 -26.999   2.348   7.325
  248    H    PHE  33           HN       PHE  33 -23.632   1.079   5.135
  249    HA   PHE  33           HA       PHE  33 -22.691  -1.571   4.660
  250    HB2  PHE  33           HB2      PHE  33 -22.200   1.066   3.343
  251    HB3  PHE  33           HB1      PHE  33 -21.221  -0.314   2.917
  252    HD1  PHE  33           HD1      PHE  33 -23.278  -2.464   3.016
  253    HD2  PHE  33           HD2      PHE  33 -23.443   1.481   1.427
  254    HE1  PHE  33           HE1      PHE  33 -24.993  -3.190   1.407
  255    HE2  PHE  33           HE2      PHE  33 -25.157   0.764  -0.192
  256    HZ   PHE  33           HZ       PHE  33 -25.942  -1.580  -0.214
  257    H    LYS  34           HN       LYS  34 -21.441   1.031   6.569
  258    HA   LYS  34           HA       LYS  34 -18.705   0.346   6.428
  259    HB2  LYS  34           HB2      LYS  34 -20.291   1.707   8.607
  260    HB3  LYS  34           HB1      LYS  34 -18.563   1.581   8.643
  261    HG2  LYS  34           HG2      LYS  34 -18.873   2.696   6.251
  262    HG3  LYS  34           HG1      LYS  34 -20.238   3.383   7.148
  263    HD2  LYS  34           HD2      LYS  34 -18.519   4.801   7.717
  264    HD3  LYS  34           HD1      LYS  34 -18.504   3.681   9.047
  265    HE2  LYS  34           HE2      LYS  34 -16.276   3.741   8.541
  266    HE3  LYS  34           HE1      LYS  34 -16.810   2.399   7.533
  267    HZ1  LYS  34           HZ1      LYS  34 -16.533   5.202   6.581
  268    HZ2  LYS  34           HZ2      LYS  34 -16.836   3.831   5.635
  269    HZ3  LYS  34           HZ3      LYS  34 -15.335   4.018   6.398
  270    H    GLN  35           HN       GLN  35 -21.332  -0.593   8.580
  271    HA   GLN  35           HA       GLN  35 -19.782  -2.373  10.165
  272    HB2  GLN  35           HB2      GLN  35 -21.946  -1.337  10.897
  273    HB3  GLN  35           HB1      GLN  35 -22.785  -2.342   9.728
  274    HG2  GLN  35           HG2      GLN  35 -22.990  -3.312  11.906
  275    HG3  GLN  35           HG1      GLN  35 -21.979  -4.347  10.900
  276   HE21  GLN  35          HE21      GLN  35 -22.172  -4.130  13.815
  277   HE22  GLN  35          HE22      GLN  35 -20.577  -3.773  14.373
  278    H    TYR  36           HN       TYR  36 -21.565  -2.568   7.208
  279    HA   TYR  36           HA       TYR  36 -21.666  -5.384   6.953
  280    HB2  TYR  36           HB2      TYR  36 -23.182  -4.162   5.624
  281    HB3  TYR  36           HB1      TYR  36 -21.930  -3.071   5.053
  282    HD1  TYR  36           HD1      TYR  36 -23.040  -6.584   4.873
  283    HD2  TYR  36           HD2      TYR  36 -20.899  -3.454   2.967
  284    HE1  TYR  36           HE1      TYR  36 -22.793  -7.998   2.881
  285    HE2  TYR  36           HE2      TYR  36 -20.650  -4.843   0.951
  286    HH   TYR  36           HH       TYR  36 -22.422  -7.669   0.436
  287    H    ALA  37           HN       ALA  37 -19.459  -2.912   5.642
  288    HA   ALA  37           HA       ALA  37 -17.729  -4.794   4.384
  289    HB1  ALA  37           HB1      ALA  37 -17.880  -2.443   3.680
  290    HB2  ALA  37           HB2      ALA  37 -16.219  -2.904   4.076
  291    HB3  ALA  37           HB3      ALA  37 -17.167  -1.946   5.215
  292    H    ASN  38           HN       ASN  38 -17.893  -3.280   7.533
  293    HA   ASN  38           HA       ASN  38 -15.368  -4.031   8.537
  294    HB2  ASN  38           HB2      ASN  38 -16.926  -2.427   9.684
  295    HB3  ASN  38           HB1      ASN  38 -17.969  -3.786  10.098
  296   HD21  ASN  38          HD21      ASN  38 -17.323  -5.228  11.741
  297   HD22  ASN  38          HD22      ASN  38 -15.968  -4.865  12.826
  298    H    ASP  39           HN       ASP  39 -18.472  -5.683   8.478
  299    HA   ASP  39           HA       ASP  39 -17.625  -7.977   9.925
  300    HB2  ASP  39           HB2      ASP  39 -19.997  -7.246   9.687
  301    HB3  ASP  39           HB1      ASP  39 -19.934  -7.719   7.991
  302    H    ASN  40           HN       ASN  40 -17.234  -6.961   6.666
  303    HA   ASN  40           HA       ASN  40 -16.633  -9.656   5.726
  304    HB2  ASN  40           HB2      ASN  40 -17.091  -7.013   4.402
  305    HB3  ASN  40           HB1      ASN  40 -16.113  -8.210   3.562
  306   HD21  ASN  40          HD21      ASN  40 -19.299  -7.369   4.700
  307   HD22  ASN  40          HD22      ASN  40 -20.146  -8.680   3.863
  308    H    GLY  41           HN       GLY  41 -15.069  -7.007   7.114
  309    HA2  GLY  41           HA2      GLY  41 -12.865  -6.911   7.819
  310    HA3  GLY  41           HA1      GLY  41 -12.522  -8.337   6.852
  311    H    VAL  42           HN       VAL  42 -14.041  -5.472   5.454
  312    HA   VAL  42           HA       VAL  42 -11.580  -5.109   3.926
  313    HB   VAL  42           HB       VAL  42 -14.386  -4.212   3.197
  314   HG11  VAL  42          HG11      VAL  42 -12.740  -2.724   2.262
  315   HG12  VAL  42          HG12      VAL  42 -13.299  -3.795   0.974
  316   HG13  VAL  42          HG13      VAL  42 -11.734  -4.076   1.742
  317   HG21  VAL  42          HG21      VAL  42 -14.169  -5.974   1.453
  318   HG22  VAL  42          HG22      VAL  42 -14.237  -6.600   3.103
  319   HG23  VAL  42          HG23      VAL  42 -12.691  -6.518   2.249
  320    H    ASP  43           HN       ASP  43 -10.378  -3.474   4.414
  321    HA   ASP  43           HA       ASP  43 -11.596  -1.056   5.599
  322    HB2  ASP  43           HB2      ASP  43  -8.782  -2.133   6.130
  323    HB3  ASP  43           HB1      ASP  43  -9.351  -0.550   6.621
  324    H    GLY  44           HN       GLY  44 -11.191   0.867   4.479
  325    HA2  GLY  44           HA2      GLY  44  -8.969   1.311   2.836
  326    HA3  GLY  44           HA1      GLY  44 -10.261   0.653   1.844
  327    H    GLU  45           HN       GLU  45  -9.619   2.923   0.965
  328    HA   GLU  45           HA       GLU  45 -10.834   5.147   2.236
  329    HB2  GLU  45           HB2      GLU  45 -10.068   4.750  -0.661
  330    HB3  GLU  45           HB1      GLU  45 -10.559   6.283   0.044
  331    HG2  GLU  45           HG2      GLU  45  -8.318   6.537   0.163
  332    HG3  GLU  45           HG1      GLU  45  -8.579   5.732   1.710
  333    H    TRP  46           HN       TRP  46 -12.694   6.301   1.584
  334    HA   TRP  46           HA       TRP  46 -14.738   4.527   0.426
  335    HB2  TRP  46           HB2      TRP  46 -14.871   6.409   2.758
  336    HB3  TRP  46           HB1      TRP  46 -16.325   6.166   1.804
  337    HD1  TRP  46           HD1      TRP  46 -13.668   3.996   3.612
  338    HE1  TRP  46           HE1      TRP  46 -14.818   1.918   4.570
  339    HE3  TRP  46           HE3      TRP  46 -18.459   4.813   1.903
  340    HZ2  TRP  46           HZ2      TRP  46 -17.371   0.792   4.620
  341    HZ3  TRP  46           HZ3      TRP  46 -20.185   3.187   2.492
  342    HH2  TRP  46           HH2      TRP  46 -19.657   1.206   3.819
  343    H    THR  47           HN       THR  47 -15.012   5.093  -1.599
  344    HA   THR  47           HA       THR  47 -15.032   7.944  -2.300
  345    HB   THR  47           HB       THR  47 -14.807   7.027  -4.684
  346    HG1  THR  47           HG1      THR  47 -14.102   4.702  -3.179
  347   HG21  THR  47          HG21      THR  47 -12.574   6.575  -2.707
  348   HG22  THR  47          HG22      THR  47 -12.967   8.101  -3.494
  349   HG23  THR  47          HG23      THR  47 -12.373   6.743  -4.452
  350    H    TYR  48           HN       TYR  48 -16.661   8.624  -3.893
  351    HA   TYR  48           HA       TYR  48 -18.978   6.915  -4.089
  352    HB2  TYR  48           HB2      TYR  48 -19.478   7.815  -1.940
  353    HB3  TYR  48           HB1      TYR  48 -19.080   9.443  -2.425
  354    HD1  TYR  48           HD1      TYR  48 -20.738  10.860  -3.317
  355    HD2  TYR  48           HD2      TYR  48 -21.580   6.690  -2.943
  356    HE1  TYR  48           HE1      TYR  48 -23.096  11.281  -3.868
  357    HE2  TYR  48           HE2      TYR  48 -23.921   7.117  -3.491
  358    HH   TYR  48           HH       TYR  48 -25.527   8.845  -3.521
  359    H    ASP  49           HN       ASP  49 -20.534   7.636  -5.584
  360    HA   ASP  49           HA       ASP  49 -19.725   9.936  -7.264
  361    HB2  ASP  49           HB2      ASP  49 -18.914   7.913  -8.472
  362    HB3  ASP  49           HB1      ASP  49 -20.504   7.194  -8.369
  363    H    ASP  50           HN       ASP  50 -21.483  11.202  -7.885
  364    HA   ASP  50           HA       ASP  50 -23.956  10.556  -6.451
  365    HB2  ASP  50           HB2      ASP  50 -24.538  12.897  -6.785
  366    HB3  ASP  50           HB1      ASP  50 -22.804  12.904  -6.418
  367    H    ALA  51           HN       ALA  51 -22.782  10.510  -9.710
  368    HA   ALA  51           HA       ALA  51 -25.362  10.687 -10.943
  369    HB1  ALA  51           HB1      ALA  51 -24.214  10.074 -13.002
  370    HB2  ALA  51           HB2      ALA  51 -22.766   9.650 -12.087
  371    HB3  ALA  51           HB3      ALA  51 -23.321  11.322 -12.133
  372    H    THR  52           HN       THR  52 -23.253   8.054  -9.917
  373    HA   THR  52           HA       THR  52 -25.177   6.091 -10.900
  374    HB   THR  52           HB       THR  52 -23.394   4.436 -10.215
  375    HG1  THR  52           HG1      THR  52 -21.798   6.800  -9.952
  376   HG21  THR  52          HG21      THR  52 -21.951   4.936 -12.128
  377   HG22  THR  52          HG22      THR  52 -22.575   6.585 -12.181
  378   HG23  THR  52          HG23      THR  52 -23.641   5.225 -12.535
  379    H    LYS  53           HN       LYS  53 -24.262   7.611  -7.963
  380    HA   LYS  53           HA       LYS  53 -24.913   7.334  -5.762
  381    HB2  LYS  53           HB2      LYS  53 -26.996   5.364  -6.746
  382    HB3  LYS  53           HB1      LYS  53 -27.013   6.319  -5.278
  383    HG2  LYS  53           HG2      LYS  53 -27.150   7.553  -7.997
  384    HG3  LYS  53           HG1      LYS  53 -28.563   7.099  -7.045
  385    HD2  LYS  53           HD2      LYS  53 -26.394   8.982  -6.121
  386    HD3  LYS  53           HD1      LYS  53 -27.940   9.466  -6.791
  387    HE2  LYS  53           HE2      LYS  53 -29.114   8.371  -4.970
  388    HE3  LYS  53           HE1      LYS  53 -27.580   7.816  -4.310
  389    HZ1  LYS  53           HZ1      LYS  53 -26.980  10.253  -4.151
  390    HZ2  LYS  53           HZ2      LYS  53 -28.163   9.697  -3.074
  391    HZ3  LYS  53           HZ3      LYS  53 -28.617  10.586  -4.440
  392    H    THR  54           HN       THR  54 -22.761   6.052  -6.439
  393    HA   THR  54           HA       THR  54 -22.990   3.279  -5.515
  394    HB   THR  54           HB       THR  54 -20.837   4.342  -7.358
  395    HG1  THR  54           HG1      THR  54 -22.362   4.308  -8.810
  396   HG21  THR  54          HG21      THR  54 -21.737   1.501  -6.723
  397   HG22  THR  54          HG22      THR  54 -20.275   2.269  -6.103
  398   HG23  THR  54          HG23      THR  54 -20.439   1.949  -7.830
  399    H    TYR  55           HN       TYR  55 -21.989   2.886  -3.656
  400    HA   TYR  55           HA       TYR  55 -19.811   4.633  -2.750
  401    HB2  TYR  55           HB2      TYR  55 -21.560   2.623  -1.289
  402    HB3  TYR  55           HB1      TYR  55 -19.991   3.081  -0.634
  403    HD1  TYR  55           HD1      TYR  55 -23.361   4.363  -1.495
  404    HD2  TYR  55           HD2      TYR  55 -19.624   5.184   0.380
  405    HE1  TYR  55           HE1      TYR  55 -24.324   6.379  -0.459
  406    HE2  TYR  55           HE2      TYR  55 -20.575   7.197   1.414
  407    HH   TYR  55           HH       TYR  55 -22.342   8.718   1.166
  408    H    THR  56           HN       THR  56 -17.716   3.961  -2.828
  409    HA   THR  56           HA       THR  56 -17.257   1.106  -3.425
  410    HB   THR  56           HB       THR  56 -15.687   3.436  -4.558
  411    HG1  THR  56           HG1      THR  56 -17.998   2.588  -5.317
  412   HG21  THR  56          HG21      THR  56 -14.310   1.423  -4.238
  413   HG22  THR  56          HG22      THR  56 -14.601   1.714  -5.953
  414   HG23  THR  56          HG23      THR  56 -15.503   0.460  -5.105
  415    H    VAL  57           HN       VAL  57 -15.955   0.095  -2.053
  416    HA   VAL  57           HA       VAL  57 -14.229   1.757  -0.337
  417    HB   VAL  57           HB       VAL  57 -15.920   0.553   1.039
  418   HG11  VAL  57          HG11      VAL  57 -14.722  -1.941  -0.153
  419   HG12  VAL  57          HG12      VAL  57 -16.412  -1.427  -0.186
  420   HG13  VAL  57          HG13      VAL  57 -15.673  -1.928   1.327
  421   HG21  VAL  57          HG21      VAL  57 -13.722   1.060   1.969
  422   HG22  VAL  57          HG22      VAL  57 -13.126  -0.507   1.420
  423   HG23  VAL  57          HG23      VAL  57 -14.392  -0.423   2.646
  424    H    THR  58           HN       THR  58 -12.222   1.712  -1.011
  425    HA   THR  58           HA       THR  58 -11.366  -0.568  -2.657
  426    HB   THR  58           HB       THR  58  -9.914   2.063  -2.388
  427    HG1  THR  58           HG1      THR  58 -12.338   1.684  -3.410
  428   HG21  THR  58          HG21      THR  58  -8.693   0.172  -3.407
  429   HG22  THR  58          HG22      THR  58  -9.014   1.449  -4.581
  430   HG23  THR  58          HG23      THR  58  -9.992  -0.021  -4.585
  431    H    GLU  59           HN       GLU  59 -10.163  -2.040  -1.746
  432    HA   GLU  59           HA       GLU  59  -8.955  -1.698   0.824
  433    HB2  GLU  59           HB2      GLU  59  -9.945  -3.847  -0.102
  434    HB3  GLU  59           HB1      GLU  59  -8.552  -3.935  -1.165
  435    HG2  GLU  59           HG2      GLU  59  -7.742  -3.708   1.590
  436    HG3  GLU  59           HG1      GLU  59  -8.815  -5.077   1.335
  437    H    GLY  60           HN       GLY  60  -7.398   0.036   0.462
  438    HA2  GLY  60           HA2      GLY  60  -4.959  -0.894  -0.917
  439    HA3  GLY  60           HA1      GLY  60  -5.584   0.736  -1.166
  440    H    SER  61           HN       SER  61  -3.214  -0.787   0.292
  441    HA   SER  61           HA       SER  61  -2.936   1.297   2.302
  442    HB2  SER  61           HB2      SER  61  -2.714  -1.651   2.993
  443    HB3  SER  61           HB1      SER  61  -2.350  -0.308   4.078
  444    HG   SER  61           HG       SER  61  -4.815  -0.051   2.978
  445    H    GLY  62           HN       GLY  62  -1.704   0.370  -0.299
  446    HA2  GLY  62           HA2      GLY  62   1.064   0.380   0.669
  447    HA3  GLY  62           HA1      GLY  62   0.578  -0.881  -0.453
  448    H    GLY  63           HN       GLY  63   1.005   2.612  -0.077
  449    HA2  GLY  63           HA2      GLY  63   0.604   3.301  -2.782
  450    HA3  GLY  63           HA1      GLY  63   1.573   4.216  -1.630
  451    H    ALA  64           HN       ALA  64   3.261   1.940  -1.049
  452    HA   ALA  64           HA       ALA  64   4.551   1.143  -3.507
  453    HB1  ALA  64           HB1      ALA  64   6.747   2.030  -2.873
  454    HB2  ALA  64           HB2      ALA  64   6.037   2.804  -1.456
  455    HB3  ALA  64           HB3      ALA  64   5.583   3.338  -3.074
  456    H    GLY  65           HN       GLY  65   5.569  -0.831  -3.214
  457    HA2  GLY  65           HA2      GLY  65   6.479  -1.737  -0.684
  458    HA3  GLY  65           HA1      GLY  65   4.867  -2.360  -0.996
  459    H    GLY  66           HN       GLY  66   8.194  -2.705  -1.597
  460    HA2  GLY  66           HA2      GLY  66   7.713  -4.675  -3.733
  461    HA3  GLY  66           HA1      GLY  66   9.282  -4.006  -3.288
  462    H    GLN  67           HN       GLN  67   9.015  -4.279  -0.503
  463    HA   GLN  67           HA       GLN  67   9.446  -5.705   1.206
  464    HB2  GLN  67           HB2      GLN  67   7.079  -6.442   0.480
  465    HB3  GLN  67           HB1      GLN  67   7.888  -7.841  -0.270
  466    HG2  GLN  67           HG2      GLN  67   8.756  -8.512   1.888
  467    HG3  GLN  67           HG1      GLN  67   8.052  -7.089   2.653
  468   HE21  GLN  67          HE21      GLN  67   7.601  -9.890   3.236
  469   HE22  GLN  67          HE22      GLN  67   5.895 -10.154   3.037
  470    H    GLY  68           HN       GLY  68  10.987  -5.776  -1.463
  471    HA2  GLY  68           HA2      GLY  68  12.741  -7.952  -0.654
  472    HA3  GLY  68           HA1      GLY  68  12.033  -8.090  -2.253
  473    H    MET  69           HN       MET  69  14.124  -6.156  -0.208
  474    HA   MET  69           HA       MET  69  15.730  -5.508  -2.541
  475    HB2  MET  69           HB2      MET  69  14.177  -3.567  -2.279
  476    HB3  MET  69           HB1      MET  69  14.808  -3.317  -0.657
  477    HG2  MET  69           HG2      MET  69  17.031  -2.899  -1.570
  478    HG3  MET  69           HG1      MET  69  16.417  -3.169  -3.202
  479    HE1  MET  69           HE1      MET  69  17.427  -0.793  -3.951
  480    HE2  MET  69           HE2      MET  69  18.042  -0.571  -2.314
  481    HE3  MET  69           HE3      MET  69  17.099   0.705  -3.085
  482    H    ILE  70           HN       ILE  70  16.864  -7.181  -1.380
  483    HA   ILE  70           HA       ILE  70  19.152  -6.633  -0.156
  484    HB   ILE  70           HB       ILE  70  17.652  -5.483   1.724
  485   HG12  ILE  70          HG12      ILE  70  19.727  -7.529   2.592
  486   HG13  ILE  70          HG11      ILE  70  20.129  -5.975   1.866
  487   HG21  ILE  70          HG21      ILE  70  17.027  -7.066   3.560
  488   HG22  ILE  70          HG22      ILE  70  17.360  -8.415   2.478
  489   HG23  ILE  70          HG23      ILE  70  16.055  -7.288   2.105
  490   HD11  ILE  70          HD11      ILE  70  19.011  -4.852   3.755
  491   HD12  ILE  70          HD12      ILE  70  20.362  -5.865   4.262
  492   HD13  ILE  70          HD13      ILE  70  18.704  -6.428   4.482
  493    H    GLN  71           HN       GLN  71  17.074  -8.605  -1.340
  494    HA   GLN  71           HA       GLN  71  17.888 -11.044   0.094
  495    HB2  GLN  71           HB2      GLN  71  15.412 -10.576  -0.164
  496    HB3  GLN  71           HB1      GLN  71  15.632 -10.707  -1.904
  497    HG2  GLN  71           HG2      GLN  71  16.358 -13.029  -1.626
  498    HG3  GLN  71           HG1      GLN  71  16.130 -12.884   0.117
  499   HE21  GLN  71          HE21      GLN  71  13.754 -11.219  -0.207
  500   HE22  GLN  71          HE22      GLN  71  12.479 -12.285  -0.680
  501    H    GLU  72           HN       GLU  72  19.382  -9.369  -1.778
  502    HA   GLU  72           HA       GLU  72  19.458 -10.840  -4.291
  503    HB2  GLU  72           HB2      GLU  72  21.325  -8.584  -3.660
  504    HB3  GLU  72           HB1      GLU  72  20.650  -9.052  -5.207
  505    HG2  GLU  72           HG2      GLU  72  19.429  -7.401  -3.035
  506    HG3  GLU  72           HG1      GLU  72  19.640  -7.023  -4.735
  507    HA   PRO  73           HA       PRO  73  23.059 -13.124  -3.055
  508    HB2  PRO  73           HB2      PRO  73  24.288 -13.634  -5.383
  509    HB3  PRO  73           HB1      PRO  73  22.615 -14.259  -5.096
  510    HG2  PRO  73           HG2      PRO  73  23.499 -11.753  -6.511
  511    HG3  PRO  73           HG1      PRO  73  22.404 -13.024  -7.107
  512    HD2  PRO  73           HD2      PRO  73  21.471 -10.735  -5.997
  513    HD3  PRO  73           HD1      PRO  73  20.637 -12.308  -5.765
  514    H    ALA  74           HN       ALA  74  25.271 -12.932  -2.675
  515    HA   ALA  74           HA       ALA  74  26.860 -10.774  -3.649
  516    HB1  ALA  74           HB1      ALA  74  25.867 -10.543  -0.811
  517    HB2  ALA  74           HB2      ALA  74  25.359  -9.520  -2.155
  518    HB3  ALA  74           HB3      ALA  74  27.035  -9.486  -1.603
  519    H    LEU  75           HN       LEU  75  28.661 -10.497  -1.664
  520    HA   LEU  75           HA       LEU  75  30.169 -12.861  -1.779
  521    HB2  LEU  75           HB2      LEU  75  30.428 -10.486   0.055
  522    HB3  LEU  75           HB1      LEU  75  31.581 -11.796   0.015
  523    HG   LEU  75           HG       LEU  75  32.522 -10.034  -1.234
  524   HD11  LEU  75          HD11      LEU  75  31.323 -11.996  -3.186
  525   HD12  LEU  75          HD12      LEU  75  32.796 -12.234  -2.244
  526   HD13  LEU  75          HD13      LEU  75  32.732 -10.973  -3.475
  527   HD21  LEU  75          HD21      LEU  75  31.364  -8.962  -3.129
  528   HD22  LEU  75          HD22      LEU  75  30.566  -8.675  -1.583
  529   HD23  LEU  75          HD23      LEU  75  29.902  -9.856  -2.711
  530    HA   PRO  76           HA       PRO  76  28.102 -15.276   1.393
  531    HB2  PRO  76           HB2      PRO  76  30.755 -16.639   1.596
  532    HB3  PRO  76           HB1      PRO  76  29.171 -17.368   1.303
  533    HG2  PRO  76           HG2      PRO  76  30.924 -17.187  -0.673
  534    HG3  PRO  76           HG1      PRO  76  29.187 -16.780  -0.966
  535    HD2  PRO  76           HD2      PRO  76  31.522 -14.879  -0.497
  536    HD3  PRO  76           HD1      PRO  76  30.236 -14.804  -1.720
  537    HA   PRO  77           HA       PRO  77  29.266 -13.498   5.304
  538    HB2  PRO  77           HB2      PRO  77  28.725 -16.324   6.204
  539    HB3  PRO  77           HB1      PRO  77  28.224 -14.807   6.971
  540    HG2  PRO  77           HG2      PRO  77  26.458 -16.087   5.544
  541    HG3  PRO  77           HG1      PRO  77  26.673 -14.339   5.272
  542    HD2  PRO  77           HD2      PRO  77  27.695 -16.645   3.606
  543    HD3  PRO  77           HD1      PRO  77  26.958 -15.085   3.078
  544    H    GLY  78           HN       GLY  78  31.284 -13.114   5.929
  545    HA2  GLY  78           HA2      GLY  78  33.366 -13.789   6.869
  546    HA3  GLY  78           HA1      GLY  78  33.147 -15.379   6.158
  547    H    TRP  79           HN       TRP  79  32.455 -14.199   3.484
  548    HA   TRP  79           HA       TRP  79  35.238 -13.750   2.655
  549    HB2  TRP  79           HB2      TRP  79  32.705 -14.264   1.070
  550    HB3  TRP  79           HB1      TRP  79  34.217 -13.799   0.305
  551    HD1  TRP  79           HD1      TRP  79  32.632 -16.737   2.216
  552    HE1  TRP  79           HE1      TRP  79  34.014 -18.851   1.744
  553    HE3  TRP  79           HE3      TRP  79  36.482 -14.614  -0.408
  554    HZ2  TRP  79           HZ2      TRP  79  36.448 -19.528   0.417
  555    HZ3  TRP  79           HZ3      TRP  79  38.290 -16.051  -1.236
  556    HH2  TRP  79           HH2      TRP  79  38.275 -18.452  -0.839
  557    H    GLU  80           HN       GLU  80  36.019 -11.708   2.254
  558    HA   GLU  80           HA       GLU  80  34.058  -9.630   1.557
  559    HB2  GLU  80           HB2      GLU  80  36.466  -9.424   3.365
  560    HB3  GLU  80           HB1      GLU  80  35.686  -8.008   2.662
  561    HG2  GLU  80           HG2      GLU  80  33.570  -8.703   3.742
  562    HG3  GLU  80           HG1      GLU  80  34.445 -10.029   4.518
  563    H    MET  81           HN       MET  81  34.809  -7.992   0.126
  564    HA   MET  81           HA       MET  81  37.185  -8.752  -1.399
  565    HB2  MET  81           HB2      MET  81  35.222  -9.603  -2.587
  566    HB3  MET  81           HB1      MET  81  34.501  -7.982  -2.566
  567    HG2  MET  81           HG2      MET  81  37.152  -8.504  -3.881
  568    HG3  MET  81           HG1      MET  81  35.635  -8.823  -4.716
  569    HE1  MET  81           HE1      MET  81  33.850  -6.955  -5.297
  570    HE2  MET  81           HE2      MET  81  34.032  -5.256  -4.862
  571    HE3  MET  81           HE3      MET  81  33.798  -6.464  -3.600
  572    H    LYS  82           HN       LYS  82  38.521  -7.039  -1.830
  573    HA   LYS  82           HA       LYS  82  37.455  -4.340  -1.615
  574    HB2  LYS  82           HB2      LYS  82  39.900  -5.041   0.013
  575    HB3  LYS  82           HB1      LYS  82  38.895  -3.610   0.129
  576    HG2  LYS  82           HG2      LYS  82  37.064  -4.989   1.035
  577    HG3  LYS  82           HG1      LYS  82  38.145  -6.410   0.973
  578    HD2  LYS  82           HD2      LYS  82  39.703  -5.225   2.492
  579    HD3  LYS  82           HD1      LYS  82  38.548  -3.897   2.612
  580    HE2  LYS  82           HE2      LYS  82  38.012  -6.764   3.400
  581    HE3  LYS  82           HE1      LYS  82  38.392  -5.452   4.515
  582    HZ1  LYS  82           HZ1      LYS  82  36.021  -5.572   2.730
  583    HZ2  LYS  82           HZ2      LYS  82  36.379  -4.316   3.809
  584    HZ3  LYS  82           HZ3      LYS  82  36.010  -5.863   4.401
  585    H    TYR  83           HN       TYR  83  39.134  -2.710  -2.347
  586    HA   TYR  83           HA       TYR  83  40.807  -3.960  -4.445
  587    HB2  TYR  83           HB2      TYR  83  39.405  -1.253  -4.422
  588    HB3  TYR  83           HB1      TYR  83  40.523  -1.787  -5.705
  589    HD1  TYR  83           HD1      TYR  83  39.757  -3.188  -7.460
  590    HD2  TYR  83           HD2      TYR  83  37.225  -2.437  -4.120
  591    HE1  TYR  83           HE1      TYR  83  37.852  -4.168  -8.681
  592    HE2  TYR  83           HE2      TYR  83  35.334  -3.426  -5.321
  593    HH   TYR  83           HH       TYR  83  34.642  -3.858  -7.636
  594    H    THR  84           HN       THR  84  42.870  -3.121  -4.817
  595    HA   THR  84           HA       THR  84  44.087  -1.681  -2.620
  596    HB   THR  84           HB       THR  84  46.204  -2.069  -3.698
  597    HG1  THR  84           HG1      THR  84  44.908  -3.180  -5.966
  598   HG21  THR  84          HG21      THR  84  44.398  -4.465  -4.037
  599   HG22  THR  84          HG22      THR  84  45.379  -4.051  -2.631
  600   HG23  THR  84          HG23      THR  84  46.158  -4.526  -4.139
  601    H    SER  85           HN       SER  85  45.794   0.086  -3.540
  602    HA   SER  85           HA       SER  85  44.190   2.270  -4.267
  603    HB2  SER  85           HB2      SER  85  47.150   2.208  -4.333
  604    HB3  SER  85           HB1      SER  85  46.120   3.591  -4.031
  605    HG   SER  85           HG       SER  85  47.192   2.264  -2.189
  606    H    GLU  86           HN       GLU  86  45.575  -0.037  -6.304
  607    HA   GLU  86           HA       GLU  86  45.678   1.909  -8.552
  608    HB2  GLU  86           HB2      GLU  86  47.220  -0.673  -8.162
  609    HB3  GLU  86           HB1      GLU  86  47.274   0.305  -9.622
  610    HG2  GLU  86           HG2      GLU  86  48.271   2.127  -8.438
  611    HG3  GLU  86           HG1      GLU  86  48.055   1.302  -6.895
  612    H    GLY  87           HN       GLY  87  43.616  -0.182  -7.291
  613    HA2  GLY  87           HA2      GLY  87  41.663  -0.865  -8.443
  614    HA3  GLY  87           HA1      GLY  87  42.589  -0.904  -9.934
  615    H    VAL  88           HN       VAL  88  44.658  -2.422  -8.109
  616    HA   VAL  88           HA       VAL  88  43.982  -5.033  -9.000
  617    HB   VAL  88           HB       VAL  88  45.959  -4.195  -6.860
  618   HG11  VAL  88          HG11      VAL  88  45.658  -6.850  -8.269
  619   HG12  VAL  88          HG12      VAL  88  45.287  -6.529  -6.576
  620   HG13  VAL  88          HG13      VAL  88  46.951  -6.419  -7.150
  621   HG21  VAL  88          HG21      VAL  88  46.314  -4.846  -9.781
  622   HG22  VAL  88          HG22      VAL  88  47.640  -4.633  -8.639
  623   HG23  VAL  88          HG23      VAL  88  46.567  -3.284  -9.007
  624    H    ARG  89           HN       ARG  89  42.857  -6.647  -7.984
  625    HA   ARG  89           HA       ARG  89  41.488  -5.813  -5.517
  626    HB2  ARG  89           HB2      ARG  89  39.968  -6.128  -7.334
  627    HB3  ARG  89           HB1      ARG  89  40.639  -7.675  -7.742
  628    HG2  ARG  89           HG2      ARG  89  39.806  -8.563  -5.627
  629    HG3  ARG  89           HG1      ARG  89  38.992  -7.008  -5.367
  630    HD2  ARG  89           HD2      ARG  89  38.168  -9.191  -6.968
  631    HD3  ARG  89           HD1      ARG  89  37.375  -7.661  -6.688
  632    HE   ARG  89           HE       ARG  89  39.413  -7.785  -8.752
  633   HH11  ARG  89          HH11      ARG  89  36.036  -7.534  -7.884
  634   HH12  ARG  89          HH12      ARG  89  35.546  -6.922  -9.432
  635   HH21  ARG  89          HH21      ARG  89  38.786  -6.976 -10.786
  636   HH22  ARG  89          HH22      ARG  89  37.107  -6.651 -11.109
  637    H    TYR  90           HN       TYR  90  41.354  -7.130  -3.752
  638    HA   TYR  90           HA       TYR  90  42.560  -9.790  -3.918
  639    HB2  TYR  90           HB2      TYR  90  43.799  -9.464  -1.847
  640    HB3  TYR  90           HB1      TYR  90  44.288  -8.258  -3.018
  641    HD1  TYR  90           HD1      TYR  90  42.874  -8.842   0.259
  642    HD2  TYR  90           HD2      TYR  90  43.507  -5.905  -2.753
  643    HE1  TYR  90           HE1      TYR  90  42.388  -7.066   1.893
  644    HE2  TYR  90           HE2      TYR  90  43.028  -4.126  -1.128
  645    HH   TYR  90           HH       TYR  90  41.765  -3.882   1.025
  646    H    PHE  91           HN       PHE  91  41.803 -11.237  -2.125
  647    HA   PHE  91           HA       PHE  91  39.210 -10.293  -1.119
  648    HB2  PHE  91           HB2      PHE  91  40.115 -13.091  -1.739
  649    HB3  PHE  91           HB1      PHE  91  38.682 -12.743  -0.806
  650    HD1  PHE  91           HD1      PHE  91  36.802 -11.339  -1.945
  651    HD2  PHE  91           HD2      PHE  91  40.002 -13.198  -4.094
  652    HE1  PHE  91           HE1      PHE  91  35.533 -11.130  -4.023
  653    HE2  PHE  91           HE2      PHE  91  38.702 -12.990  -6.166
  654    HZ   PHE  91           HZ       PHE  91  36.351 -12.074  -6.063
  655    H    VAL  92           HN       VAL  92  38.602 -10.968   1.002
  656    HA   VAL  92           HA       VAL  92  40.941 -11.455   2.732
  657    HB   VAL  92           HB       VAL  92  38.421  -9.950   3.469
  658   HG11  VAL  92          HG11      VAL  92  39.441 -11.075   5.367
  659   HG12  VAL  92          HG12      VAL  92  39.652  -9.328   5.491
  660   HG13  VAL  92          HG13      VAL  92  41.002 -10.344   4.983
  661   HG21  VAL  92          HG21      VAL  92  39.808  -7.940   3.470
  662   HG22  VAL  92          HG22      VAL  92  39.755  -8.681   1.871
  663   HG23  VAL  92          HG23      VAL  92  41.178  -8.884   2.889
  664    H    ASP  93           HN       ASP  93  40.825 -13.610   3.106
  665    HA   ASP  93           HA       ASP  93  38.342 -15.016   3.594
  666    HB2  ASP  93           HB2      ASP  93  41.252 -15.773   4.123
  667    HB3  ASP  93           HB1      ASP  93  39.885 -16.848   4.404
  668    H    HIS  94           HN       HIS  94  37.361 -13.763   5.288
  669    HA   HIS  94           HA       HIS  94  38.804 -13.048   7.639
  670    HB2  HIS  94           HB2      HIS  94  36.755 -11.879   6.682
  671    HB3  HIS  94           HB1      HIS  94  35.797 -13.176   7.387
  672    HD1  HIS  94           HD1      HIS  94  35.033 -12.801   9.714
  673    HD2  HIS  94           HD2      HIS  94  38.309 -10.433   8.720
  674    HE1  HIS  94           HE1      HIS  94  35.417 -11.295  11.700
  675    HE2  HIS  94           HE2      HIS  94  37.304  -9.775  11.012
  676    H    ASN  95           HN       ASN  95  37.348 -15.969   6.681
  677    HA   ASN  95           HA       ASN  95  36.807 -16.876   9.357
  678    HB2  ASN  95           HB2      ASN  95  36.360 -19.086   8.219
  679    HB3  ASN  95           HB1      ASN  95  35.354 -17.749   7.679
  680   HD21  ASN  95          HD21      ASN  95  38.708 -18.401   6.676
  681   HD22  ASN  95          HD22      ASN  95  38.314 -18.724   5.020
  682    H    THR  96           HN       THR  96  39.548 -16.811   7.316
  683    HA   THR  96           HA       THR  96  40.924 -18.627   9.176
  684    HB   THR  96           HB       THR  96  42.601 -18.801   7.187
  685    HG1  THR  96           HG1      THR  96  41.528 -18.556   5.165
  686   HG21  THR  96          HG21      THR  96  41.324 -20.702   6.253
  687   HG22  THR  96          HG22      THR  96  39.891 -20.148   7.123
  688   HG23  THR  96          HG23      THR  96  41.309 -20.698   8.016
  689    H    ARG  97           HN       ARG  97  40.522 -15.497   8.315
  690    HA   ARG  97           HA       ARG  97  41.597 -13.536   8.754
  691    HB2  ARG  97           HB2      ARG  97  43.104 -15.303  10.676
  692    HB3  ARG  97           HB1      ARG  97  43.229 -13.543  10.640
  693    HG2  ARG  97           HG2      ARG  97  40.847 -13.370  11.031
  694    HG3  ARG  97           HG1      ARG  97  40.718 -15.129  11.105
  695    HD2  ARG  97           HD2      ARG  97  42.269 -13.342  12.984
  696    HD3  ARG  97           HD1      ARG  97  40.816 -14.270  13.362
  697    HE   ARG  97           HE       ARG  97  43.101 -15.816  12.439
  698   HH11  ARG  97          HH11      ARG  97  41.266 -14.631  15.198
  699   HH12  ARG  97          HH12      ARG  97  41.958 -15.793  16.295
  700   HH21  ARG  97          HH21      ARG  97  44.009 -17.313  13.878
  701   HH22  ARG  97          HH22      ARG  97  43.539 -17.297  15.556
  702    H    THR  98           HN       THR  98  42.275 -13.928   6.549
  703    HA   THR  98           HA       THR  98  45.117 -13.473   6.249
  704    HB   THR  98           HB       THR  98  45.005 -15.982   6.355
  705    HG1  THR  98           HG1      THR  98  45.896 -16.126   3.987
  706   HG21  THR  98          HG21      THR  98  42.766 -16.277   5.350
  707   HG22  THR  98          HG22      THR  98  43.983 -17.216   4.484
  708   HG23  THR  98          HG23      THR  98  43.386 -15.702   3.804
  709    H    THR  99           HN       THR  99  45.633 -13.274   3.827
  710    HA   THR  99           HA       THR  99  43.296 -12.129   2.413
  711    HB   THR  99           HB       THR  99  45.065 -10.510   1.394
  712    HG1  THR  99           HG1      THR  99  46.924 -11.512   2.225
  713   HG21  THR  99          HG21      THR  99  43.320  -9.701   2.949
  714   HG22  THR  99          HG22      THR  99  44.864  -8.945   3.351
  715   HG23  THR  99          HG23      THR  99  44.262 -10.284   4.326
  716    H    THR 100           HN       THR 100  42.962 -13.757   0.859
  717    HA   THR 100           HA       THR 100  45.251 -14.830  -0.577
  718    HB   THR 100           HB       THR 100  43.079 -16.149   0.139
  719    HG1  THR 100           HG1      THR 100  43.445 -17.505  -1.725
  720   HG21  THR 100          HG21      THR 100  41.523 -16.316  -1.862
  721   HG22  THR 100          HG22      THR 100  42.250 -14.807  -2.457
  722   HG23  THR 100          HG23      THR 100  41.383 -14.839  -0.911
  723    H    PHE 101           HN       PHE 101  45.264 -14.790  -2.972
  724    HA   PHE 101           HA       PHE 101  44.341 -12.214  -3.894
  725    HB2  PHE 101           HB2      PHE 101  46.432 -14.055  -4.724
  726    HB3  PHE 101           HB1      PHE 101  45.463 -13.403  -6.119
  727    HD1  PHE 101           HD1      PHE 101  44.906 -10.759  -5.738
  728    HD2  PHE 101           HD2      PHE 101  48.266 -12.860  -4.186
  729    HE1  PHE 101           HE1      PHE 101  46.165  -8.647  -5.591
  730    HE2  PHE 101           HE2      PHE 101  49.532 -10.762  -4.037
  731    HZ   PHE 101           HZ       PHE 101  48.362  -8.581  -4.692
  732    H    LYS 102           HN       LYS 102  42.953 -11.837  -5.421
  733    HA   LYS 102           HA       LYS 102  40.625 -13.172  -5.424
  734    HB2  LYS 102           HB2      LYS 102  40.122 -11.819  -7.587
  735    HB3  LYS 102           HB1      LYS 102  40.392 -10.994  -6.065
  736    HG2  LYS 102           HG2      LYS 102  41.473  -9.872  -7.949
  737    HG3  LYS 102           HG1      LYS 102  42.637 -10.388  -6.739
  738    HD2  LYS 102           HD2      LYS 102  43.555 -10.833  -8.899
  739    HD3  LYS 102           HD1      LYS 102  43.131 -12.375  -8.157
  740    HE2  LYS 102           HE2      LYS 102  41.040 -12.397  -9.459
  741    HE3  LYS 102           HE1      LYS 102  41.529 -10.893 -10.240
  742    HZ1  LYS 102           HZ1      LYS 102  42.011 -13.005 -11.500
  743    HZ2  LYS 102           HZ2      LYS 102  43.190 -13.340 -10.332
  744    HZ3  LYS 102           HZ3      LYS 102  43.326 -11.958 -11.298
  745    H    ASP 103           HN       ASP 103  39.582 -14.649  -6.427
  746    HA   ASP 103           HA       ASP 103  40.528 -15.608  -9.023
  747    HB2  ASP 103           HB2      ASP 103  40.797 -17.354  -7.228
  748    HB3  ASP 103           HB1      ASP 103  39.058 -17.267  -6.952
  749    HA   PRO 104           HA       PRO 104  36.596 -14.118 -10.495
  750    HB2  PRO 104           HB2      PRO 104  36.036 -16.140 -12.343
  751    HB3  PRO 104           HB1      PRO 104  37.024 -14.715 -12.685
  752    HG2  PRO 104           HG2      PRO 104  37.872 -17.480 -11.938
  753    HG3  PRO 104           HG1      PRO 104  38.600 -16.352 -13.098
  754    HD2  PRO 104           HD2      PRO 104  39.694 -16.739 -10.697
  755    HD3  PRO 104           HD1      PRO 104  39.653 -15.119 -11.429
  756    H    ARG 105           HN       ARG 105  36.933 -17.446  -9.376
  757    HA   ARG 105           HA       ARG 105  34.033 -17.494  -8.828
  758    HB2  ARG 105           HB2      ARG 105  35.891 -19.868  -9.002
  759    HB3  ARG 105           HB1      ARG 105  34.147 -19.909  -8.799
  760    HG2  ARG 105           HG2      ARG 105  35.679 -19.015 -11.227
  761    HG3  ARG 105           HG1      ARG 105  34.634 -20.429 -11.074
  762    HD2  ARG 105           HD2      ARG 105  33.760 -17.542 -10.913
  763    HD3  ARG 105           HD1      ARG 105  33.522 -18.617 -12.287
  764    HE   ARG 105           HE       ARG 105  32.239 -19.984 -10.429
  765   HH11  ARG 105          HH11      ARG 105  32.229 -16.526 -10.988
  766   HH12  ARG 105          HH12      ARG 105  30.598 -16.310 -10.431
  767   HH21  ARG 105          HH21      ARG 105  30.121 -19.714  -9.677
  768   HH22  ARG 105          HH22      ARG 105  29.385 -18.138  -9.675
  769    HA   PRO 106           HA       PRO 106  35.508 -16.814  -4.547
  770    HB2  PRO 106           HB2      PRO 106  32.636 -17.516  -4.094
  771    HB3  PRO 106           HB1      PRO 106  33.627 -16.179  -3.393
  772    HG2  PRO 106           HG2      PRO 106  31.857 -15.711  -5.345
  773    HG3  PRO 106           HG1      PRO 106  33.413 -14.869  -5.289
  774    HD2  PRO 106           HD2      PRO 106  32.506 -17.068  -7.084
  775    HD3  PRO 106           HD1      PRO 106  33.645 -15.716  -7.401
  776    H    GLY 107           HN       GLY 107  36.557 -18.392  -3.513
  777    HA2  GLY 107           HA2      GLY 107  36.721 -20.302  -2.167
  778    HA3  GLY 107           HA1      GLY 107  35.164 -20.876  -2.806
  779    H    PHE 108           HN       PHE 108  35.905 -20.480  -5.599
  780    HA   PHE 108           HA       PHE 108  36.492 -21.969  -7.284
  781    HB2  PHE 108           HB2      PHE 108  38.956 -21.890  -7.695
  782    HB3  PHE 108           HB1      PHE 108  38.222 -20.284  -7.370
  783    HD1  PHE 108           HD1      PHE 108  40.464 -22.912  -6.128
  784    HD2  PHE 108           HD2      PHE 108  38.825 -19.053  -5.358
  785    HE1  PHE 108           HE1      PHE 108  42.165 -22.535  -4.394
  786    HE2  PHE 108           HE2      PHE 108  40.530 -18.675  -3.630
  787    HZ   PHE 108           HZ       PHE 108  42.202 -20.415  -3.138
  788    H    GLU 109           HN       GLU 109  35.853 -23.517  -4.891
  789    HA   GLU 109           HA       GLU 109  37.072 -25.942  -5.822
  790    HB2  GLU 109           HB2      GLU 109  38.780 -25.193  -4.226
  791    HB3  GLU 109           HB1      GLU 109  37.572 -24.994  -2.975
  792    HG2  GLU 109           HG2      GLU 109  37.182 -27.489  -3.096
  793    HG3  GLU 109           HG1      GLU 109  38.597 -27.581  -4.147
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1 -43.015   3.240  -3.028
    2    H2   GLY   1           HT2      GLY   1 -42.569   2.323  -4.386
    3    H3   GLY   1           HT3      GLY   1 -42.458   4.017  -4.426
    4    HA2  GLY   1           HA1      GLY   1 -40.869   2.274  -2.633
    5    HA3  GLY   1           HA2      GLY   1 -40.283   2.954  -4.148
    6    H    SER   2           HN       SER   2 -40.374   3.403  -0.855
    7    HA   SER   2           HA       SER   2 -40.134   6.330  -1.084
    8    HB2  SER   2           HB2      SER   2 -40.563   4.626   1.384
    9    HB3  SER   2           HB1      SER   2 -40.584   6.391   1.321
   10    HG   SER   2           HG       SER   2 -42.513   6.358   0.412
   11    H    HIS   3           HN       HIS   3 -38.131   4.072  -1.592
   12    HA   HIS   3           HA       HIS   3 -36.033   5.068   0.214
   13    HB2  HIS   3           HB2      HIS   3 -36.415   2.311  -0.961
   14    HB3  HIS   3           HB1      HIS   3 -34.896   2.839  -0.259
   15    HD1  HIS   3           HD1      HIS   3 -36.850   0.506   0.783
   16    HD2  HIS   3           HD2      HIS   3 -36.342   4.305   2.403
   17    HE1  HIS   3           HE1      HIS   3 -37.482   0.300   3.215
   18    HE2  HIS   3           HE2      HIS   3 -36.916   2.552   4.212
   19    H    MET   4           HN       MET   4 -33.829   5.003  -0.724
   20    HA   MET   4           HA       MET   4 -33.871   5.469  -3.630
   21    HB2  MET   4           HB2      MET   4 -31.875   6.551  -1.620
   22    HB3  MET   4           HB1      MET   4 -31.946   6.946  -3.327
   23    HG2  MET   4           HG2      MET   4 -34.131   7.988  -3.001
   24    HG3  MET   4           HG1      MET   4 -34.037   7.618  -1.280
   25    HE1  MET   4           HE1      MET   4 -32.479   9.656  -4.248
   26    HE2  MET   4           HE2      MET   4 -31.107   8.729  -3.637
   27    HE3  MET   4           HE3      MET   4 -31.139  10.481  -3.447
   28    H    GLN   5           HN       GLN   5 -32.407   4.340  -4.882
   29    HA   GLN   5           HA       GLN   5 -31.344   1.961  -3.676
   30    HB2  GLN   5           HB2      GLN   5 -32.431   1.856  -5.860
   31    HB3  GLN   5           HB1      GLN   5 -31.238   2.962  -6.525
   32    HG2  GLN   5           HG2      GLN   5 -29.481   1.305  -6.133
   33    HG3  GLN   5           HG1      GLN   5 -30.682   0.188  -5.488
   34   HE21  GLN   5          HE21      GLN   5 -32.116  -0.830  -6.887
   35   HE22  GLN   5          HE22      GLN   5 -31.880  -0.826  -8.624
   36    H    TYR   6           HN       TYR   6 -29.414   1.819  -2.802
   37    HA   TYR   6           HA       TYR   6 -27.222   3.466  -3.876
   38    HB2  TYR   6           HB2      TYR   6 -27.851   2.719  -1.005
   39    HB3  TYR   6           HB1      TYR   6 -26.207   3.124  -1.470
   40    HD1  TYR   6           HD1      TYR   6 -25.585   5.409  -1.920
   41    HD2  TYR   6           HD2      TYR   6 -29.644   4.415  -1.085
   42    HE1  TYR   6           HE1      TYR   6 -26.111   7.792  -1.631
   43    HE2  TYR   6           HE2      TYR   6 -30.174   6.793  -0.795
   44    HH   TYR   6           HH       TYR   6 -29.138   8.858  -0.340
   45    H    LYS   7           HN       LYS   7 -25.285   2.382  -4.304
   46    HA   LYS   7           HA       LYS   7 -25.293  -0.502  -3.748
   47    HB2  LYS   7           HB2      LYS   7 -23.942  -0.753  -5.923
   48    HB3  LYS   7           HB1      LYS   7 -25.692  -0.483  -6.070
   49    HG2  LYS   7           HG2      LYS   7 -25.383   1.733  -6.767
   50    HG3  LYS   7           HG1      LYS   7 -23.695   1.748  -6.262
   51    HD2  LYS   7           HD2      LYS   7 -23.961   1.535  -8.720
   52    HD3  LYS   7           HD1      LYS   7 -23.117   0.163  -7.997
   53    HE2  LYS   7           HE2      LYS   7 -25.259  -1.091  -7.997
   54    HE3  LYS   7           HE1      LYS   7 -26.016   0.268  -8.828
   55    HZ1  LYS   7           HZ1      LYS   7 -23.706  -1.278  -9.887
   56    HZ2  LYS   7           HZ2      LYS   7 -24.573  -0.064 -10.700
   57    HZ3  LYS   7           HZ3      LYS   7 -25.320  -1.542 -10.329
   58    H    LEU   8           HN       LEU   8 -23.251  -1.530  -3.686
   59    HA   LEU   8           HA       LEU   8 -20.956   0.222  -3.098
   60    HB2  LEU   8           HB2      LEU   8 -22.038  -0.303  -0.912
   61    HB3  LEU   8           HB1      LEU   8 -21.978  -1.997  -1.315
   62    HG   LEU   8           HG       LEU   8 -19.415  -1.664  -1.447
   63   HD11  LEU   8          HD11      LEU   8 -20.231   0.719   0.208
   64   HD12  LEU   8          HD12      LEU   8 -19.336   0.736  -1.311
   65   HD13  LEU   8          HD13      LEU   8 -18.601   0.048   0.135
   66   HD21  LEU   8          HD21      LEU   8 -21.063  -1.727   1.042
   67   HD22  LEU   8          HD22      LEU   8 -19.319  -1.987   1.041
   68   HD23  LEU   8          HD23      LEU   8 -20.378  -3.081   0.147
   69    H    ILE   9           HN       ILE   9 -19.047  -0.591  -3.751
   70    HA   ILE   9           HA       ILE   9 -19.010  -3.361  -4.771
   71    HB   ILE   9           HB       ILE   9 -17.293  -1.047  -5.723
   72   HG12  ILE   9          HG12      ILE   9 -19.493  -2.343  -7.374
   73   HG13  ILE   9          HG11      ILE   9 -19.788  -0.930  -6.311
   74   HG21  ILE   9          HG21      ILE   9 -16.742  -2.561  -7.582
   75   HG22  ILE   9          HG22      ILE   9 -17.630  -3.841  -6.763
   76   HG23  ILE   9          HG23      ILE   9 -16.188  -3.147  -6.014
   77   HD11  ILE   9          HD11      ILE   9 -18.183   0.386  -7.570
   78   HD12  ILE   9          HD12      ILE   9 -19.394  -0.290  -8.660
   79   HD13  ILE   9          HD13      ILE   9 -17.784  -1.009  -8.573
   80    H    LEU  10           HN       LEU  10 -17.668  -4.687  -3.730
   81    HA   LEU  10           HA       LEU  10 -15.748  -3.497  -1.880
   82    HB2  LEU  10           HB2      LEU  10 -16.522  -6.400  -2.129
   83    HB3  LEU  10           HB1      LEU  10 -15.436  -5.729  -0.939
   84    HG   LEU  10           HG       LEU  10 -17.322  -6.041   0.292
   85   HD11  LEU  10          HD11      LEU  10 -16.583  -3.718   0.451
   86   HD12  LEU  10          HD12      LEU  10 -18.274  -3.979   0.879
   87   HD13  LEU  10          HD13      LEU  10 -17.861  -3.283  -0.690
   88   HD21  LEU  10          HD21      LEU  10 -19.594  -5.771  -0.409
   89   HD22  LEU  10          HD22      LEU  10 -18.742  -6.741  -1.611
   90   HD23  LEU  10          HD23      LEU  10 -19.082  -5.039  -1.928
   91    H    ASN  11           HN       ASN  11 -13.890  -3.033  -2.826
   92    HA   ASN  11           HA       ASN  11 -12.845  -5.009  -4.725
   93    HB2  ASN  11           HB2      ASN  11 -11.516  -2.351  -4.262
   94    HB3  ASN  11           HB1      ASN  11 -11.584  -3.306  -5.735
   95   HD21  ASN  11          HD21      ASN  11 -13.172  -0.970  -3.768
   96   HD22  ASN  11          HD22      ASN  11 -14.364  -0.504  -4.927
   97    H    GLY  12           HN       GLY  12 -12.284  -6.465  -3.073
   98    HA2  GLY  12           HA2      GLY  12  -9.684  -5.839  -1.900
   99    HA3  GLY  12           HA1      GLY  12 -10.973  -6.325  -0.785
  100    H    LYS  13           HN       LYS  13  -8.374  -7.551  -1.773
  101    HA   LYS  13           HA       LYS  13  -8.591  -9.765  -3.316
  102    HB2  LYS  13           HB2      LYS  13  -7.053  -9.514  -0.724
  103    HB3  LYS  13           HB1      LYS  13  -6.752 -10.722  -1.966
  104    HG2  LYS  13           HG2      LYS  13  -6.622  -7.802  -2.575
  105    HG3  LYS  13           HG1      LYS  13  -5.248  -8.656  -1.893
  106    HD2  LYS  13           HD2      LYS  13  -6.674  -9.455  -4.425
  107    HD3  LYS  13           HD1      LYS  13  -5.202  -8.481  -4.369
  108    HE2  LYS  13           HE2      LYS  13  -5.473 -11.216  -3.180
  109    HE3  LYS  13           HE1      LYS  13  -4.793 -10.900  -4.777
  110    HZ1  LYS  13           HZ1      LYS  13  -3.010 -11.095  -3.234
  111    HZ2  LYS  13           HZ2      LYS  13  -3.723 -10.012  -2.150
  112    HZ3  LYS  13           HZ3      LYS  13  -3.136  -9.453  -3.639
  113    H    THR  14           HN       THR  14  -9.817  -9.393  -0.073
  114    HA   THR  14           HA       THR  14 -10.235 -12.229   0.354
  115    HB   THR  14           HB       THR  14 -11.538 -11.314   2.374
  116    HG1  THR  14           HG1      THR  14 -10.855  -9.081   2.839
  117   HG21  THR  14          HG21      THR  14  -9.468 -10.800   3.596
  118   HG22  THR  14          HG22      THR  14  -8.609 -10.631   2.063
  119   HG23  THR  14          HG23      THR  14  -9.261 -12.197   2.540
  120    H    LEU  15           HN       LEU  15 -12.145  -9.476  -0.725
  121    HA   LEU  15           HA       LEU  15 -14.321 -11.230  -1.461
  122    HB2  LEU  15           HB2      LEU  15 -14.373  -9.180   0.671
  123    HB3  LEU  15           HB1      LEU  15 -15.767  -9.291  -0.362
  124    HG   LEU  15           HG       LEU  15 -14.683 -11.754   0.934
  125   HD11  LEU  15          HD11      LEU  15 -16.035 -11.325   2.891
  126   HD12  LEU  15          HD12      LEU  15 -16.498  -9.751   2.238
  127   HD13  LEU  15          HD13      LEU  15 -14.820 -10.063   2.671
  128   HD21  LEU  15          HD21      LEU  15 -16.482 -11.896  -0.757
  129   HD22  LEU  15          HD22      LEU  15 -17.494 -10.882   0.273
  130   HD23  LEU  15          HD23      LEU  15 -16.983 -12.473   0.831
  131    H    LYS  16           HN       LYS  16 -14.556 -10.704  -3.567
  132    HA   LYS  16           HA       LYS  16 -14.592  -7.844  -4.262
  133    HB2  LYS  16           HB2      LYS  16 -13.648 -10.168  -5.957
  134    HB3  LYS  16           HB1      LYS  16 -13.732  -8.498  -6.496
  135    HG2  LYS  16           HG2      LYS  16 -11.802  -7.968  -5.510
  136    HG3  LYS  16           HG1      LYS  16 -12.173  -8.865  -4.033
  137    HD2  LYS  16           HD2      LYS  16 -10.918  -9.795  -6.581
  138    HD3  LYS  16           HD1      LYS  16 -10.338  -9.950  -4.920
  139    HE2  LYS  16           HE2      LYS  16 -11.978 -11.605  -4.415
  140    HE3  LYS  16           HE1      LYS  16 -12.789 -11.356  -5.960
  141    HZ1  LYS  16           HZ1      LYS  16 -11.400 -13.361  -5.923
  142    HZ2  LYS  16           HZ2      LYS  16 -10.027 -12.406  -5.636
  143    HZ3  LYS  16           HZ3      LYS  16 -10.879 -12.250  -7.090
  144    H    GLY  17           HN       GLY  17 -16.556  -7.236  -4.735
  145    HA2  GLY  17           HA2      GLY  17 -18.242  -8.327  -6.632
  146    HA3  GLY  17           HA1      GLY  17 -18.760  -8.986  -5.082
  147    H    GLU  18           HN       GLU  18 -20.739  -7.657  -5.847
  148    HA   GLU  18           HA       GLU  18 -20.644  -5.189  -4.347
  149    HB2  GLU  18           HB2      GLU  18 -21.893  -4.100  -6.443
  150    HB3  GLU  18           HB1      GLU  18 -20.158  -3.999  -6.216
  151    HG2  GLU  18           HG2      GLU  18 -20.599  -4.515  -8.494
  152    HG3  GLU  18           HG1      GLU  18 -19.891  -5.938  -7.741
  153    H    THR  19           HN       THR  19 -22.769  -4.225  -3.997
  154    HA   THR  19           HA       THR  19 -25.086  -5.837  -4.598
  155    HB   THR  19           HB       THR  19 -24.109  -7.077  -2.680
  156    HG1  THR  19           HG1      THR  19 -26.054  -7.124  -1.476
  157   HG21  THR  19          HG21      THR  19 -23.027  -5.204  -1.494
  158   HG22  THR  19          HG22      THR  19 -24.152  -6.043  -0.421
  159   HG23  THR  19          HG23      THR  19 -24.607  -4.502  -1.147
  160    H    THR  20           HN       THR  20 -26.990  -4.885  -3.030
  161    HA   THR  20           HA       THR  20 -26.725  -1.967  -3.011
  162    HB   THR  20           HB       THR  20 -29.003  -1.776  -4.000
  163    HG1  THR  20           HG1      THR  20 -29.364  -4.166  -3.489
  164   HG21  THR  20          HG21      THR  20 -27.084  -1.432  -5.477
  165   HG22  THR  20          HG22      THR  20 -28.355  -2.292  -6.348
  166   HG23  THR  20          HG23      THR  20 -26.948  -3.167  -5.743
  167    H    THR  21           HN       THR  21 -28.318  -0.853  -1.754
  168    HA   THR  21           HA       THR  21 -30.047  -2.435  -0.032
  169    HB   THR  21           HB       THR  21 -27.842  -2.166   1.255
  170    HG1  THR  21           HG1      THR  21 -29.831  -0.846   2.718
  171   HG21  THR  21          HG21      THR  21 -27.576   0.066   2.410
  172   HG22  THR  21          HG22      THR  21 -28.790   0.731   1.316
  173   HG23  THR  21          HG23      THR  21 -27.255   0.151   0.674
  174    H    GLU  22           HN       GLU  22 -31.649  -1.069   1.051
  175    HA   GLU  22           HA       GLU  22 -32.200   1.310  -0.580
  176    HB2  GLU  22           HB2      GLU  22 -34.004  -0.294   1.254
  177    HB3  GLU  22           HB1      GLU  22 -34.521   1.085   0.308
  178    HG2  GLU  22           HG2      GLU  22 -34.161  -0.151  -1.772
  179    HG3  GLU  22           HG1      GLU  22 -33.521  -1.542  -0.817
  180    H    ALA  23           HN       ALA  23 -31.891   3.287   0.264
  181    HA   ALA  23           HA       ALA  23 -32.389   3.687   3.144
  182    HB1  ALA  23           HB1      ALA  23 -29.980   3.328   2.988
  183    HB2  ALA  23           HB2      ALA  23 -30.314   5.019   3.365
  184    HB3  ALA  23           HB3      ALA  23 -29.850   4.556   1.729
  185    H    VAL  24           HN       VAL  24 -32.767   6.008   3.658
  186    HA   VAL  24           HA       VAL  24 -33.807   7.429   1.309
  187    HB   VAL  24           HB       VAL  24 -35.104   8.789   2.921
  188   HG11  VAL  24          HG11      VAL  24 -35.432   5.803   3.181
  189   HG12  VAL  24          HG12      VAL  24 -36.157   6.843   1.955
  190   HG13  VAL  24          HG13      VAL  24 -36.650   6.994   3.641
  191   HG21  VAL  24          HG21      VAL  24 -34.005   6.908   5.003
  192   HG22  VAL  24          HG22      VAL  24 -35.213   8.166   5.264
  193   HG23  VAL  24          HG23      VAL  24 -33.560   8.605   4.827
  194    H    ASP  25           HN       ASP  25 -30.972   7.395   2.710
  195    HA   ASP  25           HA       ASP  25 -30.426  10.178   2.245
  196    HB2  ASP  25           HB2      ASP  25 -31.059  10.499   4.501
  197    HB3  ASP  25           HB1      ASP  25 -30.284   9.013   5.018
  198    H    ALA  26           HN       ALA  26 -28.134  10.647   2.310
  199    HA   ALA  26           HA       ALA  26 -26.680   8.468   1.111
  200    HB1  ALA  26           HB1      ALA  26 -24.953  10.100   0.659
  201    HB2  ALA  26           HB2      ALA  26 -25.722  11.256   1.747
  202    HB3  ALA  26           HB3      ALA  26 -26.530  10.784   0.252
  203    H    ALA  27           HN       ALA  27 -26.523  10.295   4.139
  204    HA   ALA  27           HA       ALA  27 -24.025   9.138   4.958
  205    HB1  ALA  27           HB1      ALA  27 -24.730  11.336   5.774
  206    HB2  ALA  27           HB2      ALA  27 -24.444  10.214   7.104
  207    HB3  ALA  27           HB3      ALA  27 -26.094  10.590   6.605
  208    H    THR  28           HN       THR  28 -27.433   8.575   5.588
  209    HA   THR  28           HA       THR  28 -27.152   6.520   7.502
  210    HB   THR  28           HB       THR  28 -29.400   6.709   5.478
  211    HG1  THR  28           HG1      THR  28 -28.873   8.743   6.680
  212   HG21  THR  28          HG21      THR  28 -30.745   5.765   7.312
  213   HG22  THR  28          HG22      THR  28 -29.307   5.706   8.333
  214   HG23  THR  28          HG23      THR  28 -29.404   4.698   6.890
  215    H    ALA  29           HN       ALA  29 -26.836   6.529   4.036
  216    HA   ALA  29           HA       ALA  29 -27.109   3.676   3.712
  217    HB1  ALA  29           HB1      ALA  29 -25.936   5.719   1.819
  218    HB2  ALA  29           HB2      ALA  29 -27.638   5.264   1.885
  219    HB3  ALA  29           HB3      ALA  29 -26.426   4.074   1.415
  220    H    GLU  30           HN       GLU  30 -24.549   6.021   4.064
  221    HA   GLU  30           HA       GLU  30 -22.352   4.374   3.492
  222    HB2  GLU  30           HB2      GLU  30 -22.500   6.967   3.817
  223    HB3  GLU  30           HB1      GLU  30 -22.278   6.589   5.517
  224    HG2  GLU  30           HG2      GLU  30 -20.179   5.402   4.930
  225    HG3  GLU  30           HG1      GLU  30 -20.383   5.986   3.277
  226    H    LYS  31           HN       LYS  31 -23.673   5.426   6.601
  227    HA   LYS  31           HA       LYS  31 -22.122   4.077   8.350
  228    HB2  LYS  31           HB2      LYS  31 -25.056   4.666   8.591
  229    HB3  LYS  31           HB1      LYS  31 -24.046   4.126   9.925
  230    HG2  LYS  31           HG2      LYS  31 -23.873   6.711   8.393
  231    HG3  LYS  31           HG1      LYS  31 -24.209   6.475  10.109
  232    HD2  LYS  31           HD2      LYS  31 -21.916   5.547  10.368
  233    HD3  LYS  31           HD1      LYS  31 -21.603   5.963   8.682
  234    HE2  LYS  31           HE2      LYS  31 -20.707   7.720  10.016
  235    HE3  LYS  31           HE1      LYS  31 -22.178   8.335   9.263
  236    HZ1  LYS  31           HZ1      LYS  31 -23.370   8.018  11.313
  237    HZ2  LYS  31           HZ2      LYS  31 -21.967   8.917  11.637
  238    HZ3  LYS  31           HZ3      LYS  31 -22.027   7.271  12.034
  239    H    VAL  32           HN       VAL  32 -25.002   2.696   6.761
  240    HA   VAL  32           HA       VAL  32 -24.974   0.302   8.291
  241    HB   VAL  32           HB       VAL  32 -26.187   0.800   5.554
  242   HG11  VAL  32          HG11      VAL  32 -26.716  -1.410   7.549
  243   HG12  VAL  32          HG12      VAL  32 -25.881  -1.585   6.006
  244   HG13  VAL  32          HG13      VAL  32 -27.589  -1.146   6.039
  245   HG21  VAL  32          HG21      VAL  32 -27.046   2.295   7.299
  246   HG22  VAL  32          HG22      VAL  32 -27.446   0.899   8.300
  247   HG23  VAL  32          HG23      VAL  32 -28.268   1.146   6.759
  248    H    PHE  33           HN       PHE  33 -23.730   1.076   5.042
  249    HA   PHE  33           HA       PHE  33 -22.764  -1.549   4.520
  250    HB2  PHE  33           HB2      PHE  33 -22.274   1.139   3.289
  251    HB3  PHE  33           HB1      PHE  33 -21.239  -0.204   2.861
  252    HD1  PHE  33           HD1      PHE  33 -23.116  -2.441   2.698
  253    HD2  PHE  33           HD2      PHE  33 -23.563   1.603   1.455
  254    HE1  PHE  33           HE1      PHE  33 -24.725  -3.154   0.980
  255    HE2  PHE  33           HE2      PHE  33 -25.173   0.898  -0.267
  256    HZ   PHE  33           HZ       PHE  33 -25.762  -1.481  -0.514
  257    H    LYS  34           HN       LYS  34 -21.528   1.049   6.440
  258    HA   LYS  34           HA       LYS  34 -18.786   0.375   6.266
  259    HB2  LYS  34           HB2      LYS  34 -20.290   1.830   8.466
  260    HB3  LYS  34           HB1      LYS  34 -18.555   1.792   8.327
  261    HG2  LYS  34           HG2      LYS  34 -19.235   2.721   5.903
  262    HG3  LYS  34           HG1      LYS  34 -20.455   3.447   6.962
  263    HD2  LYS  34           HD2      LYS  34 -18.591   4.870   6.973
  264    HD3  LYS  34           HD1      LYS  34 -18.584   4.067   8.517
  265    HE2  LYS  34           HE2      LYS  34 -16.896   2.518   7.714
  266    HE3  LYS  34           HE1      LYS  34 -16.928   3.279   6.122
  267    HZ1  LYS  34           HZ1      LYS  34 -15.068   4.084   7.414
  268    HZ2  LYS  34           HZ2      LYS  34 -16.100   4.593   8.657
  269    HZ3  LYS  34           HZ3      LYS  34 -16.166   5.342   7.133
  270    H    GLN  35           HN       GLN  35 -21.405  -0.507   8.440
  271    HA   GLN  35           HA       GLN  35 -19.838  -2.174  10.114
  272    HB2  GLN  35           HB2      GLN  35 -21.999  -1.217  10.865
  273    HB3  GLN  35           HB1      GLN  35 -22.846  -2.092   9.615
  274    HG2  GLN  35           HG2      GLN  35 -21.391  -3.521  11.844
  275    HG3  GLN  35           HG1      GLN  35 -23.051  -2.965  11.977
  276   HE21  GLN  35          HE21      GLN  35 -21.850  -5.670  11.971
  277   HE22  GLN  35          HE22      GLN  35 -22.701  -6.540  10.739
  278    H    TYR  36           HN       TYR  36 -21.587  -2.557   7.162
  279    HA   TYR  36           HA       TYR  36 -21.653  -5.369   6.966
  280    HB2  TYR  36           HB2      TYR  36 -23.131  -4.116   5.612
  281    HB3  TYR  36           HB1      TYR  36 -21.849  -3.078   5.035
  282    HD1  TYR  36           HD1      TYR  36 -22.965  -6.657   4.856
  283    HD2  TYR  36           HD2      TYR  36 -20.963  -3.408   3.011
  284    HE1  TYR  36           HE1      TYR  36 -22.761  -7.972   2.779
  285    HE2  TYR  36           HE2      TYR  36 -20.754  -4.674   0.927
  286    HH   TYR  36           HH       TYR  36 -20.732  -7.036   0.213
  287    H    ALA  37           HN       ALA  37 -19.437  -2.952   5.568
  288    HA   ALA  37           HA       ALA  37 -17.689  -4.890   4.426
  289    HB1  ALA  37           HB1      ALA  37 -17.201  -1.982   5.089
  290    HB2  ALA  37           HB2      ALA  37 -17.825  -2.606   3.561
  291    HB3  ALA  37           HB3      ALA  37 -16.174  -2.984   4.066
  292    H    ASN  38           HN       ASN  38 -17.880  -3.216   7.465
  293    HA   ASN  38           HA       ASN  38 -15.344  -3.633   8.547
  294    HB2  ASN  38           HB2      ASN  38 -16.985  -2.165   9.647
  295    HB3  ASN  38           HB1      ASN  38 -18.025  -3.547   9.978
  296   HD21  ASN  38          HD21      ASN  38 -17.574  -4.898  11.711
  297   HD22  ASN  38          HD22      ASN  38 -16.301  -4.529  12.896
  298    H    ASP  39           HN       ASP  39 -18.253  -5.638   9.065
  299    HA   ASP  39           HA       ASP  39 -16.819  -7.596  10.528
  300    HB2  ASP  39           HB2      ASP  39 -19.587  -7.368   9.478
  301    HB3  ASP  39           HB1      ASP  39 -19.000  -8.979   9.907
  302    H    ASN  40           HN       ASN  40 -17.161  -7.098   7.149
  303    HA   ASN  40           HA       ASN  40 -16.481  -9.825   6.488
  304    HB2  ASN  40           HB2      ASN  40 -17.009  -7.322   4.923
  305    HB3  ASN  40           HB1      ASN  40 -16.227  -8.694   4.145
  306   HD21  ASN  40          HD21      ASN  40 -18.869  -7.390   3.810
  307   HD22  ASN  40          HD22      ASN  40 -20.033  -8.715   3.955
  308    H    GLY  41           HN       GLY  41 -14.888  -7.019   7.435
  309    HA2  GLY  41           HA2      GLY  41 -12.626  -6.849   7.954
  310    HA3  GLY  41           HA1      GLY  41 -12.316  -8.294   7.002
  311    H    VAL  42           HN       VAL  42 -14.131  -5.608   5.685
  312    HA   VAL  42           HA       VAL  42 -11.829  -4.991   3.993
  313    HB   VAL  42           HB       VAL  42 -14.765  -4.653   3.335
  314   HG11  VAL  42          HG11      VAL  42 -13.934  -4.223   1.060
  315   HG12  VAL  42          HG12      VAL  42 -12.275  -4.373   1.644
  316   HG13  VAL  42          HG13      VAL  42 -13.296  -3.052   2.213
  317   HG21  VAL  42          HG21      VAL  42 -12.764  -6.748   2.520
  318   HG22  VAL  42          HG22      VAL  42 -14.328  -6.517   1.736
  319   HG23  VAL  42          HG23      VAL  42 -14.250  -6.990   3.440
  320    H    ASP  43           HN       ASP  43 -10.949  -3.110   4.428
  321    HA   ASP  43           HA       ASP  43 -12.650  -0.821   4.891
  322    HB2  ASP  43           HB2      ASP  43 -11.544  -0.033   6.948
  323    HB3  ASP  43           HB1      ASP  43 -12.230  -1.630   7.226
  324    H    GLY  44           HN       GLY  44 -11.972   0.075   3.022
  325    HA2  GLY  44           HA2      GLY  44  -9.152   0.876   2.859
  326    HA3  GLY  44           HA1      GLY  44 -10.001   0.244   1.450
  327    H    GLU  45           HN       GLU  45  -9.358   2.359   0.546
  328    HA   GLU  45           HA       GLU  45 -10.258   4.830   1.504
  329    HB2  GLU  45           HB2      GLU  45  -9.971   5.643  -0.785
  330    HB3  GLU  45           HB1      GLU  45  -8.635   4.599  -0.339
  331    HG2  GLU  45           HG2      GLU  45  -9.659   2.760  -1.580
  332    HG3  GLU  45           HG1      GLU  45 -10.978   3.830  -2.056
  333    H    TRP  46           HN       TRP  46 -12.172   5.903   1.403
  334    HA   TRP  46           HA       TRP  46 -14.438   4.355   0.319
  335    HB2  TRP  46           HB2      TRP  46 -14.180   5.960   2.826
  336    HB3  TRP  46           HB1      TRP  46 -15.717   6.049   1.986
  337    HD1  TRP  46           HD1      TRP  46 -13.321   3.352   3.406
  338    HE1  TRP  46           HE1      TRP  46 -14.725   1.369   4.238
  339    HE3  TRP  46           HE3      TRP  46 -18.032   4.970   2.033
  340    HZ2  TRP  46           HZ2      TRP  46 -17.414   0.590   4.318
  341    HZ3  TRP  46           HZ3      TRP  46 -19.948   3.529   2.555
  342    HH2  TRP  46           HH2      TRP  46 -19.641   1.381   3.672
  343    H    THR  47           HN       THR  47 -15.304   5.175  -1.440
  344    HA   THR  47           HA       THR  47 -15.278   8.093  -1.812
  345    HB   THR  47           HB       THR  47 -15.123   7.613  -4.291
  346    HG1  THR  47           HG1      THR  47 -14.228   5.059  -3.376
  347   HG21  THR  47          HG21      THR  47 -12.677   7.272  -4.252
  348   HG22  THR  47          HG22      THR  47 -12.787   6.807  -2.552
  349   HG23  THR  47          HG23      THR  47 -13.204   8.446  -3.044
  350    H    TYR  48           HN       TYR  48 -17.107   8.984  -2.896
  351    HA   TYR  48           HA       TYR  48 -19.300   7.152  -3.471
  352    HB2  TYR  48           HB2      TYR  48 -19.801   7.743  -1.232
  353    HB3  TYR  48           HB1      TYR  48 -19.405   9.412  -1.488
  354    HD1  TYR  48           HD1      TYR  48 -21.199  10.878  -1.614
  355    HD2  TYR  48           HD2      TYR  48 -21.768   6.850  -2.868
  356    HE1  TYR  48           HE1      TYR  48 -23.574  11.352  -2.053
  357    HE2  TYR  48           HE2      TYR  48 -24.137   7.316  -3.312
  358    HH   TYR  48           HH       TYR  48 -25.421  10.523  -3.331
  359    H    ASP  49           HN       ASP  49 -20.601   7.809  -5.148
  360    HA   ASP  49           HA       ASP  49 -20.165  10.569  -6.158
  361    HB2  ASP  49           HB2      ASP  49 -19.166   8.709  -7.665
  362    HB3  ASP  49           HB1      ASP  49 -20.838   8.292  -8.050
  363    H    ASP  50           HN       ASP  50 -22.090  11.658  -6.758
  364    HA   ASP  50           HA       ASP  50 -24.411  10.365  -5.497
  365    HB2  ASP  50           HB2      ASP  50 -23.740  12.723  -4.829
  366    HB3  ASP  50           HB1      ASP  50 -24.236  13.235  -6.442
  367    H    ALA  51           HN       ALA  51 -23.142  10.827  -8.581
  368    HA   ALA  51           HA       ALA  51 -25.617  11.165  -9.978
  369    HB1  ALA  51           HB1      ALA  51 -24.336  10.651 -12.000
  370    HB2  ALA  51           HB2      ALA  51 -22.953  10.192 -11.007
  371    HB3  ALA  51           HB3      ALA  51 -23.531  11.857 -10.998
  372    H    THR  52           HN       THR  52 -23.643   8.399  -9.051
  373    HA   THR  52           HA       THR  52 -25.684   6.622 -10.166
  374    HB   THR  52           HB       THR  52 -23.918   4.844  -9.862
  375    HG1  THR  52           HG1      THR  52 -22.240   5.420  -8.740
  376   HG21  THR  52          HG21      THR  52 -23.210   7.201 -11.624
  377   HG22  THR  52          HG22      THR  52 -24.303   5.882 -12.041
  378   HG23  THR  52          HG23      THR  52 -22.586   5.558 -11.802
  379    H    LYS  53           HN       LYS  53 -24.556   7.808  -7.172
  380    HA   LYS  53           HA       LYS  53 -24.983   7.287  -4.977
  381    HB2  LYS  53           HB2      LYS  53 -27.183   5.878  -6.398
  382    HB3  LYS  53           HB1      LYS  53 -26.838   5.353  -4.757
  383    HG2  LYS  53           HG2      LYS  53 -28.591   7.022  -4.767
  384    HG3  LYS  53           HG1      LYS  53 -27.159   7.633  -3.944
  385    HD2  LYS  53           HD2      LYS  53 -26.547   8.867  -5.985
  386    HD3  LYS  53           HD1      LYS  53 -28.015   8.282  -6.764
  387    HE2  LYS  53           HE2      LYS  53 -29.355   9.375  -5.035
  388    HE3  LYS  53           HE1      LYS  53 -27.887   9.988  -4.282
  389    HZ1  LYS  53           HZ1      LYS  53 -27.414  11.220  -6.321
  390    HZ2  LYS  53           HZ2      LYS  53 -28.911  11.670  -5.677
  391    HZ3  LYS  53           HZ3      LYS  53 -28.842  10.639  -7.014
  392    H    THR  54           HN       THR  54 -22.932   5.962  -6.420
  393    HA   THR  54           HA       THR  54 -22.936   3.258  -5.325
  394    HB   THR  54           HB       THR  54 -20.863   4.427  -7.179
  395    HG1  THR  54           HG1      THR  54 -22.205   3.151  -8.777
  396   HG21  THR  54          HG21      THR  54 -20.322   2.302  -5.974
  397   HG22  THR  54          HG22      THR  54 -20.422   2.093  -7.723
  398   HG23  THR  54          HG23      THR  54 -21.755   1.563  -6.698
  399    H    TYR  55           HN       TYR  55 -21.991   2.972  -3.413
  400    HA   TYR  55           HA       TYR  55 -19.772   4.681  -2.606
  401    HB2  TYR  55           HB2      TYR  55 -21.396   2.608  -1.105
  402    HB3  TYR  55           HB1      TYR  55 -19.817   3.112  -0.515
  403    HD1  TYR  55           HD1      TYR  55 -23.278   4.122  -1.058
  404    HD2  TYR  55           HD2      TYR  55 -19.453   5.386   0.323
  405    HE1  TYR  55           HE1      TYR  55 -24.317   6.059   0.028
  406    HE2  TYR  55           HE2      TYR  55 -20.489   7.332   1.413
  407    HH   TYR  55           HH       TYR  55 -22.542   8.687   1.194
  408    H    THR  56           HN       THR  56 -17.718   4.116  -2.805
  409    HA   THR  56           HA       THR  56 -17.176   1.361  -3.688
  410    HB   THR  56           HB       THR  56 -15.672   3.836  -4.586
  411    HG1  THR  56           HG1      THR  56 -18.106   3.201  -5.238
  412   HG21  THR  56          HG21      THR  56 -14.396   1.765  -4.803
  413   HG22  THR  56          HG22      THR  56 -14.890   2.334  -6.399
  414   HG23  THR  56          HG23      THR  56 -15.748   0.998  -5.635
  415    H    VAL  57           HN       VAL  57 -15.909   0.261  -2.346
  416    HA   VAL  57           HA       VAL  57 -14.064   1.768  -0.621
  417    HB   VAL  57           HB       VAL  57 -15.866   0.758   0.769
  418   HG11  VAL  57          HG11      VAL  57 -14.883  -1.866  -0.342
  419   HG12  VAL  57          HG12      VAL  57 -16.512  -1.196  -0.463
  420   HG13  VAL  57          HG13      VAL  57 -15.886  -1.721   1.094
  421   HG21  VAL  57          HG21      VAL  57 -13.624   1.066   1.679
  422   HG22  VAL  57          HG22      VAL  57 -13.193  -0.565   1.158
  423   HG23  VAL  57          HG23      VAL  57 -14.433  -0.332   2.389
  424    H    THR  58           HN       THR  58 -12.085   1.516  -1.293
  425    HA   THR  58           HA       THR  58 -11.360  -0.969  -2.702
  426    HB   THR  58           HB       THR  58 -10.032   1.744  -2.910
  427    HG1  THR  58           HG1      THR  58 -11.167   1.731  -5.004
  428   HG21  THR  58          HG21      THR  58  -9.085   0.763  -5.006
  429   HG22  THR  58          HG22      THR  58  -9.764  -0.799  -4.537
  430   HG23  THR  58          HG23      THR  58  -8.529  -0.035  -3.538
  431    H    GLU  59           HN       GLU  59  -9.993  -2.286  -1.733
  432    HA   GLU  59           HA       GLU  59  -8.707  -1.679   0.726
  433    HB2  GLU  59           HB2      GLU  59  -8.379  -4.012  -1.173
  434    HB3  GLU  59           HB1      GLU  59  -7.388  -3.847   0.255
  435    HG2  GLU  59           HG2      GLU  59 -10.388  -3.992   0.267
  436    HG3  GLU  59           HG1      GLU  59  -9.293  -5.329   0.614
  437    H    GLY  60           HN       GLY  60  -6.407  -1.523   1.175
  438    HA2  GLY  60           HA2      GLY  60  -4.536  -1.223  -1.012
  439    HA3  GLY  60           HA1      GLY  60  -4.969   0.309  -0.256
  440    H    SER  61           HN       SER  61  -2.393  -1.144  -0.304
  441    HA   SER  61           HA       SER  61  -1.867  -0.955   2.533
  442    HB2  SER  61           HB2      SER  61  -1.329  -3.520   1.025
  443    HB3  SER  61           HB1      SER  61  -0.662  -3.140   2.613
  444    HG   SER  61           HG       SER  61  -3.374  -2.777   2.472
  445    H    GLY  62           HN       GLY  62  -0.175  -2.327  -0.295
  446    HA2  GLY  62           HA2      GLY  62   1.423  -0.292  -1.057
  447    HA3  GLY  62           HA1      GLY  62   2.204  -0.863   0.412
  448    H    GLY  63           HN       GLY  63   3.976  -1.253  -1.198
  449    HA2  GLY  63           HA2      GLY  63   3.645  -3.949  -2.352
  450    HA3  GLY  63           HA1      GLY  63   4.435  -2.667  -3.256
  451    H    ALA  64           HN       ALA  64   5.878  -1.503  -1.129
  452    HA   ALA  64           HA       ALA  64   7.921  -1.627  -0.145
  453    HB1  ALA  64           HB1      ALA  64   8.299  -3.495   1.371
  454    HB2  ALA  64           HB2      ALA  64   6.986  -4.392   0.608
  455    HB3  ALA  64           HB3      ALA  64   6.645  -2.904   1.494
  456    H    GLY  65           HN       GLY  65   7.768  -2.403  -2.938
  457    HA2  GLY  65           HA2      GLY  65   9.681  -4.583  -3.220
  458    HA3  GLY  65           HA1      GLY  65   8.857  -3.742  -4.524
  459    H    GLY  66           HN       GLY  66  11.609  -4.359  -4.523
  460    HA2  GLY  66           HA2      GLY  66  12.823  -1.690  -4.185
  461    HA3  GLY  66           HA1      GLY  66  13.715  -3.202  -4.165
  462    H    GLN  67           HN       GLN  67  11.344  -3.289  -6.491
  463    HA   GLN  67           HA       GLN  67  11.274  -3.192  -8.742
  464    HB2  GLN  67           HB2      GLN  67  11.849  -0.760  -8.262
  465    HB3  GLN  67           HB1      GLN  67  13.543  -1.175  -8.632
  466    HG2  GLN  67           HG2      GLN  67  12.876  -1.856 -10.877
  467    HG3  GLN  67           HG1      GLN  67  11.195  -1.468 -10.507
  468   HE21  GLN  67          HE21      GLN  67  12.969  -0.361 -12.554
  469   HE22  GLN  67          HE22      GLN  67  13.008   1.342 -12.273
  470    H    GLY  68           HN       GLY  68  13.199  -4.982  -7.265
  471    HA2  GLY  68           HA2      GLY  68  14.083  -6.729  -8.937
  472    HA3  GLY  68           HA1      GLY  68  15.159  -5.426  -9.415
  473    H    MET  69           HN       MET  69  16.276  -7.740  -8.650
  474    HA   MET  69           HA       MET  69  17.108  -7.372  -5.862
  475    HB2  MET  69           HB2      MET  69  17.986  -9.640  -5.960
  476    HB3  MET  69           HB1      MET  69  16.309  -9.626  -6.477
  477    HG2  MET  69           HG2      MET  69  18.686  -9.714  -8.330
  478    HG3  MET  69           HG1      MET  69  17.735 -11.111  -7.834
  479    HE1  MET  69           HE1      MET  69  17.412 -11.739 -10.398
  480    HE2  MET  69           HE2      MET  69  18.334 -10.317 -10.886
  481    HE3  MET  69           HE3      MET  69  16.754 -10.634 -11.604
  482    H    ILE  70           HN       ILE  70  18.166  -5.405  -7.024
  483    HA   ILE  70           HA       ILE  70  20.722  -6.191  -8.245
  484    HB   ILE  70           HB       ILE  70  19.419  -3.441  -8.460
  485   HG12  ILE  70          HG12      ILE  70  19.603  -5.635 -10.543
  486   HG13  ILE  70          HG11      ILE  70  18.146  -5.210  -9.655
  487   HG21  ILE  70          HG21      ILE  70  21.122  -2.949 -10.108
  488   HG22  ILE  70          HG22      ILE  70  21.764  -4.586 -10.016
  489   HG23  ILE  70          HG23      ILE  70  21.921  -3.499  -8.633
  490   HD11  ILE  70          HD11      ILE  70  18.142  -4.256 -11.897
  491   HD12  ILE  70          HD12      ILE  70  19.643  -3.398 -11.543
  492   HD13  ILE  70          HD13      ILE  70  18.166  -2.988 -10.672
  493    H    GLN  71           HN       GLN  71  21.448  -6.619  -6.077
  494    HA   GLN  71           HA       GLN  71  21.895  -4.224  -4.437
  495    HB2  GLN  71           HB2      GLN  71  21.981  -5.648  -2.547
  496    HB3  GLN  71           HB1      GLN  71  20.619  -6.193  -3.495
  497    HG2  GLN  71           HG2      GLN  71  22.087  -7.965  -4.450
  498    HG3  GLN  71           HG1      GLN  71  23.309  -7.497  -3.267
  499   HE21  GLN  71          HE21      GLN  71  21.957 -10.006  -3.558
  500   HE22  GLN  71          HE22      GLN  71  21.117 -10.291  -2.069
  501    H    GLU  72           HN       GLU  72  23.368  -5.566  -6.783
  502    HA   GLU  72           HA       GLU  72  26.014  -5.976  -5.603
  503    HB2  GLU  72           HB2      GLU  72  25.007  -6.297  -8.445
  504    HB3  GLU  72           HB1      GLU  72  26.661  -6.605  -7.940
  505    HG2  GLU  72           HG2      GLU  72  25.976  -8.436  -6.567
  506    HG3  GLU  72           HG1      GLU  72  24.276  -8.045  -6.818
  507    HA   PRO  73           HA       PRO  73  27.311  -1.868  -6.609
  508    HB2  PRO  73           HB2      PRO  73  29.988  -2.245  -6.913
  509    HB3  PRO  73           HB1      PRO  73  29.178  -2.277  -5.305
  510    HG2  PRO  73           HG2      PRO  73  30.007  -4.571  -7.066
  511    HG3  PRO  73           HG1      PRO  73  30.200  -4.379  -5.313
  512    HD2  PRO  73           HD2      PRO  73  28.213  -5.869  -6.400
  513    HD3  PRO  73           HD1      PRO  73  28.002  -4.951  -4.871
  514    H    ALA  74           HN       ALA  74  28.740  -0.716  -8.250
  515    HA   ALA  74           HA       ALA  74  29.208  -2.066 -10.718
  516    HB1  ALA  74           HB1      ALA  74  27.012   0.008 -10.686
  517    HB2  ALA  74           HB2      ALA  74  26.762  -1.732 -10.836
  518    HB3  ALA  74           HB3      ALA  74  27.629  -0.856 -12.097
  519    H    LEU  75           HN       LEU  75  29.909  -0.472 -12.442
  520    HA   LEU  75           HA       LEU  75  31.819   1.323 -11.295
  521    HB2  LEU  75           HB2      LEU  75  31.081   0.479 -14.071
  522    HB3  LEU  75           HB1      LEU  75  32.055   1.912 -13.856
  523    HG   LEU  75           HG       LEU  75  33.457   0.017 -14.349
  524   HD11  LEU  75          HD11      LEU  75  34.990   0.158 -12.466
  525   HD12  LEU  75          HD12      LEU  75  33.709   0.845 -11.467
  526   HD13  LEU  75          HD13      LEU  75  34.315   1.742 -12.859
  527   HD21  LEU  75          HD21      LEU  75  33.606  -1.917 -12.887
  528   HD22  LEU  75          HD22      LEU  75  31.969  -1.750 -13.525
  529   HD23  LEU  75          HD23      LEU  75  32.322  -1.266 -11.867
  530    HA   PRO  76           HA       PRO  76  29.256   4.969 -11.358
  531    HB2  PRO  76           HB2      PRO  76  31.672   6.582 -11.923
  532    HB3  PRO  76           HB1      PRO  76  30.645   6.626 -10.481
  533    HG2  PRO  76           HG2      PRO  76  33.124   5.620 -10.378
  534    HG3  PRO  76           HG1      PRO  76  31.764   4.855  -9.466
  535    HD2  PRO  76           HD2      PRO  76  32.963   4.006 -12.135
  536    HD3  PRO  76           HD1      PRO  76  32.580   3.022 -10.707
  537    HA   PRO  77           HA       PRO  77  28.235   5.844 -15.598
  538    HB2  PRO  77           HB2      PRO  77  27.944   8.614 -14.441
  539    HB3  PRO  77           HB1      PRO  77  26.866   7.763 -15.559
  540    HG2  PRO  77           HG2      PRO  77  26.182   7.818 -13.042
  541    HG3  PRO  77           HG1      PRO  77  26.151   6.265 -13.905
  542    HD2  PRO  77           HD2      PRO  77  28.216   7.279 -11.954
  543    HD3  PRO  77           HD1      PRO  77  27.481   5.638 -12.108
  544    H    GLY  78           HN       GLY  78  29.588   6.146 -17.227
  545    HA2  GLY  78           HA2      GLY  78  31.132   7.404 -18.525
  546    HA3  GLY  78           HA1      GLY  78  31.568   8.317 -17.091
  547    H    TRP  79           HN       TRP  79  31.887   5.745 -15.529
  548    HA   TRP  79           HA       TRP  79  34.619   5.191 -16.438
  549    HB2  TRP  79           HB2      TRP  79  33.137   4.479 -13.889
  550    HB3  TRP  79           HB1      TRP  79  34.760   3.910 -14.248
  551    HD1  TRP  79           HD1      TRP  79  32.844   7.159 -13.483
  552    HE1  TRP  79           HE1      TRP  79  34.532   8.916 -12.641
  553    HE3  TRP  79           HE3      TRP  79  37.178   4.544 -14.234
  554    HZ2  TRP  79           HZ2      TRP  79  37.331   9.150 -12.326
  555    HZ3  TRP  79           HZ3      TRP  79  39.309   5.600 -13.632
  556    HH2  TRP  79           HH2      TRP  79  39.387   7.851 -12.697
  557    H    GLU  80           HN       GLU  80  35.345   3.162 -17.099
  558    HA   GLU  80           HA       GLU  80  33.364   0.997 -17.276
  559    HB2  GLU  80           HB2      GLU  80  33.694   2.095 -19.490
  560    HB3  GLU  80           HB1      GLU  80  35.420   1.812 -19.355
  561    HG2  GLU  80           HG2      GLU  80  34.369   0.204 -20.838
  562    HG3  GLU  80           HG1      GLU  80  35.070  -0.582 -19.425
  563    H    MET  81           HN       MET  81  34.371  -1.171 -17.327
  564    HA   MET  81           HA       MET  81  37.126  -1.225 -16.328
  565    HB2  MET  81           HB2      MET  81  35.636  -1.192 -14.355
  566    HB3  MET  81           HB1      MET  81  34.811  -2.640 -14.975
  567    HG2  MET  81           HG2      MET  81  37.756  -2.660 -14.428
  568    HG3  MET  81           HG1      MET  81  36.595  -2.870 -13.120
  569    HE1  MET  81           HE1      MET  81  34.713  -6.125 -14.186
  570    HE2  MET  81           HE2      MET  81  34.247  -4.514 -14.735
  571    HE3  MET  81           HE3      MET  81  34.777  -4.758 -13.074
  572    H    LYS  82           HN       LYS  82  38.291  -2.747 -17.443
  573    HA   LYS  82           HA       LYS  82  36.929  -5.116 -18.454
  574    HB2  LYS  82           HB2      LYS  82  38.545  -3.427 -20.387
  575    HB3  LYS  82           HB1      LYS  82  37.561  -4.819 -20.759
  576    HG2  LYS  82           HG2      LYS  82  35.539  -3.528 -20.131
  577    HG3  LYS  82           HG1      LYS  82  36.583  -2.099 -19.907
  578    HD2  LYS  82           HD2      LYS  82  36.282  -3.667 -22.476
  579    HD3  LYS  82           HD1      LYS  82  35.473  -2.143 -22.113
  580    HE2  LYS  82           HE2      LYS  82  37.634  -1.030 -21.922
  581    HE3  LYS  82           HE1      LYS  82  38.458  -2.555 -22.240
  582    HZ1  LYS  82           HZ1      LYS  82  37.352  -2.611 -24.423
  583    HZ2  LYS  82           HZ2      LYS  82  38.375  -1.265 -24.237
  584    HZ3  LYS  82           HZ3      LYS  82  36.690  -1.077 -24.114
  585    H    TYR  83           HN       TYR  83  38.577  -6.710 -19.372
  586    HA   TYR  83           HA       TYR  83  41.073  -6.499 -17.793
  587    HB2  TYR  83           HB2      TYR  83  39.441  -8.898 -18.680
  588    HB3  TYR  83           HB1      TYR  83  41.127  -9.063 -18.133
  589    HD1  TYR  83           HD1      TYR  83  41.471  -9.552 -15.874
  590    HD2  TYR  83           HD2      TYR  83  37.894  -7.547 -17.016
  591    HE1  TYR  83           HE1      TYR  83  40.685  -9.637 -13.547
  592    HE2  TYR  83           HE2      TYR  83  37.100  -7.634 -14.694
  593    HH   TYR  83           HH       TYR  83  37.427  -8.709 -12.670
  594    H    THR  84           HN       THR  84  43.021  -7.392 -18.707
  595    HA   THR  84           HA       THR  84  43.261  -6.936 -21.562
  596    HB   THR  84           HB       THR  84  45.653  -7.167 -21.251
  597    HG1  THR  84           HG1      THR  84  46.384  -7.618 -19.004
  598   HG21  THR  84          HG21      THR  84  46.092  -5.455 -19.540
  599   HG22  THR  84          HG22      THR  84  44.431  -5.609 -18.974
  600   HG23  THR  84          HG23      THR  84  44.758  -5.015 -20.603
  601    H    SER  85           HN       SER  85  45.348  -8.806 -22.119
  602    HA   SER  85           HA       SER  85  43.702 -11.123 -22.647
  603    HB2  SER  85           HB2      SER  85  45.803 -11.825 -23.949
  604    HB3  SER  85           HB1      SER  85  44.962 -10.376 -24.503
  605    HG   SER  85           HG       SER  85  46.570  -9.138 -23.825
  606    H    GLU  86           HN       GLU  86  45.646 -10.299 -20.072
  607    HA   GLU  86           HA       GLU  86  46.366 -13.142 -19.606
  608    HB2  GLU  86           HB2      GLU  86  47.902 -10.650 -18.812
  609    HB3  GLU  86           HB1      GLU  86  48.291 -12.268 -18.235
  610    HG2  GLU  86           HG2      GLU  86  48.603 -12.966 -20.596
  611    HG3  GLU  86           HG1      GLU  86  48.354 -11.289 -21.081
  612    H    GLY  87           HN       GLY  87  44.086 -11.185 -18.785
  613    HA2  GLY  87           HA2      GLY  87  42.578 -11.472 -17.035
  614    HA3  GLY  87           HA1      GLY  87  43.804 -12.371 -16.162
  615    H    VAL  88           HN       VAL  88  44.864  -9.337 -17.336
  616    HA   VAL  88           HA       VAL  88  44.825  -8.310 -14.605
  617    HB   VAL  88           HB       VAL  88  46.212  -7.194 -17.054
  618   HG11  VAL  88          HG11      VAL  88  45.707  -5.431 -15.467
  619   HG12  VAL  88          HG12      VAL  88  47.435  -5.783 -15.442
  620   HG13  VAL  88          HG13      VAL  88  46.392  -6.386 -14.154
  621   HG21  VAL  88          HG21      VAL  88  48.267  -7.994 -15.937
  622   HG22  VAL  88          HG22      VAL  88  47.185  -9.306 -16.401
  623   HG23  VAL  88          HG23      VAL  88  47.267  -8.785 -14.719
  624    H    ARG  89           HN       ARG  89  43.476  -6.805 -13.941
  625    HA   ARG  89           HA       ARG  89  41.475  -5.801 -15.800
  626    HB2  ARG  89           HB2      ARG  89  40.478  -6.677 -13.891
  627    HB3  ARG  89           HB1      ARG  89  41.726  -6.047 -12.829
  628    HG2  ARG  89           HG2      ARG  89  40.813  -3.855 -12.942
  629    HG3  ARG  89           HG1      ARG  89  39.696  -4.331 -14.223
  630    HD2  ARG  89           HD2      ARG  89  38.226  -5.146 -12.762
  631    HD3  ARG  89           HD1      ARG  89  39.474  -6.047 -11.914
  632    HE   ARG  89           HE       ARG  89  39.930  -3.626 -10.958
  633   HH11  ARG  89          HH11      ARG  89  36.878  -5.262 -11.466
  634   HH12  ARG  89          HH12      ARG  89  36.109  -4.541 -10.083
  635   HH21  ARG  89          HH21      ARG  89  38.945  -2.700  -9.136
  636   HH22  ARG  89          HH22      ARG  89  37.291  -3.070  -8.760
  637    H    TYR  90           HN       TYR  90  41.403  -3.804 -16.568
  638    HA   TYR  90           HA       TYR  90  42.974  -1.732 -15.198
  639    HB2  TYR  90           HB2      TYR  90  43.413  -0.663 -17.390
  640    HB3  TYR  90           HB1      TYR  90  44.124  -2.259 -17.273
  641    HD1  TYR  90           HD1      TYR  90  43.048  -4.181 -18.512
  642    HD2  TYR  90           HD2      TYR  90  41.844  -0.135 -19.080
  643    HE1  TYR  90           HE1      TYR  90  41.916  -4.811 -20.594
  644    HE2  TYR  90           HE2      TYR  90  40.726  -0.761 -21.178
  645    HH   TYR  90           HH       TYR  90  40.608  -2.430 -22.784
  646    H    PHE  91           HN       PHE  91  42.075   0.477 -15.407
  647    HA   PHE  91           HA       PHE  91  39.163   0.319 -15.611
  648    HB2  PHE  91           HB2      PHE  91  40.889   2.421 -14.282
  649    HB3  PHE  91           HB1      PHE  91  39.133   2.382 -14.278
  650    HD1  PHE  91           HD1      PHE  91  38.034   0.077 -13.325
  651    HD2  PHE  91           HD2      PHE  91  42.001   1.481 -12.509
  652    HE1  PHE  91           HE1      PHE  91  38.121  -1.290 -11.307
  653    HE2  PHE  91           HE2      PHE  91  42.051   0.108 -10.471
  654    HZ   PHE  91           HZ       PHE  91  39.920  -1.460 -10.008
  655    H    VAL  92           HN       VAL  92  38.020   1.903 -16.815
  656    HA   VAL  92           HA       VAL  92  39.690   3.120 -18.917
  657    HB   VAL  92           HB       VAL  92  37.132   1.576 -19.410
  658   HG11  VAL  92          HG11      VAL  92  37.603   1.867 -21.769
  659   HG12  VAL  92          HG12      VAL  92  39.053   2.792 -21.387
  660   HG13  VAL  92          HG13      VAL  92  37.459   3.433 -20.976
  661   HG21  VAL  92          HG21      VAL  92  40.002   0.838 -19.741
  662   HG22  VAL  92          HG22      VAL  92  38.770   0.132 -20.777
  663   HG23  VAL  92          HG23      VAL  92  38.687  -0.101 -19.035
  664    H    ASP  93           HN       ASP  93  39.332   5.279 -18.695
  665    HA   ASP  93           HA       ASP  93  36.759   6.310 -17.857
  666    HB2  ASP  93           HB2      ASP  93  39.256   7.603 -18.999
  667    HB3  ASP  93           HB1      ASP  93  37.762   8.511 -18.826
  668    H    HIS  94           HN       HIS  94  35.527   5.022 -19.456
  669    HA   HIS  94           HA       HIS  94  35.473   5.296 -22.197
  670    HB2  HIS  94           HB2      HIS  94  33.986   3.770 -20.979
  671    HB3  HIS  94           HB1      HIS  94  33.096   5.130 -20.305
  672    HD1  HIS  94           HD1      HIS  94  31.089   5.866 -21.595
  673    HD2  HIS  94           HD2      HIS  94  33.675   3.501 -23.832
  674    HE1  HIS  94           HE1      HIS  94  29.894   5.428 -23.766
  675    HE2  HIS  94           HE2      HIS  94  31.365   3.762 -24.972
  676    H    ASN  95           HN       ASN  95  34.811   7.738 -19.909
  677    HA   ASN  95           HA       ASN  95  33.146   9.363 -21.598
  678    HB2  ASN  95           HB2      ASN  95  33.339  11.041 -19.766
  679    HB3  ASN  95           HB1      ASN  95  32.828   9.462 -19.176
  680   HD21  ASN  95          HD21      ASN  95  34.284   8.206 -17.969
  681   HD22  ASN  95          HD22      ASN  95  35.676   8.909 -17.220
  682    H    THR  96           HN       THR  96  36.594   9.204 -20.833
  683    HA   THR  96           HA       THR  96  37.006  11.481 -22.657
  684    HB   THR  96           HB       THR  96  39.300  11.615 -21.519
  685    HG1  THR  96           HG1      THR  96  39.327   9.680 -20.391
  686   HG21  THR  96          HG21      THR  96  36.780  12.258 -19.979
  687   HG22  THR  96          HG22      THR  96  37.631  13.308 -21.113
  688   HG23  THR  96          HG23      THR  96  38.380  12.878 -19.575
  689    H    ARG  97           HN       ARG  97  37.241   8.205 -22.404
  690    HA   ARG  97           HA       ARG  97  38.182   6.545 -23.641
  691    HB2  ARG  97           HB2      ARG  97  38.834   8.791 -25.535
  692    HB3  ARG  97           HB1      ARG  97  39.014   7.076 -25.899
  693    HG2  ARG  97           HG2      ARG  97  36.626   6.767 -25.477
  694    HG3  ARG  97           HG1      ARG  97  36.456   8.506 -25.223
  695    HD2  ARG  97           HD2      ARG  97  37.130   7.025 -27.752
  696    HD3  ARG  97           HD1      ARG  97  35.839   8.194 -27.464
  697    HE   ARG  97           HE       ARG  97  38.367   9.417 -27.090
  698   HH11  ARG  97          HH11      ARG  97  36.177   8.320 -29.579
  699   HH12  ARG  97          HH12      ARG  97  36.874   9.315 -30.815
  700   HH21  ARG  97          HH21      ARG  97  39.271  10.751 -28.674
  701   HH22  ARG  97          HH22      ARG  97  38.621  10.755 -30.286
  702    H    THR  98           HN       THR  98  39.615   6.317 -21.930
  703    HA   THR  98           HA       THR  98  42.400   6.558 -22.686
  704    HB   THR  98           HB       THR  98  42.730   7.554 -20.204
  705    HG1  THR  98           HG1      THR  98  41.064   8.686 -19.505
  706   HG21  THR  98          HG21      THR  98  43.717   8.538 -22.223
  707   HG22  THR  98          HG22      THR  98  42.990   9.802 -21.228
  708   HG23  THR  98          HG23      THR  98  42.154   9.225 -22.670
  709    H    THR  99           HN       THR  99  43.814   5.335 -21.180
  710    HA   THR  99           HA       THR  99  42.259   3.320 -19.663
  711    HB   THR  99           HB       THR  99  44.322   1.823 -20.104
  712    HG1  THR  99           HG1      THR  99  45.314   2.654 -22.232
  713   HG21  THR  99          HG21      THR  99  43.597   1.229 -22.418
  714   HG22  THR  99          HG22      THR  99  42.693   2.741 -22.506
  715   HG23  THR  99          HG23      THR  99  42.202   1.494 -21.367
  716    H    THR 100           HN       THR 100  42.909   2.956 -17.492
  717    HA   THR 100           HA       THR 100  45.481   3.984 -16.639
  718    HB   THR 100           HB       THR 100  44.056   5.968 -16.422
  719    HG1  THR 100           HG1      THR 100  44.642   6.410 -14.311
  720   HG21  THR 100          HG21      THR 100  42.413   4.280 -14.526
  721   HG22  THR 100          HG22      THR 100  41.886   4.853 -16.108
  722   HG23  THR 100          HG23      THR 100  42.201   6.006 -14.810
  723    H    PHE 101           HN       PHE 101  46.197   3.144 -14.672
  724    HA   PHE 101           HA       PHE 101  44.607   0.872 -13.693
  725    HB2  PHE 101           HB2      PHE 101  47.600   1.371 -13.778
  726    HB3  PHE 101           HB1      PHE 101  46.860   0.100 -12.722
  727    HD1  PHE 101           HD1      PHE 101  46.377  -1.997 -13.604
  728    HD2  PHE 101           HD2      PHE 101  47.177   1.238 -16.245
  729    HE1  PHE 101           HE1      PHE 101  46.377  -3.562 -15.498
  730    HE2  PHE 101           HE2      PHE 101  47.184  -0.317 -18.155
  731    HZ   PHE 101           HZ       PHE 101  46.915  -2.774 -17.732
  732    H    LYS 102           HN       LYS 102  43.404   1.816 -12.056
  733    HA   LYS 102           HA       LYS 102  44.799   3.404 -10.055
  734    HB2  LYS 102           HB2      LYS 102  41.885   2.696 -10.408
  735    HB3  LYS 102           HB1      LYS 102  42.500   3.555  -9.009
  736    HG2  LYS 102           HG2      LYS 102  43.303   5.353 -10.485
  737    HG3  LYS 102           HG1      LYS 102  42.618   4.495 -11.864
  738    HD2  LYS 102           HD2      LYS 102  41.082   6.234 -11.152
  739    HD3  LYS 102           HD1      LYS 102  40.378   4.652 -10.809
  740    HE2  LYS 102           HE2      LYS 102  39.977   6.015  -8.907
  741    HE3  LYS 102           HE1      LYS 102  41.247   4.878  -8.470
  742    HZ1  LYS 102           HZ1      LYS 102  41.844   7.015  -7.657
  743    HZ2  LYS 102           HZ2      LYS 102  41.581   7.743  -9.163
  744    HZ3  LYS 102           HZ3      LYS 102  42.875   6.668  -8.957
  745    H    ASP 103           HN       ASP 103  46.117   1.892  -9.118
  746    HA   ASP 103           HA       ASP 103  44.907  -0.527  -8.039
  747    HB2  ASP 103           HB2      ASP 103  47.057  -0.629  -9.347
  748    HB3  ASP 103           HB1      ASP 103  47.835   0.274  -8.053
  749    HA   PRO 104           HA       PRO 104  44.604   1.449  -4.065
  750    HB2  PRO 104           HB2      PRO 104  44.117  -0.767  -2.546
  751    HB3  PRO 104           HB1      PRO 104  42.888  -0.061  -3.603
  752    HG2  PRO 104           HG2      PRO 104  44.688  -2.402  -4.085
  753    HG3  PRO 104           HG1      PRO 104  42.963  -2.223  -4.454
  754    HD2  PRO 104           HD2      PRO 104  44.890  -1.956  -6.327
  755    HD3  PRO 104           HD1      PRO 104  43.375  -1.031  -6.383
  756    H    ARG 105           HN       ARG 105  47.057  -0.800  -4.893
  757    HA   ARG 105           HA       ARG 105  48.404  -0.475  -2.295
  758    HB2  ARG 105           HB2      ARG 105  48.919  -2.349  -4.607
  759    HB3  ARG 105           HB1      ARG 105  50.066  -2.134  -3.297
  760    HG2  ARG 105           HG2      ARG 105  48.872  -4.096  -2.818
  761    HG3  ARG 105           HG1      ARG 105  48.235  -2.865  -1.725
  762    HD2  ARG 105           HD2      ARG 105  46.476  -4.324  -2.794
  763    HD3  ARG 105           HD1      ARG 105  46.266  -2.590  -3.050
  764    HE   ARG 105           HE       ARG 105  47.301  -2.969  -5.296
  765   HH11  ARG 105          HH11      ARG 105  45.736  -5.641  -3.617
  766   HH12  ARG 105          HH12      ARG 105  45.254  -6.419  -5.096
  767   HH21  ARG 105          HH21      ARG 105  46.701  -4.007  -7.195
  768   HH22  ARG 105          HH22      ARG 105  45.828  -5.514  -7.129
  769    HA   PRO 106           HA       PRO 106  50.670   2.888  -4.426
  770    HB2  PRO 106           HB2      PRO 106  52.255   2.572  -1.897
  771    HB3  PRO 106           HB1      PRO 106  51.658   4.071  -2.705
  772    HG2  PRO 106           HG2      PRO 106  50.467   3.091  -0.520
  773    HG3  PRO 106           HG1      PRO 106  49.528   3.828  -1.831
  774    HD2  PRO 106           HD2      PRO 106  49.833   0.960  -1.079
  775    HD3  PRO 106           HD1      PRO 106  48.439   1.818  -1.822
  776    H    GLY 107           HN       GLY 107  52.064   2.267  -5.988
  777    HA2  GLY 107           HA2      GLY 107  53.978   1.417  -6.962
  778    HA3  GLY 107           HA1      GLY 107  54.552   0.977  -5.335
  779    H    PHE 108           HN       PHE 108  51.887  -0.528  -5.032
  780    HA   PHE 108           HA       PHE 108  51.485  -2.804  -4.843
  781    HB2  PHE 108           HB2      PHE 108  50.887  -3.853  -7.040
  782    HB3  PHE 108           HB1      PHE 108  50.084  -2.277  -6.724
  783    HD1  PHE 108           HD1      PHE 108  50.571  -0.365  -8.136
  784    HD2  PHE 108           HD2      PHE 108  52.579  -4.075  -8.762
  785    HE1  PHE 108           HE1      PHE 108  51.329   0.414 -10.337
  786    HE2  PHE 108           HE2      PHE 108  53.340  -3.288 -10.964
  787    HZ   PHE 108           HZ       PHE 108  52.713  -1.039 -11.754
  788    H    GLU 109           HN       GLU 109  54.155  -2.391  -4.456
  789    HA   GLU 109           HA       GLU 109  55.275  -4.882  -5.560
  790    HB2  GLU 109           HB2      GLU 109  56.688  -2.262  -4.950
  791    HB3  GLU 109           HB1      GLU 109  57.569  -3.770  -5.117
  792    HG2  GLU 109           HG2      GLU 109  55.859  -2.505  -7.267
  793    HG3  GLU 109           HG1      GLU 109  57.613  -2.380  -7.133
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1 -41.534   4.847  -5.018
    2    H2   GLY   1           HT2      GLY   1 -39.996   4.935  -4.323
    3    H3   GLY   1           HT3      GLY   1 -40.550   6.199  -5.307
    4    HA2  GLY   1           HA1      GLY   1 -42.281   6.719  -3.715
    5    HA3  GLY   1           HA2      GLY   1 -41.705   5.408  -2.693
    6    H    SER   2           HN       SER   2 -40.759   6.257  -0.970
    7    HA   SER   2           HA       SER   2 -39.271   8.767  -1.245
    8    HB2  SER   2           HB2      SER   2 -39.979   7.291   1.299
    9    HB3  SER   2           HB1      SER   2 -39.488   8.978   1.138
   10    HG   SER   2           HG       SER   2 -41.529   9.419   0.926
   11    H    HIS   3           HN       HIS   3 -38.496   5.704  -1.717
   12    HA   HIS   3           HA       HIS   3 -35.963   5.856  -0.223
   13    HB2  HIS   3           HB2      HIS   3 -37.345   3.384  -1.297
   14    HB3  HIS   3           HB1      HIS   3 -35.828   3.407  -0.412
   15    HD1  HIS   3           HD1      HIS   3 -39.252   2.726   0.119
   16    HD2  HIS   3           HD2      HIS   3 -36.321   4.719   2.286
   17    HE1  HIS   3           HE1      HIS   3 -40.081   2.773   2.493
   18    HE2  HIS   3           HE2      HIS   3 -38.399   4.195   3.728
   19    H    MET   4           HN       MET   4 -34.078   4.900  -1.381
   20    HA   MET   4           HA       MET   4 -34.346   4.841  -4.287
   21    HB2  MET   4           HB2      MET   4 -33.583   7.153  -3.550
   22    HB3  MET   4           HB1      MET   4 -32.141   6.374  -2.926
   23    HG2  MET   4           HG2      MET   4 -32.013   7.487  -5.213
   24    HG3  MET   4           HG1      MET   4 -31.307   5.887  -5.019
   25    HE1  MET   4           HE1      MET   4 -31.892   7.146  -7.848
   26    HE2  MET   4           HE2      MET   4 -32.627   5.784  -8.695
   27    HE3  MET   4           HE3      MET   4 -31.247   5.520  -7.632
   28    H    GLN   5           HN       GLN   5 -32.115   4.112  -5.177
   29    HA   GLN   5           HA       GLN   5 -31.368   1.763  -3.585
   30    HB2  GLN   5           HB2      GLN   5 -32.435   1.270  -5.740
   31    HB3  GLN   5           HB1      GLN   5 -31.209   2.214  -6.570
   32    HG2  GLN   5           HG2      GLN   5 -29.495   0.619  -5.773
   33    HG3  GLN   5           HG1      GLN   5 -30.781  -0.356  -5.064
   34   HE21  GLN   5          HE21      GLN   5 -32.192  -1.469  -6.414
   35   HE22  GLN   5          HE22      GLN   5 -31.831  -1.757  -8.106
   36    H    TYR   6           HN       TYR   6 -29.428   1.798  -2.699
   37    HA   TYR   6           HA       TYR   6 -27.289   3.335  -4.041
   38    HB2  TYR   6           HB2      TYR   6 -27.728   2.770  -1.071
   39    HB3  TYR   6           HB1      TYR   6 -26.174   3.312  -1.685
   40    HD1  TYR   6           HD1      TYR   6 -29.568   4.270  -0.798
   41    HD2  TYR   6           HD2      TYR   6 -25.965   5.601  -2.623
   42    HE1  TYR   6           HE1      TYR   6 -30.324   6.598  -0.579
   43    HE2  TYR   6           HE2      TYR   6 -26.718   7.931  -2.415
   44    HH   TYR   6           HH       TYR   6 -28.811   9.174  -2.173
   45    H    LYS   7           HN       LYS   7 -25.382   2.220  -4.453
   46    HA   LYS   7           HA       LYS   7 -25.322  -0.567  -3.538
   47    HB2  LYS   7           HB2      LYS   7 -24.082  -1.124  -5.690
   48    HB3  LYS   7           HB1      LYS   7 -25.823  -0.812  -5.843
   49    HG2  LYS   7           HG2      LYS   7 -25.486   1.156  -6.980
   50    HG3  LYS   7           HG1      LYS   7 -23.868   1.398  -6.312
   51    HD2  LYS   7           HD2      LYS   7 -23.893   0.749  -8.726
   52    HD3  LYS   7           HD1      LYS   7 -22.973  -0.348  -7.700
   53    HE2  LYS   7           HE2      LYS   7 -24.991  -1.811  -7.599
   54    HE3  LYS   7           HE1      LYS   7 -25.742  -0.763  -8.800
   55    HZ1  LYS   7           HZ1      LYS   7 -23.195  -2.245  -9.179
   56    HZ2  LYS   7           HZ2      LYS   7 -23.982  -1.290 -10.343
   57    HZ3  LYS   7           HZ3      LYS   7 -24.701  -2.722  -9.789
   58    H    LEU   8           HN       LEU   8 -23.165  -1.552  -3.641
   59    HA   LEU   8           HA       LEU   8 -20.947   0.336  -3.230
   60    HB2  LEU   8           HB2      LEU   8 -21.918  -0.084  -0.982
   61    HB3  LEU   8           HB1      LEU   8 -21.849  -1.791  -1.280
   62    HG   LEU   8           HG       LEU   8 -19.298  -1.475  -1.463
   63   HD11  LEU   8          HD11      LEU   8 -19.266   0.950  -1.551
   64   HD12  LEU   8          HD12      LEU   8 -18.429   0.380  -0.105
   65   HD13  LEU   8          HD13      LEU   8 -20.061   1.035   0.021
   66   HD21  LEU   8          HD21      LEU   8 -20.036  -2.745   0.307
   67   HD22  LEU   8          HD22      LEU   8 -20.988  -1.433   0.984
   68   HD23  LEU   8          HD23      LEU   8 -19.229  -1.409   1.131
   69    H    ILE   9           HN       ILE   9 -18.963  -0.517  -3.735
   70    HA   ILE   9           HA       ILE   9 -18.933  -3.303  -4.713
   71    HB   ILE   9           HB       ILE   9 -17.399  -0.921  -5.807
   72   HG12  ILE   9          HG12      ILE   9 -19.321  -2.803  -7.231
   73   HG13  ILE   9          HG11      ILE   9 -19.815  -1.194  -6.580
   74   HG21  ILE   9          HG21      ILE   9 -17.138  -3.858  -6.440
   75   HG22  ILE   9          HG22      ILE   9 -15.893  -2.792  -5.773
   76   HG23  ILE   9          HG23      ILE   9 -16.460  -2.570  -7.431
   77   HD11  ILE   9          HD11      ILE   9 -18.242  -0.119  -8.113
   78   HD12  ILE   9          HD12      ILE   9 -19.347  -1.167  -9.007
   79   HD13  ILE   9          HD13      ILE   9 -17.691  -1.691  -8.698
   80    H    LEU  10           HN       LEU  10 -17.568  -4.584  -3.648
   81    HA   LEU  10           HA       LEU  10 -15.679  -3.307  -1.831
   82    HB2  LEU  10           HB2      LEU  10 -16.389  -6.237  -2.004
   83    HB3  LEU  10           HB1      LEU  10 -15.321  -5.516  -0.828
   84    HG   LEU  10           HG       LEU  10 -17.199  -5.807   0.417
   85   HD11  LEU  10          HD11      LEU  10 -17.859  -3.149  -0.751
   86   HD12  LEU  10          HD12      LEU  10 -16.575  -3.445   0.437
   87   HD13  LEU  10          HD13      LEU  10 -18.260  -3.765   0.855
   88   HD21  LEU  10          HD21      LEU  10 -18.985  -4.999  -1.864
   89   HD22  LEU  10          HD22      LEU  10 -19.473  -5.687  -0.317
   90   HD23  LEU  10          HD23      LEU  10 -18.567  -6.665  -1.470
   91    H    ASN  11           HN       ASN  11 -14.000  -2.671  -3.111
   92    HA   ASN  11           HA       ASN  11 -12.811  -4.682  -4.883
   93    HB2  ASN  11           HB2      ASN  11 -11.877  -1.842  -4.286
   94    HB3  ASN  11           HB1      ASN  11 -11.200  -2.925  -5.476
   95   HD21  ASN  11          HD21      ASN  11 -12.320  -0.255  -5.663
   96   HD22  ASN  11          HD22      ASN  11 -13.516  -0.363  -6.906
   97    H    GLY  12           HN       GLY  12 -12.382  -6.097  -3.130
   98    HA2  GLY  12           HA2      GLY  12  -9.829  -5.434  -1.867
   99    HA3  GLY  12           HA1      GLY  12 -11.120  -6.076  -0.854
  100    H    LYS  13           HN       LYS  13  -8.388  -6.976  -2.082
  101    HA   LYS  13           HA       LYS  13  -8.721  -9.082  -3.812
  102    HB2  LYS  13           HB2      LYS  13  -6.621  -9.071  -1.643
  103    HB3  LYS  13           HB1      LYS  13  -6.477  -9.677  -3.293
  104    HG2  LYS  13           HG2      LYS  13  -6.777  -7.321  -4.088
  105    HG3  LYS  13           HG1      LYS  13  -6.672  -6.808  -2.406
  106    HD2  LYS  13           HD2      LYS  13  -4.434  -8.009  -2.336
  107    HD3  LYS  13           HD1      LYS  13  -4.558  -8.124  -4.093
  108    HE2  LYS  13           HE2      LYS  13  -4.431  -5.627  -2.408
  109    HE3  LYS  13           HE1      LYS  13  -3.249  -6.191  -3.584
  110    HZ1  LYS  13           HZ1      LYS  13  -5.050  -5.905  -5.293
  111    HZ2  LYS  13           HZ2      LYS  13  -4.453  -4.477  -4.618
  112    HZ3  LYS  13           HZ3      LYS  13  -5.950  -5.088  -4.110
  113    H    THR  14           HN       THR  14  -9.559  -8.982  -0.465
  114    HA   THR  14           HA       THR  14  -9.487 -11.857  -0.063
  115    HB   THR  14           HB       THR  14 -10.833 -11.199   2.035
  116    HG1  THR  14           HG1      THR  14 -11.055  -9.065   2.466
  117   HG21  THR  14          HG21      THR  14  -8.443 -11.691   2.103
  118   HG22  THR  14          HG22      THR  14  -8.825 -10.345   3.175
  119   HG23  THR  14          HG23      THR  14  -8.074 -10.041   1.609
  120    H    LEU  15           HN       LEU  15 -12.008  -9.370  -0.474
  121    HA   LEU  15           HA       LEU  15 -13.813 -11.402  -1.559
  122    HB2  LEU  15           HB2      LEU  15 -14.373 -11.135   0.805
  123    HB3  LEU  15           HB1      LEU  15 -14.421  -9.397   0.603
  124    HG   LEU  15           HG       LEU  15 -16.250 -10.148  -1.253
  125   HD11  LEU  15          HD11      LEU  15 -16.613 -12.037   1.068
  126   HD12  LEU  15          HD12      LEU  15 -16.141 -12.501  -0.568
  127   HD13  LEU  15          HD13      LEU  15 -17.725 -11.787  -0.277
  128   HD21  LEU  15          HD21      LEU  15 -17.858  -9.342   0.359
  129   HD22  LEU  15          HD22      LEU  15 -16.371  -8.388   0.392
  130   HD23  LEU  15          HD23      LEU  15 -16.686  -9.573   1.659
  131    H    LYS  16           HN       LYS  16 -14.235 -10.725  -3.558
  132    HA   LYS  16           HA       LYS  16 -14.593  -7.832  -3.992
  133    HB2  LYS  16           HB2      LYS  16 -13.885  -9.931  -6.056
  134    HB3  LYS  16           HB1      LYS  16 -14.041  -8.206  -6.348
  135    HG2  LYS  16           HG2      LYS  16 -11.766  -8.367  -6.185
  136    HG3  LYS  16           HG1      LYS  16 -12.151  -8.087  -4.495
  137    HD2  LYS  16           HD2      LYS  16 -10.531  -9.914  -4.972
  138    HD3  LYS  16           HD1      LYS  16 -11.902 -10.367  -3.958
  139    HE2  LYS  16           HE2      LYS  16 -13.001 -11.321  -5.967
  140    HE3  LYS  16           HE1      LYS  16 -11.564 -10.925  -6.908
  141    HZ1  LYS  16           HZ1      LYS  16 -11.658 -12.770  -4.580
  142    HZ2  LYS  16           HZ2      LYS  16 -10.274 -12.390  -5.479
  143    HZ3  LYS  16           HZ3      LYS  16 -11.545 -13.234  -6.210
  144    H    GLY  17           HN       GLY  17 -16.567  -7.147  -4.581
  145    HA2  GLY  17           HA2      GLY  17 -18.426  -8.521  -6.112
  146    HA3  GLY  17           HA1      GLY  17 -18.779  -8.919  -4.437
  147    H    GLU  18           HN       GLU  18 -20.839  -7.841  -5.119
  148    HA   GLU  18           HA       GLU  18 -20.696  -5.001  -4.416
  149    HB2  GLU  18           HB2      GLU  18 -22.307  -6.129  -6.725
  150    HB3  GLU  18           HB1      GLU  18 -22.461  -4.494  -6.104
  151    HG2  GLU  18           HG2      GLU  18 -20.184  -4.001  -6.774
  152    HG3  GLU  18           HG1      GLU  18 -19.979  -5.662  -7.337
  153    H    THR  19           HN       THR  19 -22.889  -4.147  -3.848
  154    HA   THR  19           HA       THR  19 -24.955  -6.052  -3.231
  155    HB   THR  19           HB       THR  19 -23.390  -6.355  -1.301
  156    HG1  THR  19           HG1      THR  19 -25.795  -6.507  -1.184
  157   HG21  THR  19          HG21      THR  19 -22.519  -4.069  -1.136
  158   HG22  THR  19          HG22      THR  19 -23.290  -4.528   0.388
  159   HG23  THR  19          HG23      THR  19 -24.130  -3.469  -0.742
  160    H    THR  20           HN       THR  20 -26.829  -4.917  -2.120
  161    HA   THR  20           HA       THR  20 -26.906  -2.050  -2.742
  162    HB   THR  20           HB       THR  20 -29.259  -2.488  -3.647
  163    HG1  THR  20           HG1      THR  20 -29.660  -4.584  -3.125
  164   HG21  THR  20          HG21      THR  20 -27.486  -1.846  -5.187
  165   HG22  THR  20          HG22      THR  20 -28.424  -3.149  -5.918
  166   HG23  THR  20          HG23      THR  20 -26.853  -3.493  -5.197
  167    H    THR  21           HN       THR  21 -28.691  -0.919  -1.723
  168    HA   THR  21           HA       THR  21 -30.338  -2.299   0.196
  169    HB   THR  21           HB       THR  21 -28.143  -1.969   1.438
  170    HG1  THR  21           HG1      THR  21 -29.905  -0.430   2.893
  171   HG21  THR  21          HG21      THR  21 -28.973   0.957   1.254
  172   HG22  THR  21          HG22      THR  21 -27.486   0.258   0.614
  173   HG23  THR  21          HG23      THR  21 -27.744   0.340   2.358
  174    H    GLU  22           HN       GLU  22 -31.961  -0.904   1.131
  175    HA   GLU  22           HA       GLU  22 -32.518   1.409  -0.583
  176    HB2  GLU  22           HB2      GLU  22 -34.776   1.329   0.368
  177    HB3  GLU  22           HB1      GLU  22 -34.338  -0.290  -0.171
  178    HG2  GLU  22           HG2      GLU  22 -33.880  -0.976   2.097
  179    HG3  GLU  22           HG1      GLU  22 -34.197   0.694   2.685
  180    H    ALA  23           HN       ALA  23 -32.216   3.475   0.122
  181    HA   ALA  23           HA       ALA  23 -32.263   4.004   3.002
  182    HB1  ALA  23           HB1      ALA  23 -30.065   5.101   2.994
  183    HB2  ALA  23           HB2      ALA  23 -29.831   4.642   1.308
  184    HB3  ALA  23           HB3      ALA  23 -29.919   3.399   2.554
  185    H    VAL  24           HN       VAL  24 -32.555   6.287   3.478
  186    HA   VAL  24           HA       VAL  24 -33.431   7.849   1.157
  187    HB   VAL  24           HB       VAL  24 -34.649   9.251   2.799
  188   HG11  VAL  24          HG11      VAL  24 -36.362   7.584   3.344
  189   HG12  VAL  24          HG12      VAL  24 -35.227   6.295   2.948
  190   HG13  VAL  24          HG13      VAL  24 -35.774   7.408   1.691
  191   HG21  VAL  24          HG21      VAL  24 -34.889   8.457   5.104
  192   HG22  VAL  24          HG22      VAL  24 -33.218   8.887   4.736
  193   HG23  VAL  24          HG23      VAL  24 -33.702   7.191   4.789
  194    H    ASP  25           HN       ASP  25 -30.668   7.538   2.772
  195    HA   ASP  25           HA       ASP  25 -29.851  10.276   2.325
  196    HB2  ASP  25           HB2      ASP  25 -29.572   8.942   5.032
  197    HB3  ASP  25           HB1      ASP  25 -28.625  10.336   4.539
  198    H    ALA  26           HN       ALA  26 -27.513  10.461   2.237
  199    HA   ALA  26           HA       ALA  26 -26.290   8.060   1.185
  200    HB1  ALA  26           HB1      ALA  26 -24.412   9.522   0.615
  201    HB2  ALA  26           HB2      ALA  26 -25.135  10.830   1.551
  202    HB3  ALA  26           HB3      ALA  26 -25.936  10.248   0.091
  203    H    ALA  27           HN       ALA  27 -25.953  10.208   3.969
  204    HA   ALA  27           HA       ALA  27 -23.671   9.005   5.105
  205    HB1  ALA  27           HB1      ALA  27 -24.278  10.156   7.154
  206    HB2  ALA  27           HB2      ALA  27 -25.900  10.452   6.531
  207    HB3  ALA  27           HB3      ALA  27 -24.509  11.221   5.767
  208    H    THR  28           HN       THR  28 -27.106   8.323   5.453
  209    HA   THR  28           HA       THR  28 -26.858   6.409   7.517
  210    HB   THR  28           HB       THR  28 -29.053   6.416   5.438
  211    HG1  THR  28           HG1      THR  28 -29.955   7.889   7.274
  212   HG21  THR  28          HG21      THR  28 -29.033   5.782   8.395
  213   HG22  THR  28          HG22      THR  28 -29.060   4.591   7.096
  214   HG23  THR  28          HG23      THR  28 -30.429   5.681   7.324
  215    H    ALA  29           HN       ALA  29 -26.404   6.247   4.075
  216    HA   ALA  29           HA       ALA  29 -26.639   3.382   3.900
  217    HB1  ALA  29           HB1      ALA  29 -27.122   4.754   1.947
  218    HB2  ALA  29           HB2      ALA  29 -25.760   3.680   1.622
  219    HB3  ALA  29           HB3      ALA  29 -25.475   5.386   1.966
  220    H    GLU  30           HN       GLU  30 -24.098   5.790   4.249
  221    HA   GLU  30           HA       GLU  30 -21.872   4.126   3.906
  222    HB2  GLU  30           HB2      GLU  30 -22.034   6.739   4.185
  223    HB3  GLU  30           HB1      GLU  30 -21.863   6.362   5.892
  224    HG2  GLU  30           HG2      GLU  30 -19.780   5.081   5.314
  225    HG3  GLU  30           HG1      GLU  30 -19.912   5.776   3.699
  226    H    LYS  31           HN       LYS  31 -23.389   5.241   6.925
  227    HA   LYS  31           HA       LYS  31 -21.897   3.835   8.743
  228    HB2  LYS  31           HB2      LYS  31 -24.845   4.450   8.974
  229    HB3  LYS  31           HB1      LYS  31 -23.765   4.063  10.307
  230    HG2  LYS  31           HG2      LYS  31 -23.615   6.482   8.524
  231    HG3  LYS  31           HG1      LYS  31 -24.138   6.439  10.207
  232    HD2  LYS  31           HD2      LYS  31 -21.384   5.678   9.241
  233    HD3  LYS  31           HD1      LYS  31 -21.812   7.255   9.903
  234    HE2  LYS  31           HE2      LYS  31 -21.994   4.613  11.356
  235    HE3  LYS  31           HE1      LYS  31 -20.741   5.835  11.579
  236    HZ1  LYS  31           HZ1      LYS  31 -22.280   6.136  13.311
  237    HZ2  LYS  31           HZ2      LYS  31 -23.615   6.035  12.272
  238    HZ3  LYS  31           HZ3      LYS  31 -22.595   7.388  12.206
  239    H    VAL  32           HN       VAL  32 -24.783   2.638   7.031
  240    HA   VAL  32           HA       VAL  32 -24.913   0.195   8.514
  241    HB   VAL  32           HB       VAL  32 -26.137   0.859   5.826
  242   HG11  VAL  32          HG11      VAL  32 -26.739  -1.374   7.766
  243   HG12  VAL  32          HG12      VAL  32 -26.030  -1.539   6.160
  244   HG13  VAL  32          HG13      VAL  32 -27.696  -0.989   6.334
  245   HG21  VAL  32          HG21      VAL  32 -27.322   1.012   8.596
  246   HG22  VAL  32          HG22      VAL  32 -28.186   1.294   7.084
  247   HG23  VAL  32          HG23      VAL  32 -26.888   2.383   7.575
  248    H    PHE  33           HN       PHE  33 -23.774   1.016   5.246
  249    HA   PHE  33           HA       PHE  33 -22.959  -1.622   4.614
  250    HB2  PHE  33           HB2      PHE  33 -22.509   1.050   3.389
  251    HB3  PHE  33           HB1      PHE  33 -21.450  -0.252   2.916
  252    HD1  PHE  33           HD1      PHE  33 -23.322   1.255   1.091
  253    HD2  PHE  33           HD2      PHE  33 -23.833  -2.320   3.350
  254    HE1  PHE  33           HE1      PHE  33 -25.050   0.500  -0.494
  255    HE2  PHE  33           HE2      PHE  33 -25.553  -3.082   1.767
  256    HZ   PHE  33           HZ       PHE  33 -26.083  -1.692  -0.237
  257    H    LYS  34           HN       LYS  34 -21.462   0.832   6.519
  258    HA   LYS  34           HA       LYS  34 -18.798  -0.083   6.141
  259    HB2  LYS  34           HB2      LYS  34 -20.114   1.676   8.195
  260    HB3  LYS  34           HB1      LYS  34 -18.421   1.283   8.296
  261    HG2  LYS  34           HG2      LYS  34 -18.341   2.139   5.844
  262    HG3  LYS  34           HG1      LYS  34 -19.859   2.935   6.277
  263    HD2  LYS  34           HD2      LYS  34 -18.114   4.514   6.674
  264    HD3  LYS  34           HD1      LYS  34 -18.693   3.939   8.237
  265    HE2  LYS  34           HE2      LYS  34 -16.826   2.510   8.515
  266    HE3  LYS  34           HE1      LYS  34 -16.319   2.744   6.844
  267    HZ1  LYS  34           HZ1      LYS  34 -15.935   5.109   7.373
  268    HZ2  LYS  34           HZ2      LYS  34 -14.928   4.058   8.245
  269    HZ3  LYS  34           HZ3      LYS  34 -16.265   4.780   9.004
  270    H    GLN  35           HN       GLN  35 -21.286  -0.642   8.611
  271    HA   GLN  35           HA       GLN  35 -19.811  -2.506  10.124
  272    HB2  GLN  35           HB2      GLN  35 -21.919  -1.443  10.909
  273    HB3  GLN  35           HB1      GLN  35 -22.818  -2.367   9.719
  274    HG2  GLN  35           HG2      GLN  35 -23.074  -3.430  11.834
  275    HG3  GLN  35           HG1      GLN  35 -22.062  -4.450  10.820
  276   HE21  GLN  35          HE21      GLN  35 -22.344  -4.345  13.718
  277   HE22  GLN  35          HE22      GLN  35 -20.756  -4.058  14.351
  278    H    TYR  36           HN       TYR  36 -21.672  -2.704   7.209
  279    HA   TYR  36           HA       TYR  36 -21.856  -5.506   6.929
  280    HB2  TYR  36           HB2      TYR  36 -23.305  -4.242   5.580
  281    HB3  TYR  36           HB1      TYR  36 -22.034  -3.139   5.090
  282    HD1  TYR  36           HD1      TYR  36 -21.191  -3.294   3.007
  283    HD2  TYR  36           HD2      TYR  36 -22.932  -6.761   4.745
  284    HE1  TYR  36           HE1      TYR  36 -20.855  -4.493   0.899
  285    HE2  TYR  36           HE2      TYR  36 -22.601  -7.990   2.636
  286    HH   TYR  36           HH       TYR  36 -22.297  -7.518   0.257
  287    H    ALA  37           HN       ALA  37 -19.607  -3.119   5.558
  288    HA   ALA  37           HA       ALA  37 -17.899  -4.994   4.318
  289    HB1  ALA  37           HB1      ALA  37 -17.263  -2.195   5.270
  290    HB2  ALA  37           HB2      ALA  37 -18.000  -2.604   3.721
  291    HB3  ALA  37           HB3      ALA  37 -16.354  -3.126   4.079
  292    H    ASN  38           HN       ASN  38 -17.950  -3.498   7.493
  293    HA   ASN  38           HA       ASN  38 -15.450  -4.284   8.468
  294    HB2  ASN  38           HB2      ASN  38 -16.916  -2.652   9.638
  295    HB3  ASN  38           HB1      ASN  38 -18.037  -3.955  10.025
  296   HD21  ASN  38          HD21      ASN  38 -17.569  -5.376  11.673
  297   HD22  ASN  38          HD22      ASN  38 -16.210  -5.139  12.788
  298    H    ASP  39           HN       ASP  39 -18.554  -5.997   8.544
  299    HA   ASP  39           HA       ASP  39 -17.755  -8.184  10.105
  300    HB2  ASP  39           HB2      ASP  39 -20.103  -7.747   9.629
  301    HB3  ASP  39           HB1      ASP  39 -19.846  -8.060   7.915
  302    H    ASN  40           HN       ASN  40 -17.077  -7.399   6.813
  303    HA   ASN  40           HA       ASN  40 -16.098 -10.126   6.317
  304    HB2  ASN  40           HB2      ASN  40 -16.882  -7.912   4.435
  305    HB3  ASN  40           HB1      ASN  40 -15.894  -9.272   3.904
  306   HD21  ASN  40          HD21      ASN  40 -19.048  -8.207   4.866
  307   HD22  ASN  40          HD22      ASN  40 -19.884  -9.716   4.495
  308    H    GLY  41           HN       GLY  41 -14.964  -7.335   7.522
  309    HA2  GLY  41           HA2      GLY  41 -12.806  -6.688   7.994
  310    HA3  GLY  41           HA1      GLY  41 -12.244  -8.106   7.124
  311    H    VAL  42           HN       VAL  42 -14.316  -5.718   5.616
  312    HA   VAL  42           HA       VAL  42 -12.055  -4.937   3.925
  313    HB   VAL  42           HB       VAL  42 -15.028  -4.914   3.315
  314   HG11  VAL  42          HG11      VAL  42 -12.683  -4.233   1.528
  315   HG12  VAL  42          HG12      VAL  42 -13.794  -3.060   2.238
  316   HG13  VAL  42          HG13      VAL  42 -14.387  -4.240   1.066
  317   HG21  VAL  42          HG21      VAL  42 -14.409  -6.653   1.669
  318   HG22  VAL  42          HG22      VAL  42 -14.093  -7.149   3.332
  319   HG23  VAL  42          HG23      VAL  42 -12.761  -6.627   2.300
  320    H    ASP  43           HN       ASP  43 -11.284  -3.002   4.281
  321    HA   ASP  43           HA       ASP  43 -13.031  -0.751   4.726
  322    HB2  ASP  43           HB2      ASP  43 -12.583  -1.595   7.059
  323    HB3  ASP  43           HB1      ASP  43 -10.867  -1.321   6.771
  324    H    GLY  44           HN       GLY  44 -12.178   1.038   3.734
  325    HA2  GLY  44           HA2      GLY  44  -9.417   1.478   3.297
  326    HA3  GLY  44           HA1      GLY  44 -10.160   0.752   1.875
  327    H    GLU  45           HN       GLU  45  -9.448   2.901   0.970
  328    HA   GLU  45           HA       GLU  45 -10.554   5.358   1.692
  329    HB2  GLU  45           HB2      GLU  45  -9.814   4.269  -1.036
  330    HB3  GLU  45           HB1      GLU  45 -10.292   5.939  -0.762
  331    HG2  GLU  45           HG2      GLU  45  -7.955   4.629   0.612
  332    HG3  GLU  45           HG1      GLU  45  -7.842   5.541  -0.891
  333    H    TRP  46           HN       TRP  46 -12.472   6.264   1.492
  334    HA   TRP  46           HA       TRP  46 -14.616   4.643   0.289
  335    HB2  TRP  46           HB2      TRP  46 -14.536   6.256   2.791
  336    HB3  TRP  46           HB1      TRP  46 -16.023   6.327   1.871
  337    HD1  TRP  46           HD1      TRP  46 -13.688   3.672   3.464
  338    HE1  TRP  46           HE1      TRP  46 -15.115   1.678   4.238
  339    HE3  TRP  46           HE3      TRP  46 -18.306   5.195   1.746
  340    HZ2  TRP  46           HZ2      TRP  46 -17.800   0.866   4.154
  341    HZ3  TRP  46           HZ3      TRP  46 -20.234   3.741   2.171
  342    HH2  TRP  46           HH2      TRP  46 -19.984   1.619   3.336
  343    H    THR  47           HN       THR  47 -15.245   5.407  -1.598
  344    HA   THR  47           HA       THR  47 -15.421   8.327  -1.929
  345    HB   THR  47           HB       THR  47 -15.014   7.751  -4.432
  346    HG1  THR  47           HG1      THR  47 -13.545   5.597  -3.325
  347   HG21  THR  47          HG21      THR  47 -13.462   9.073  -3.114
  348   HG22  THR  47          HG22      THR  47 -12.568   7.931  -4.119
  349   HG23  THR  47          HG23      THR  47 -12.787   7.611  -2.398
  350    H    TYR  48           HN       TYR  48 -17.073   9.041  -3.482
  351    HA   TYR  48           HA       TYR  48 -19.172   7.065  -4.008
  352    HB2  TYR  48           HB2      TYR  48 -19.871   8.030  -1.946
  353    HB3  TYR  48           HB1      TYR  48 -19.488   9.635  -2.469
  354    HD1  TYR  48           HD1      TYR  48 -21.733   6.779  -3.318
  355    HD2  TYR  48           HD2      TYR  48 -21.232  11.009  -3.220
  356    HE1  TYR  48           HE1      TYR  48 -24.070   7.072  -4.016
  357    HE2  TYR  48           HE2      TYR  48 -23.561  11.305  -3.917
  358    HH   TYR  48           HH       TYR  48 -25.803   8.664  -4.016
  359    H    ASP  49           HN       ASP  49 -20.651   7.661  -5.665
  360    HA   ASP  49           HA       ASP  49 -19.828   9.985  -7.302
  361    HB2  ASP  49           HB2      ASP  49 -18.973   7.611  -8.114
  362    HB3  ASP  49           HB1      ASP  49 -20.626   7.448  -8.706
  363    H    ASP  50           HN       ASP  50 -21.615  11.270  -7.520
  364    HA   ASP  50           HA       ASP  50 -24.184  10.478  -6.594
  365    HB2  ASP  50           HB2      ASP  50 -23.342  12.817  -8.340
  366    HB3  ASP  50           HB1      ASP  50 -24.934  12.654  -7.604
  367    H    ALA  51           HN       ALA  51 -22.765  10.651  -9.793
  368    HA   ALA  51           HA       ALA  51 -25.076  10.391 -11.337
  369    HB1  ALA  51           HB1      ALA  51 -22.325   9.366 -12.012
  370    HB2  ALA  51           HB2      ALA  51 -22.853  11.039 -12.194
  371    HB3  ALA  51           HB3      ALA  51 -23.616   9.765 -13.146
  372    H    THR  52           HN       THR  52 -23.502   8.024  -9.388
  373    HA   THR  52           HA       THR  52 -25.189   5.981 -10.654
  374    HB   THR  52           HB       THR  52 -22.954   5.593 -11.541
  375    HG1  THR  52           HG1      THR  52 -23.471   3.496  -9.705
  376   HG21  THR  52          HG21      THR  52 -22.252   5.431  -8.645
  377   HG22  THR  52          HG22      THR  52 -21.465   6.358  -9.923
  378   HG23  THR  52          HG23      THR  52 -21.287   4.608  -9.866
  379    H    LYS  53           HN       LYS  53 -24.860   7.534  -7.848
  380    HA   LYS  53           HA       LYS  53 -25.060   7.054  -5.589
  381    HB2  LYS  53           HB2      LYS  53 -27.155   5.461  -7.003
  382    HB3  LYS  53           HB1      LYS  53 -26.960   5.235  -5.274
  383    HG2  LYS  53           HG2      LYS  53 -28.686   6.834  -5.680
  384    HG3  LYS  53           HG1      LYS  53 -27.292   7.667  -4.989
  385    HD2  LYS  53           HD2      LYS  53 -28.304   8.892  -6.850
  386    HD3  LYS  53           HD1      LYS  53 -26.633   8.459  -7.173
  387    HE2  LYS  53           HE2      LYS  53 -27.361   6.620  -8.570
  388    HE3  LYS  53           HE1      LYS  53 -29.045   6.955  -8.184
  389    HZ1  LYS  53           HZ1      LYS  53 -28.316   7.824 -10.370
  390    HZ2  LYS  53           HZ2      LYS  53 -27.260   8.884  -9.570
  391    HZ3  LYS  53           HZ3      LYS  53 -28.931   9.019  -9.339
  392    H    THR  54           HN       THR  54 -22.900   5.650  -6.720
  393    HA   THR  54           HA       THR  54 -23.044   3.037  -5.378
  394    HB   THR  54           HB       THR  54 -21.161   3.865  -7.608
  395    HG1  THR  54           HG1      THR  54 -23.765   3.243  -7.691
  396   HG21  THR  54          HG21      THR  54 -20.734   1.439  -7.764
  397   HG22  THR  54          HG22      THR  54 -21.857   1.148  -6.432
  398   HG23  THR  54          HG23      THR  54 -20.351   2.027  -6.142
  399    H    TYR  55           HN       TYR  55 -22.020   3.064  -3.480
  400    HA   TYR  55           HA       TYR  55 -19.789   4.844  -3.001
  401    HB2  TYR  55           HB2      TYR  55 -21.311   2.914  -1.248
  402    HB3  TYR  55           HB1      TYR  55 -19.680   3.397  -0.792
  403    HD1  TYR  55           HD1      TYR  55 -19.139   5.749  -0.327
  404    HD2  TYR  55           HD2      TYR  55 -23.148   4.480  -1.016
  405    HE1  TYR  55           HE1      TYR  55 -19.964   7.833   0.680
  406    HE2  TYR  55           HE2      TYR  55 -23.979   6.564  -0.010
  407    HH   TYR  55           HH       TYR  55 -22.048   9.245   0.519
  408    H    THR  56           HN       THR  56 -17.677   4.315  -2.953
  409    HA   THR  56           HA       THR  56 -17.048   1.546  -3.689
  410    HB   THR  56           HB       THR  56 -14.882   2.956  -4.611
  411    HG1  THR  56           HG1      THR  56 -15.532   4.991  -4.542
  412   HG21  THR  56          HG21      THR  56 -15.899   2.740  -6.869
  413   HG22  THR  56          HG22      THR  56 -17.440   2.333  -6.117
  414   HG23  THR  56          HG23      THR  56 -16.048   1.264  -5.915
  415    H    VAL  57           HN       VAL  57 -15.838   0.476  -2.324
  416    HA   VAL  57           HA       VAL  57 -14.008   1.976  -0.575
  417    HB   VAL  57           HB       VAL  57 -15.817   0.893   0.797
  418   HG11  VAL  57          HG11      VAL  57 -14.691  -1.678  -0.299
  419   HG12  VAL  57          HG12      VAL  57 -16.344  -1.082  -0.470
  420   HG13  VAL  57          HG13      VAL  57 -15.742  -1.576   1.109
  421   HG21  VAL  57          HG21      VAL  57 -13.654   1.315   1.775
  422   HG22  VAL  57          HG22      VAL  57 -13.046  -0.220   1.157
  423   HG23  VAL  57          HG23      VAL  57 -14.304  -0.206   2.391
  424    H    THR  58           HN       THR  58 -11.965   1.593  -1.073
  425    HA   THR  58           HA       THR  58 -11.389  -0.867  -2.594
  426    HB   THR  58           HB       THR  58 -10.019   1.764  -3.126
  427    HG1  THR  58           HG1      THR  58 -12.556   1.304  -3.514
  428   HG21  THR  58          HG21      THR  58 -10.430  -0.703  -4.838
  429   HG22  THR  58          HG22      THR  58  -8.945  -0.303  -3.971
  430   HG23  THR  58          HG23      THR  58  -9.507   0.735  -5.279
  431    H    GLU  59           HN       GLU  59 -10.065  -2.102  -1.570
  432    HA   GLU  59           HA       GLU  59  -8.281  -1.254   0.473
  433    HB2  GLU  59           HB2      GLU  59  -8.518  -3.869  -1.021
  434    HB3  GLU  59           HB1      GLU  59  -7.309  -3.611   0.192
  435    HG2  GLU  59           HG2      GLU  59  -9.449  -4.797   0.881
  436    HG3  GLU  59           HG1      GLU  59  -8.834  -3.520   1.921
  437    H    GLY  60           HN       GLY  60  -5.907  -1.424   0.424
  438    HA2  GLY  60           HA2      GLY  60  -4.869  -0.083  -1.902
  439    HA3  GLY  60           HA1      GLY  60  -3.970  -0.546  -0.463
  440    H    SER  61           HN       SER  61  -2.302  -1.034  -2.041
  441    HA   SER  61           HA       SER  61  -2.716  -3.314  -3.792
  442    HB2  SER  61           HB2      SER  61  -1.384  -1.246  -4.419
  443    HB3  SER  61           HB1      SER  61  -0.157  -1.785  -3.274
  444    HG   SER  61           HG       SER  61   0.416  -2.531  -5.278
  445    H    GLY  62           HN       GLY  62  -0.360  -4.640  -3.751
  446    HA2  GLY  62           HA2      GLY  62  -0.015  -5.571  -0.986
  447    HA3  GLY  62           HA1      GLY  62  -0.407  -6.743  -2.240
  448    H    GLY  63           HN       GLY  63   1.902  -7.115  -0.833
  449    HA2  GLY  63           HA2      GLY  63   3.993  -6.084  -2.637
  450    HA3  GLY  63           HA1      GLY  63   4.255  -6.482  -0.947
  451    H    ALA  64           HN       ALA  64   2.322  -8.608  -2.920
  452    HA   ALA  64           HA       ALA  64   4.642 -10.395  -3.236
  453    HB1  ALA  64           HB1      ALA  64   3.342 -11.122  -1.283
  454    HB2  ALA  64           HB2      ALA  64   3.278 -12.312  -2.584
  455    HB3  ALA  64           HB3      ALA  64   1.903 -11.249  -2.293
  456    H    GLY  65           HN       GLY  65   1.202 -10.856  -3.985
  457    HA2  GLY  65           HA2      GLY  65   0.104 -10.733  -6.029
  458    HA3  GLY  65           HA1      GLY  65   1.622 -10.311  -6.803
  459    H    GLY  66           HN       GLY  66   3.259 -12.208  -6.801
  460    HA2  GLY  66           HA2      GLY  66   2.050 -14.265  -8.345
  461    HA3  GLY  66           HA1      GLY  66   3.734 -14.196  -7.859
  462    H    GLN  67           HN       GLN  67   3.380 -14.247  -5.062
  463    HA   GLN  67           HA       GLN  67   1.907 -16.712  -4.527
  464    HB2  GLN  67           HB2      GLN  67   4.211 -17.378  -5.146
  465    HB3  GLN  67           HB1      GLN  67   4.849 -16.338  -3.848
  466    HG2  GLN  67           HG2      GLN  67   3.816 -17.718  -2.181
  467    HG3  GLN  67           HG1      GLN  67   2.992 -18.679  -3.408
  468   HE21  GLN  67          HE21      GLN  67   3.940 -20.606  -2.709
  469   HE22  GLN  67          HE22      GLN  67   5.616 -20.955  -2.986
  470    H    GLY  68           HN       GLY  68   0.728 -16.427  -2.764
  471    HA2  GLY  68           HA2      GLY  68   1.209 -14.088  -1.116
  472    HA3  GLY  68           HA1      GLY  68  -0.210 -15.118  -1.078
  473    H    MET  69           HN       MET  69   0.190 -14.717   1.266
  474    HA   MET  69           HA       MET  69   1.276 -16.985   2.553
  475    HB2  MET  69           HB2      MET  69   3.356 -15.531   1.961
  476    HB3  MET  69           HB1      MET  69   2.759 -14.425   3.189
  477    HG2  MET  69           HG2      MET  69   2.830 -16.321   4.817
  478    HG3  MET  69           HG1      MET  69   3.633 -17.279   3.575
  479    HE1  MET  69           HE1      MET  69   3.917 -14.247   6.051
  480    HE2  MET  69           HE2      MET  69   4.022 -13.443   4.486
  481    HE3  MET  69           HE3      MET  69   5.432 -13.503   5.545
  482    H    ILE  70           HN       ILE  70   1.758 -15.509   5.061
  483    HA   ILE  70           HA       ILE  70   0.790 -14.325   6.723
  484    HB   ILE  70           HB       ILE  70  -1.242 -13.499   4.644
  485   HG12  ILE  70          HG12      ILE  70   1.089 -12.015   5.893
  486   HG13  ILE  70          HG11      ILE  70   1.021 -12.644   4.251
  487   HG21  ILE  70          HG21      ILE  70  -0.910 -12.411   7.463
  488   HG22  ILE  70          HG22      ILE  70  -2.248 -13.420   6.912
  489   HG23  ILE  70          HG23      ILE  70  -2.025 -11.804   6.240
  490   HD11  ILE  70          HD11      ILE  70   0.638 -10.254   4.274
  491   HD12  ILE  70          HD12      ILE  70  -0.721 -10.463   5.381
  492   HD13  ILE  70          HD13      ILE  70  -0.809 -11.111   3.745
  493    H    GLN  71           HN       GLN  71   0.466 -16.384   7.653
  494    HA   GLN  71           HA       GLN  71  -2.387 -16.930   8.105
  495    HB2  GLN  71           HB2      GLN  71  -1.054 -18.800   6.900
  496    HB3  GLN  71           HB1      GLN  71  -0.213 -19.017   8.430
  497    HG2  GLN  71           HG2      GLN  71  -2.342 -19.470   9.536
  498    HG3  GLN  71           HG1      GLN  71  -3.180 -19.263   8.003
  499   HE21  GLN  71          HE21      GLN  71  -1.049 -20.593   6.497
  500   HE22  GLN  71          HE22      GLN  71  -1.228 -22.277   6.829
  501    H    GLU  72           HN       GLU  72  -0.551 -15.070   9.160
  502    HA   GLU  72           HA       GLU  72  -0.010 -16.025  11.880
  503    HB2  GLU  72           HB2      GLU  72   1.691 -14.143  11.959
  504    HB3  GLU  72           HB1      GLU  72   2.107 -15.507  10.936
  505    HG2  GLU  72           HG2      GLU  72   1.523 -14.277   8.962
  506    HG3  GLU  72           HG1      GLU  72   0.904 -12.934   9.919
  507    HA   PRO  73           HA       PRO  73  -2.817 -12.876  13.220
  508    HB2  PRO  73           HB2      PRO  73  -1.944 -12.271  15.690
  509    HB3  PRO  73           HB1      PRO  73  -2.525 -13.950  15.318
  510    HG2  PRO  73           HG2      PRO  73   0.278 -12.857  15.302
  511    HG3  PRO  73           HG1      PRO  73  -0.332 -14.286  16.167
  512    HD2  PRO  73           HD2      PRO  73   0.920 -14.503  13.785
  513    HD3  PRO  73           HD1      PRO  73  -0.473 -15.560  14.203
  514    H    ALA  74           HN       ALA  74  -3.060 -10.671  13.470
  515    HA   ALA  74           HA       ALA  74  -0.925  -8.814  13.680
  516    HB1  ALA  74           HB1      ALA  74  -2.124  -9.224  10.932
  517    HB2  ALA  74           HB2      ALA  74  -0.444  -9.491  11.398
  518    HB3  ALA  74           HB3      ALA  74  -1.111  -7.859  11.397
  519    H    LEU  75           HN       LEU  75  -1.845  -6.540  12.974
  520    HA   LEU  75           HA       LEU  75  -4.507  -6.400  14.162
  521    HB2  LEU  75           HB2      LEU  75  -2.440  -4.265  13.641
  522    HB3  LEU  75           HB1      LEU  75  -4.039  -3.928  14.259
  523    HG   LEU  75           HG       LEU  75  -2.592  -3.877  16.106
  524   HD11  LEU  75          HD11      LEU  75  -4.681  -5.030  16.540
  525   HD12  LEU  75          HD12      LEU  75  -3.380  -5.708  17.517
  526   HD13  LEU  75          HD13      LEU  75  -3.944  -6.567  16.085
  527   HD21  LEU  75          HD21      LEU  75  -0.676  -5.031  15.093
  528   HD22  LEU  75          HD22      LEU  75  -1.512  -6.574  15.294
  529   HD23  LEU  75          HD23      LEU  75  -1.038  -5.634  16.710
  530    HA   PRO  76           HA       PRO  76  -6.345  -5.638  10.140
  531    HB2  PRO  76           HB2      PRO  76  -8.368  -4.017  11.614
  532    HB3  PRO  76           HB1      PRO  76  -8.640  -5.445  10.611
  533    HG2  PRO  76           HG2      PRO  76  -8.897  -5.589  13.249
  534    HG3  PRO  76           HG1      PRO  76  -8.089  -6.919  12.329
  535    HD2  PRO  76           HD2      PRO  76  -6.793  -4.658  13.903
  536    HD3  PRO  76           HD1      PRO  76  -6.437  -6.397  13.932
  537    HA   PRO  77           HA       PRO  77  -4.948  -1.612   8.953
  538    HB2  PRO  77           HB2      PRO  77  -6.828  -0.737   7.191
  539    HB3  PRO  77           HB1      PRO  77  -5.649  -1.996   6.784
  540    HG2  PRO  77           HG2      PRO  77  -8.462  -2.281   7.771
  541    HG3  PRO  77           HG1      PRO  77  -7.705  -3.074   6.367
  542    HD2  PRO  77           HD2      PRO  77  -7.926  -4.424   8.669
  543    HD3  PRO  77           HD1      PRO  77  -6.392  -4.506   7.723
  544    H    GLY  78           HN       GLY  78  -5.022   0.189  10.104
  545    HA2  GLY  78           HA2      GLY  78  -6.060   2.116  10.989
  546    HA3  GLY  78           HA1      GLY  78  -7.607   1.288  10.917
  547    H    TRP  79           HN       TRP  79  -6.365  -1.124  12.320
  548    HA   TRP  79           HA       TRP  79  -6.768  -0.020  15.009
  549    HB2  TRP  79           HB2      TRP  79  -6.644  -2.871  13.988
  550    HB3  TRP  79           HB1      TRP  79  -6.752  -2.470  15.696
  551    HD1  TRP  79           HD1      TRP  79  -8.816  -2.262  12.452
  552    HE1  TRP  79           HE1      TRP  79 -11.300  -2.041  13.085
  553    HE3  TRP  79           HE3      TRP  79  -8.345  -1.754  17.537
  554    HZ2  TRP  79           HZ2      TRP  79 -12.853  -1.703  15.414
  555    HZ3  TRP  79           HZ3      TRP  79 -10.378  -1.484  18.879
  556    HH2  TRP  79           HH2      TRP  79 -12.584  -1.458  17.846
  557    H    GLU  80           HN       GLU  80  -5.231  -0.017  16.641
  558    HA   GLU  80           HA       GLU  80  -2.659  -1.337  16.105
  559    HB2  GLU  80           HB2      GLU  80  -3.173   1.441  17.109
  560    HB3  GLU  80           HB1      GLU  80  -1.733   0.581  17.632
  561    HG2  GLU  80           HG2      GLU  80  -1.240   0.238  15.161
  562    HG3  GLU  80           HG1      GLU  80  -2.494   1.441  14.862
  563    H    MET  81           HN       MET  81  -1.605  -2.197  17.946
  564    HA   MET  81           HA       MET  81  -3.309  -2.401  20.340
  565    HB2  MET  81           HB2      MET  81  -3.225  -4.470  18.851
  566    HB3  MET  81           HB1      MET  81  -1.508  -4.606  19.306
  567    HG2  MET  81           HG2      MET  81  -3.761  -4.558  21.301
  568    HG3  MET  81           HG1      MET  81  -3.117  -6.038  20.596
  569    HE1  MET  81           HE1      MET  81  -3.357  -5.361  23.683
  570    HE2  MET  81           HE2      MET  81  -1.817  -5.952  24.311
  571    HE3  MET  81           HE3      MET  81  -2.707  -6.897  23.114
  572    H    LYS  82           HN       LYS  82  -2.273  -2.018  22.279
  573    HA   LYS  82           HA       LYS  82   0.617  -2.050  22.441
  574    HB2  LYS  82           HB2      LYS  82  -0.869   0.563  22.857
  575    HB3  LYS  82           HB1      LYS  82   0.837   0.309  23.142
  576    HG2  LYS  82           HG2      LYS  82   1.258   0.019  20.808
  577    HG3  LYS  82           HG1      LYS  82  -0.494   0.049  20.450
  578    HD2  LYS  82           HD2      LYS  82  -0.494   2.372  21.498
  579    HD3  LYS  82           HD1      LYS  82   1.266   2.298  21.416
  580    HE2  LYS  82           HE2      LYS  82  -0.577   1.962  19.053
  581    HE3  LYS  82           HE1      LYS  82   0.220   3.470  19.492
  582    HZ1  LYS  82           HZ1      LYS  82   1.734   0.980  18.942
  583    HZ2  LYS  82           HZ2      LYS  82   2.318   2.570  19.007
  584    HZ3  LYS  82           HZ3      LYS  82   1.320   2.084  17.721
  585    H    TYR  83           HN       TYR  83   1.358  -1.793  24.675
  586    HA   TYR  83           HA       TYR  83  -0.780  -2.379  26.644
  587    HB2  TYR  83           HB2      TYR  83   2.125  -3.270  26.523
  588    HB3  TYR  83           HB1      TYR  83   1.168  -3.369  28.020
  589    HD1  TYR  83           HD1      TYR  83   1.677  -4.728  24.655
  590    HD2  TYR  83           HD2      TYR  83  -0.570  -5.040  28.257
  591    HE1  TYR  83           HE1      TYR  83   0.815  -6.908  23.917
  592    HE2  TYR  83           HE2      TYR  83  -1.438  -7.225  27.530
  593    HH   TYR  83           HH       TYR  83  -0.248  -8.804  24.608
  594    H    THR  84           HN       THR  84  -0.639  -1.376  28.715
  595    HA   THR  84           HA       THR  84   0.950   1.072  28.796
  596    HB   THR  84           HB       THR  84  -0.286   1.733  30.718
  597    HG1  THR  84           HG1      THR  84  -1.335   0.325  32.052
  598   HG21  THR  84          HG21      THR  84  -2.647   1.423  30.118
  599   HG22  THR  84          HG22      THR  84  -2.188   0.153  28.985
  600   HG23  THR  84          HG23      THR  84  -1.655   1.810  28.713
  601    H    SER  85           HN       SER  85   2.202   1.445  30.966
  602    HA   SER  85           HA       SER  85   4.056  -0.730  31.201
  603    HB2  SER  85           HB2      SER  85   5.168   0.848  32.858
  604    HB3  SER  85           HB1      SER  85   4.950   1.482  31.230
  605    HG   SER  85           HG       SER  85   3.338   2.015  33.503
  606    H    GLU  86           HN       GLU  86   1.183  -0.860  32.303
  607    HA   GLU  86           HA       GLU  86   1.879  -1.783  35.043
  608    HB2  GLU  86           HB2      GLU  86  -0.773  -0.611  34.112
  609    HB3  GLU  86           HB1      GLU  86  -0.359  -1.071  35.758
  610    HG2  GLU  86           HG2      GLU  86   1.231   0.694  35.928
  611    HG3  GLU  86           HG1      GLU  86   1.079   1.073  34.214
  612    H    GLY  87           HN       GLY  87   1.252  -2.789  32.047
  613    HA2  GLY  87           HA2      GLY  87   0.786  -4.930  31.304
  614    HA3  GLY  87           HA1      GLY  87   0.257  -5.349  32.925
  615    H    VAL  88           HN       VAL  88  -1.170  -2.512  31.658
  616    HA   VAL  88           HA       VAL  88  -3.719  -3.900  31.451
  617    HB   VAL  88           HB       VAL  88  -3.124  -0.937  31.305
  618   HG11  VAL  88          HG11      VAL  88  -5.187  -1.418  30.155
  619   HG12  VAL  88          HG12      VAL  88  -5.562  -0.695  31.720
  620   HG13  VAL  88          HG13      VAL  88  -5.733  -2.435  31.490
  621   HG21  VAL  88          HG21      VAL  88  -2.598  -1.892  33.496
  622   HG22  VAL  88          HG22      VAL  88  -4.209  -2.604  33.573
  623   HG23  VAL  88          HG23      VAL  88  -4.019  -0.852  33.578
  624    H    ARG  89           HN       ARG  89  -4.930  -4.085  29.629
  625    HA   ARG  89           HA       ARG  89  -3.458  -3.776  27.119
  626    HB2  ARG  89           HB2      ARG  89  -4.513  -5.970  27.930
  627    HB3  ARG  89           HB1      ARG  89  -6.064  -5.235  27.571
  628    HG2  ARG  89           HG2      ARG  89  -5.376  -4.982  25.221
  629    HG3  ARG  89           HG1      ARG  89  -3.854  -5.792  25.601
  630    HD2  ARG  89           HD2      ARG  89  -5.526  -7.620  26.584
  631    HD3  ARG  89           HD1      ARG  89  -6.605  -6.908  25.387
  632    HE   ARG  89           HE       ARG  89  -3.988  -7.647  24.408
  633   HH11  ARG  89          HH11      ARG  89  -7.352  -8.641  24.793
  634   HH12  ARG  89          HH12      ARG  89  -7.204  -9.916  23.622
  635   HH21  ARG  89          HH21      ARG  89  -3.841  -9.340  22.889
  636   HH22  ARG  89          HH22      ARG  89  -5.247 -10.321  22.563
  637    H    TYR  90           HN       TYR  90  -3.902  -1.973  25.908
  638    HA   TYR  90           HA       TYR  90  -6.708  -1.119  25.829
  639    HB2  TYR  90           HB2      TYR  90  -6.199   1.202  25.863
  640    HB3  TYR  90           HB1      TYR  90  -5.336   0.496  27.206
  641    HD1  TYR  90           HD1      TYR  90  -5.083   2.411  24.184
  642    HD2  TYR  90           HD2      TYR  90  -2.840   0.140  26.995
  643    HE1  TYR  90           HE1      TYR  90  -3.022   3.516  23.418
  644    HE2  TYR  90           HE2      TYR  90  -0.776   1.230  26.239
  645    HH   TYR  90           HH       TYR  90  -0.816   3.898  23.956
  646    H    PHE  91           HN       PHE  91  -7.277   0.031  23.761
  647    HA   PHE  91           HA       PHE  91  -5.476  -0.788  21.591
  648    HB2  PHE  91           HB2      PHE  91  -8.466  -1.127  21.782
  649    HB3  PHE  91           HB1      PHE  91  -7.636  -1.089  20.241
  650    HD1  PHE  91           HD1      PHE  91  -6.799  -3.004  19.325
  651    HD2  PHE  91           HD2      PHE  91  -7.577  -2.916  23.514
  652    HE1  PHE  91           HE1      PHE  91  -6.288  -5.404  19.470
  653    HE2  PHE  91           HE2      PHE  91  -7.063  -5.306  23.660
  654    HZ   PHE  91           HZ       PHE  91  -6.418  -6.559  21.640
  655    H    VAL  92           HN       VAL  92  -5.789   0.442  19.573
  656    HA   VAL  92           HA       VAL  92  -6.762   3.176  20.100
  657    HB   VAL  92           HB       VAL  92  -4.228   2.477  18.604
  658   HG11  VAL  92          HG11      VAL  92  -3.837   4.884  18.561
  659   HG12  VAL  92          HG12      VAL  92  -5.388   5.158  19.356
  660   HG13  VAL  92          HG13      VAL  92  -5.338   4.465  17.735
  661   HG21  VAL  92          HG21      VAL  92  -4.558   3.738  21.319
  662   HG22  VAL  92          HG22      VAL  92  -3.031   3.512  20.468
  663   HG23  VAL  92          HG23      VAL  92  -3.966   2.112  21.003
  664    H    ASP  93           HN       ASP  93  -8.180   3.846  18.618
  665    HA   ASP  93           HA       ASP  93  -8.395   2.454  16.034
  666    HB2  ASP  93           HB2      ASP  93 -10.188   4.212  17.654
  667    HB3  ASP  93           HB1      ASP  93 -10.172   4.576  15.930
  668    H    HIS  94           HN       HIS  94  -6.788   3.175  14.599
  669    HA   HIS  94           HA       HIS  94  -5.592   5.761  14.915
  670    HB2  HIS  94           HB2      HIS  94  -4.525   3.565  13.965
  671    HB3  HIS  94           HB1      HIS  94  -5.233   4.089  12.444
  672    HD1  HIS  94           HD1      HIS  94  -4.082   6.009  11.190
  673    HD2  HIS  94           HD2      HIS  94  -2.422   5.252  14.941
  674    HE1  HIS  94           HE1      HIS  94  -1.939   7.314  11.274
  675    HE2  HIS  94           HE2      HIS  94  -0.995   6.911  13.574
  676    H    ASN  95           HN       ASN  95  -8.374   4.681  13.342
  677    HA   ASN  95           HA       ASN  95  -8.352   6.591  11.191
  678    HB2  ASN  95           HB2      ASN  95 -10.753   5.883  10.891
  679    HB3  ASN  95           HB1      ASN  95  -9.607   4.547  10.849
  680   HD21  ASN  95          HD21      ASN  95  -9.702   2.979  12.385
  681   HD22  ASN  95          HD22      ASN  95 -10.930   2.901  13.611
  682    H    THR  96           HN       THR  96 -10.072   6.309  14.306
  683    HA   THR  96           HA       THR  96 -11.008   9.046  14.033
  684    HB   THR  96           HB       THR  96 -12.069   8.575  16.307
  685    HG1  THR  96           HG1      THR  96 -11.921   5.849  15.813
  686   HG21  THR  96          HG21      THR  96 -13.360   8.519  14.236
  687   HG22  THR  96          HG22      THR  96 -13.897   7.257  15.340
  688   HG23  THR  96          HG23      THR  96 -12.873   6.844  13.965
  689    H    ARG  97           HN       ARG  97  -8.460   7.293  15.458
  690    HA   ARG  97           HA       ARG  97  -6.563   7.946  16.543
  691    HB2  ARG  97           HB2      ARG  97  -7.626  10.753  16.142
  692    HB3  ARG  97           HB1      ARG  97  -5.987  10.339  16.652
  693    HG2  ARG  97           HG2      ARG  97  -5.542   9.256  14.569
  694    HG3  ARG  97           HG1      ARG  97  -7.227   9.405  14.088
  695    HD2  ARG  97           HD2      ARG  97  -6.938  11.884  14.125
  696    HD3  ARG  97           HD1      ARG  97  -5.219  11.616  14.416
  697    HE   ARG  97           HE       ARG  97  -6.220  10.218  12.119
  698   HH11  ARG  97          HH11      ARG  97  -4.868  13.226  13.287
  699   HH12  ARG  97          HH12      ARG  97  -4.374  13.754  11.702
  700   HH21  ARG  97          HH21      ARG  97  -5.518  10.893  10.048
  701   HH22  ARG  97          HH22      ARG  97  -4.693  12.413   9.876
  702    H    THR  98           HN       THR  98  -8.715   7.070  17.835
  703    HA   THR  98           HA       THR  98  -8.794   8.601  20.359
  704    HB   THR  98           HB       THR  98 -10.922   7.268  20.796
  705    HG1  THR  98           HG1      THR  98 -11.139   6.807  18.035
  706   HG21  THR  98          HG21      THR  98 -11.017   9.615  20.055
  707   HG22  THR  98          HG22      THR  98 -12.332   8.685  19.333
  708   HG23  THR  98          HG23      THR  98 -10.913   9.092  18.371
  709    H    THR  99           HN       THR  99  -8.748   7.303  22.358
  710    HA   THR  99           HA       THR  99  -7.412   4.688  22.001
  711    HB   THR  99           HB       THR  99  -6.897   5.059  24.533
  712    HG1  THR  99           HG1      THR  99  -8.458   6.911  24.539
  713   HG21  THR  99          HG21      THR  99  -5.668   6.891  22.430
  714   HG22  THR  99          HG22      THR  99  -5.105   5.277  22.856
  715   HG23  THR  99          HG23      THR  99  -4.959   6.598  24.017
  716    H    THR 100           HN       THR 100  -8.566   2.840  22.659
  717    HA   THR 100           HA       THR 100 -10.886   3.275  24.387
  718    HB   THR 100           HB       THR 100 -11.647   3.434  22.001
  719    HG1  THR 100           HG1      THR 100 -13.240   2.812  23.355
  720   HG21  THR 100          HG21      THR 100 -10.820   0.521  21.908
  721   HG22  THR 100          HG22      THR 100 -10.139   1.833  20.945
  722   HG23  THR 100          HG23      THR 100 -11.809   1.333  20.696
  723    H    PHE 101           HN       PHE 101 -11.455   1.526  25.633
  724    HA   PHE 101           HA       PHE 101  -9.631  -0.762  25.549
  725    HB2  PHE 101           HB2      PHE 101 -11.629   0.191  27.631
  726    HB3  PHE 101           HB1      PHE 101 -10.776  -1.401  27.726
  727    HD1  PHE 101           HD1      PHE 101 -10.161   2.286  27.504
  728    HD2  PHE 101           HD2      PHE 101  -8.684  -1.524  28.710
  729    HE1  PHE 101           HE1      PHE 101  -8.252   3.375  28.604
  730    HE2  PHE 101           HE2      PHE 101  -6.768  -0.435  29.814
  731    HZ   PHE 101           HZ       PHE 101  -6.553   2.018  29.758
  732    H    LYS 102           HN       LYS 102 -10.337  -2.050  23.948
  733    HA   LYS 102           HA       LYS 102 -13.031  -3.162  24.169
  734    HB2  LYS 102           HB2      LYS 102 -13.191  -1.365  22.512
  735    HB3  LYS 102           HB1      LYS 102 -11.837  -2.042  21.623
  736    HG2  LYS 102           HG2      LYS 102 -13.191  -4.077  21.206
  737    HG3  LYS 102           HG1      LYS 102 -14.555  -3.275  21.988
  738    HD2  LYS 102           HD2      LYS 102 -13.083  -2.248  19.562
  739    HD3  LYS 102           HD1      LYS 102 -14.632  -3.092  19.530
  740    HE2  LYS 102           HE2      LYS 102 -14.156  -0.536  21.050
  741    HE3  LYS 102           HE1      LYS 102 -14.766  -0.585  19.397
  742    HZ1  LYS 102           HZ1      LYS 102 -16.715  -1.689  20.095
  743    HZ2  LYS 102           HZ2      LYS 102 -16.493  -0.411  21.190
  744    HZ3  LYS 102           HZ3      LYS 102 -16.096  -1.998  21.643
  745    H    ASP 103           HN       ASP 103 -12.491  -5.201  24.625
  746    HA   ASP 103           HA       ASP 103 -10.273  -6.475  23.227
  747    HB2  ASP 103           HB2      ASP 103 -10.736  -6.722  25.746
  748    HB3  ASP 103           HB1      ASP 103 -12.070  -7.770  25.278
  749    HA   PRO 104           HA       PRO 104 -12.881  -8.320  20.162
  750    HB2  PRO 104           HB2      PRO 104 -11.089 -10.676  20.249
  751    HB3  PRO 104           HB1      PRO 104 -11.421  -9.595  18.896
  752    HG2  PRO 104           HG2      PRO 104  -9.074  -9.616  20.273
  753    HG3  PRO 104           HG1      PRO 104  -9.707  -8.176  19.458
  754    HD2  PRO 104           HD2      PRO 104  -9.602  -8.839  22.344
  755    HD3  PRO 104           HD1      PRO 104  -9.608  -7.254  21.546
  756    H    ARG 105           HN       ARG 105 -12.003  -9.963  23.113
  757    HA   ARG 105           HA       ARG 105 -14.018 -12.022  22.738
  758    HB2  ARG 105           HB2      ARG 105 -12.023 -11.381  24.885
  759    HB3  ARG 105           HB1      ARG 105 -13.378 -12.433  25.253
  760    HG2  ARG 105           HG2      ARG 105 -11.384 -13.708  24.723
  761    HG3  ARG 105           HG1      ARG 105 -12.655 -13.997  23.528
  762    HD2  ARG 105           HD2      ARG 105 -10.677 -11.846  22.937
  763    HD3  ARG 105           HD1      ARG 105 -10.109 -13.513  22.818
  764    HE   ARG 105           HE       ARG 105 -12.536 -12.720  21.374
  765   HH11  ARG 105          HH11      ARG 105  -9.164 -13.702  21.335
  766   HH12  ARG 105          HH12      ARG 105  -9.191 -14.137  19.648
  767   HH21  ARG 105          HH21      ARG 105 -12.545 -13.284  19.146
  768   HH22  ARG 105          HH22      ARG 105 -11.088 -13.905  18.423
  769    HA   PRO 106           HA       PRO 106 -17.133  -9.367  24.497
  770    HB2  PRO 106           HB2      PRO 106 -19.083 -11.209  25.008
  771    HB3  PRO 106           HB1      PRO 106 -18.718 -10.603  23.350
  772    HG2  PRO 106           HG2      PRO 106 -17.898 -13.159  24.688
  773    HG3  PRO 106           HG1      PRO 106 -18.416 -12.877  23.015
  774    HD2  PRO 106           HD2      PRO 106 -15.807 -13.175  23.773
  775    HD3  PRO 106           HD1      PRO 106 -16.326 -12.220  22.343
  776    H    GLY 107           HN       GLY 107 -16.875  -8.551  26.475
  777    HA2  GLY 107           HA2      GLY 107 -17.057  -8.399  28.764
  778    HA3  GLY 107           HA1      GLY 107 -17.522 -10.115  28.810
  779    H    PHE 108           HN       PHE 108 -15.048 -10.839  27.282
  780    HA   PHE 108           HA       PHE 108 -13.084 -11.886  27.887
  781    HB2  PHE 108           HB2      PHE 108 -12.474  -9.453  27.365
  782    HB3  PHE 108           HB1      PHE 108 -12.368  -9.227  29.147
  783    HD1  PHE 108           HD1      PHE 108 -10.481  -9.990  30.352
  784    HD2  PHE 108           HD2      PHE 108 -10.940 -11.052  26.253
  785    HE1  PHE 108           HE1      PHE 108  -8.167 -10.811  30.310
  786    HE2  PHE 108           HE2      PHE 108  -8.628 -11.878  26.207
  787    HZ   PHE 108           HZ       PHE 108  -7.247 -11.785  28.268
  788    H    GLU 109           HN       GLU 109 -14.490 -13.096  29.476
  789    HA   GLU 109           HA       GLU 109 -13.002 -13.429  31.838
  790    HB2  GLU 109           HB2      GLU 109 -14.597 -12.866  33.528
  791    HB3  GLU 109           HB1      GLU 109 -14.479 -11.449  32.500
  792    HG2  GLU 109           HG2      GLU 109 -16.595 -11.760  31.621
  793    HG3  GLU 109           HG1      GLU 109 -16.640 -13.466  32.067
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1 -40.002   9.518  -6.398
    2    H2   GLY   1           HT2      GLY   1 -39.317   8.523  -7.581
    3    H3   GLY   1           HT3      GLY   1 -38.328   9.238  -6.403
    4    HA2  GLY   1           HA1      GLY   1 -40.391   7.148  -5.972
    5    HA3  GLY   1           HA2      GLY   1 -38.649   6.933  -5.868
    6    H    SER   2           HN       SER   2 -39.399   6.104  -3.696
    7    HA   SER   2           HA       SER   2 -39.661   8.352  -1.807
    8    HB2  SER   2           HB2      SER   2 -41.574   6.685  -1.901
    9    HB3  SER   2           HB1      SER   2 -40.447   5.483  -1.272
   10    HG   SER   2           HG       SER   2 -40.598   7.912   0.094
   11    H    HIS   3           HN       HIS   3 -38.275   5.126  -2.271
   12    HA   HIS   3           HA       HIS   3 -36.138   5.862  -0.385
   13    HB2  HIS   3           HB2      HIS   3 -37.247   3.177  -1.206
   14    HB3  HIS   3           HB1      HIS   3 -35.645   3.323  -0.492
   15    HD1  HIS   3           HD1      HIS   3 -36.754   1.791   1.426
   16    HD2  HIS   3           HD2      HIS   3 -38.162   5.692   1.159
   17    HE1  HIS   3           HE1      HIS   3 -37.888   2.245   3.619
   18    HE2  HIS   3           HE2      HIS   3 -38.792   4.592   3.422
   19    H    MET   4           HN       MET   4 -33.917   5.461  -1.096
   20    HA   MET   4           HA       MET   4 -33.749   5.441  -4.040
   21    HB2  MET   4           HB2      MET   4 -31.842   6.759  -2.084
   22    HB3  MET   4           HB1      MET   4 -31.687   6.773  -3.830
   23    HG2  MET   4           HG2      MET   4 -33.935   8.013  -2.263
   24    HG3  MET   4           HG1      MET   4 -32.574   8.876  -2.975
   25    HE1  MET   4           HE1      MET   4 -33.210   8.246  -6.813
   26    HE2  MET   4           HE2      MET   4 -32.271   7.215  -5.732
   27    HE3  MET   4           HE3      MET   4 -32.132   8.968  -5.622
   28    H    GLN   5           HN       GLN   5 -32.405   3.990  -5.009
   29    HA   GLN   5           HA       GLN   5 -31.297   1.908  -3.380
   30    HB2  GLN   5           HB2      GLN   5 -32.294   1.387  -5.550
   31    HB3  GLN   5           HB1      GLN   5 -31.105   2.401  -6.358
   32    HG2  GLN   5           HG2      GLN   5 -29.343   0.880  -5.366
   33    HG3  GLN   5           HG1      GLN   5 -30.665  -0.206  -4.940
   34   HE21  GLN   5          HE21      GLN   5 -28.788   1.193  -7.501
   35   HE22  GLN   5          HE22      GLN   5 -29.324   0.086  -8.758
   36    H    TYR   6           HN       TYR   6 -29.374   2.076  -2.404
   37    HA   TYR   6           HA       TYR   6 -27.315   3.707  -3.725
   38    HB2  TYR   6           HB2      TYR   6 -27.597   2.867  -0.807
   39    HB3  TYR   6           HB1      TYR   6 -26.105   3.562  -1.436
   40    HD1  TYR   6           HD1      TYR   6 -25.965   5.916  -1.968
   41    HD2  TYR   6           HD2      TYR   6 -29.669   4.234  -0.686
   42    HE1  TYR   6           HE1      TYR   6 -26.859   8.176  -1.593
   43    HE2  TYR   6           HE2      TYR   6 -30.562   6.494  -0.314
   44    HH   TYR   6           HH       TYR   6 -28.859   9.348  -1.353
   45    H    LYS   7           HN       LYS   7 -25.158   2.831  -3.899
   46    HA   LYS   7           HA       LYS   7 -25.317  -0.099  -4.300
   47    HB2  LYS   7           HB2      LYS   7 -25.384   1.417  -6.411
   48    HB3  LYS   7           HB1      LYS   7 -23.714   1.781  -6.010
   49    HG2  LYS   7           HG2      LYS   7 -23.098  -0.531  -6.323
   50    HG3  LYS   7           HG1      LYS   7 -24.789  -0.974  -6.586
   51    HD2  LYS   7           HD2      LYS   7 -24.831   0.543  -8.550
   52    HD3  LYS   7           HD1      LYS   7 -23.106   0.838  -8.315
   53    HE2  LYS   7           HE2      LYS   7 -24.413  -1.809  -8.922
   54    HE3  LYS   7           HE1      LYS   7 -23.439  -0.845 -10.029
   55    HZ1  LYS   7           HZ1      LYS   7 -22.118  -2.617  -9.108
   56    HZ2  LYS   7           HZ2      LYS   7 -22.503  -2.137  -7.529
   57    HZ3  LYS   7           HZ3      LYS   7 -21.553  -1.137  -8.506
   58    H    LEU   8           HN       LEU   8 -23.572  -1.312  -3.618
   59    HA   LEU   8           HA       LEU   8 -21.159   0.217  -2.846
   60    HB2  LEU   8           HB2      LEU   8 -22.428  -0.768  -0.876
   61    HB3  LEU   8           HB1      LEU   8 -22.060  -2.345  -1.526
   62    HG   LEU   8           HG       LEU   8 -19.614  -1.750  -1.330
   63   HD11  LEU   8          HD11      LEU   8 -19.213   0.004   0.504
   64   HD12  LEU   8          HD12      LEU   8 -20.803   0.630   0.051
   65   HD13  LEU   8          HD13      LEU   8 -19.504   0.566  -1.138
   66   HD21  LEU   8          HD21      LEU   8 -21.458  -2.016   0.998
   67   HD22  LEU   8          HD22      LEU   8 -19.701  -2.039   1.191
   68   HD23  LEU   8          HD23      LEU   8 -20.500  -3.262   0.198
   69    H    ILE   9           HN       ILE   9 -19.195  -0.629  -3.345
   70    HA   ILE   9           HA       ILE   9 -19.112  -3.184  -4.796
   71    HB   ILE   9           HB       ILE   9 -17.712  -0.623  -5.637
   72   HG12  ILE   9          HG12      ILE   9 -19.761  -2.315  -7.143
   73   HG13  ILE   9          HG11      ILE   9 -20.160  -0.788  -6.274
   74   HG21  ILE   9          HG21      ILE   9 -16.260  -2.552  -5.920
   75   HG22  ILE   9          HG22      ILE   9 -16.803  -1.960  -7.491
   76   HG23  ILE   9          HG23      ILE   9 -17.531  -3.408  -6.795
   77   HD11  ILE   9          HD11      ILE   9 -19.906  -0.399  -8.663
   78   HD12  ILE   9          HD12      ILE   9 -18.288  -1.102  -8.641
   79   HD13  ILE   9          HD13      ILE   9 -18.605   0.404  -7.780
   80    H    LEU  10           HN       LEU  10 -17.772  -4.518  -3.724
   81    HA   LEU  10           HA       LEU  10 -15.794  -3.305  -1.940
   82    HB2  LEU  10           HB2      LEU  10 -16.495  -6.230  -2.122
   83    HB3  LEU  10           HB1      LEU  10 -15.450  -5.484  -0.944
   84    HG   LEU  10           HG       LEU  10 -17.401  -5.935   0.218
   85   HD11  LEU  10          HD11      LEU  10 -17.846  -3.100  -0.612
   86   HD12  LEU  10          HD12      LEU  10 -16.596  -3.630   0.524
   87   HD13  LEU  10          HD13      LEU  10 -18.298  -3.875   0.915
   88   HD21  LEU  10          HD21      LEU  10 -19.606  -5.739  -0.523
   89   HD22  LEU  10          HD22      LEU  10 -18.732  -6.361  -1.920
   90   HD23  LEU  10          HD23      LEU  10 -19.164  -4.653  -1.832
   91    H    ASN  11           HN       ASN  11 -13.931  -2.892  -2.850
   92    HA   ASN  11           HA       ASN  11 -12.960  -4.794  -4.887
   93    HB2  ASN  11           HB2      ASN  11 -13.285  -2.282  -5.412
   94    HB3  ASN  11           HB1      ASN  11 -11.874  -2.020  -4.396
   95   HD21  ASN  11          HD21      ASN  11 -12.343  -1.570  -7.250
   96   HD22  ASN  11          HD22      ASN  11 -11.087  -2.424  -8.074
   97    H    GLY  12           HN       GLY  12 -12.257  -6.249  -3.303
   98    HA2  GLY  12           HA2      GLY  12  -9.651  -5.505  -2.195
   99    HA3  GLY  12           HA1      GLY  12 -10.873  -6.125  -1.065
  100    H    LYS  13           HN       LYS  13  -8.285  -7.169  -1.963
  101    HA   LYS  13           HA       LYS  13  -8.382  -9.225  -3.785
  102    HB2  LYS  13           HB2      LYS  13  -6.666  -9.020  -1.296
  103    HB3  LYS  13           HB1      LYS  13  -6.332 -10.049  -2.692
  104    HG2  LYS  13           HG2      LYS  13  -5.975  -8.183  -4.098
  105    HG3  LYS  13           HG1      LYS  13  -6.643  -7.068  -2.909
  106    HD2  LYS  13           HD2      LYS  13  -4.734  -7.648  -1.410
  107    HD3  LYS  13           HD1      LYS  13  -4.041  -8.575  -2.744
  108    HE2  LYS  13           HE2      LYS  13  -3.901  -6.606  -4.118
  109    HE3  LYS  13           HE1      LYS  13  -4.779  -5.660  -2.918
  110    HZ1  LYS  13           HZ1      LYS  13  -2.902  -6.065  -1.375
  111    HZ2  LYS  13           HZ2      LYS  13  -2.483  -5.155  -2.747
  112    HZ3  LYS  13           HZ3      LYS  13  -2.049  -6.793  -2.654
  113    H    THR  14           HN       THR  14  -9.599  -9.250  -0.507
  114    HA   THR  14           HA       THR  14  -9.935 -12.164  -0.675
  115    HB   THR  14           HB       THR  14 -10.692 -10.385   1.651
  116    HG1  THR  14           HG1      THR  14  -8.663 -10.571   2.372
  117   HG21  THR  14          HG21      THR  14 -11.710 -12.626   1.639
  118   HG22  THR  14          HG22      THR  14 -10.525 -12.467   2.937
  119   HG23  THR  14          HG23      THR  14 -10.111 -13.347   1.467
  120    H    LEU  15           HN       LEU  15 -11.836  -9.175  -0.483
  121    HA   LEU  15           HA       LEU  15 -14.216 -10.737  -1.184
  122    HB2  LEU  15           HB2      LEU  15 -13.842  -8.544   0.788
  123    HB3  LEU  15           HB1      LEU  15 -15.340  -8.574  -0.099
  124    HG   LEU  15           HG       LEU  15 -15.765  -9.661   1.941
  125   HD11  LEU  15          HD11      LEU  15 -16.271 -11.960   1.268
  126   HD12  LEU  15          HD12      LEU  15 -15.254 -11.750  -0.159
  127   HD13  LEU  15          HD13      LEU  15 -16.715 -10.782   0.033
  128   HD21  LEU  15          HD21      LEU  15 -14.416 -11.465   2.849
  129   HD22  LEU  15          HD22      LEU  15 -13.428 -10.024   2.610
  130   HD23  LEU  15          HD23      LEU  15 -13.319 -11.367   1.471
  131    H    LYS  16           HN       LYS  16 -14.222 -10.397  -3.375
  132    HA   LYS  16           HA       LYS  16 -14.512  -7.590  -4.233
  133    HB2  LYS  16           HB2      LYS  16 -13.922  -9.959  -6.033
  134    HB3  LYS  16           HB1      LYS  16 -13.940  -8.270  -6.495
  135    HG2  LYS  16           HG2      LYS  16 -11.745  -8.364  -6.278
  136    HG3  LYS  16           HG1      LYS  16 -11.971  -8.372  -4.522
  137    HD2  LYS  16           HD2      LYS  16 -11.989 -10.795  -4.575
  138    HD3  LYS  16           HD1      LYS  16 -11.884 -10.737  -6.331
  139    HE2  LYS  16           HE2      LYS  16  -9.788  -9.556  -4.555
  140    HE3  LYS  16           HE1      LYS  16  -9.722 -11.217  -5.143
  141    HZ1  LYS  16           HZ1      LYS  16  -9.802  -8.778  -6.839
  142    HZ2  LYS  16           HZ2      LYS  16  -9.759 -10.373  -7.408
  143    HZ3  LYS  16           HZ3      LYS  16  -8.439  -9.742  -6.550
  144    H    GLY  17           HN       GLY  17 -16.540  -7.019  -4.683
  145    HA2  GLY  17           HA2      GLY  17 -18.396  -8.466  -6.113
  146    HA3  GLY  17           HA1      GLY  17 -18.679  -8.882  -4.427
  147    H    GLU  18           HN       GLU  18 -20.818  -7.855  -4.987
  148    HA   GLU  18           HA       GLU  18 -20.670  -5.017  -4.279
  149    HB2  GLU  18           HB2      GLU  18 -22.555  -6.052  -6.401
  150    HB3  GLU  18           HB1      GLU  18 -22.313  -4.384  -5.916
  151    HG2  GLU  18           HG2      GLU  18 -20.052  -4.452  -6.869
  152    HG3  GLU  18           HG1      GLU  18 -20.337  -6.115  -7.390
  153    H    THR  19           HN       THR  19 -22.973  -4.196  -3.865
  154    HA   THR  19           HA       THR  19 -25.015  -6.013  -3.149
  155    HB   THR  19           HB       THR  19 -23.492  -6.516  -1.270
  156    HG1  THR  19           HG1      THR  19 -25.330  -6.782  -0.283
  157   HG21  THR  19          HG21      THR  19 -23.121  -4.774   0.476
  158   HG22  THR  19          HG22      THR  19 -23.828  -3.575  -0.608
  159   HG23  THR  19          HG23      THR  19 -22.320  -4.381  -1.050
  160    H    THR  20           HN       THR  20 -26.871  -4.878  -2.226
  161    HA   THR  20           HA       THR  20 -26.759  -1.970  -2.623
  162    HB   THR  20           HB       THR  20 -29.209  -2.351  -3.523
  163    HG1  THR  20           HG1      THR  20 -27.991  -4.758  -4.438
  164   HG21  THR  20          HG21      THR  20 -28.321  -2.590  -5.868
  165   HG22  THR  20          HG22      THR  20 -26.719  -2.831  -5.175
  166   HG23  THR  20          HG23      THR  20 -27.569  -1.302  -4.932
  167    H    THR  21           HN       THR  21 -28.582  -0.817  -1.606
  168    HA   THR  21           HA       THR  21 -30.147  -2.281   0.335
  169    HB   THR  21           HB       THR  21 -27.975  -1.799   1.545
  170    HG1  THR  21           HG1      THR  21 -30.025  -0.332   2.814
  171   HG21  THR  21          HG21      THR  21 -28.948   1.070   1.259
  172   HG22  THR  21          HG22      THR  21 -27.414   0.421   0.674
  173   HG23  THR  21          HG23      THR  21 -27.712   0.560   2.409
  174    H    GLU  22           HN       GLU  22 -31.952  -1.100   1.086
  175    HA   GLU  22           HA       GLU  22 -32.614   1.186  -0.636
  176    HB2  GLU  22           HB2      GLU  22 -34.561   0.118   1.365
  177    HB3  GLU  22           HB1      GLU  22 -34.857   0.649  -0.281
  178    HG2  GLU  22           HG2      GLU  22 -35.275  -1.600  -0.451
  179    HG3  GLU  22           HG1      GLU  22 -33.536  -1.543  -0.911
  180    H    ALA  23           HN       ALA  23 -32.022   3.156   0.164
  181    HA   ALA  23           HA       ALA  23 -32.703   3.729   2.981
  182    HB1  ALA  23           HB1      ALA  23 -30.017   4.440   1.771
  183    HB2  ALA  23           HB2      ALA  23 -30.284   3.115   2.899
  184    HB3  ALA  23           HB3      ALA  23 -30.551   4.780   3.416
  185    H    VAL  24           HN       VAL  24 -32.835   6.116   3.374
  186    HA   VAL  24           HA       VAL  24 -33.664   7.492   0.988
  187    HB   VAL  24           HB       VAL  24 -35.263   7.664   2.679
  188   HG11  VAL  24          HG11      VAL  24 -34.746   8.360   5.000
  189   HG12  VAL  24          HG12      VAL  24 -33.029   8.263   4.613
  190   HG13  VAL  24          HG13      VAL  24 -34.032   6.812   4.555
  191   HG21  VAL  24          HG21      VAL  24 -34.808   9.806   1.681
  192   HG22  VAL  24          HG22      VAL  24 -33.572  10.122   2.895
  193   HG23  VAL  24          HG23      VAL  24 -35.264  10.004   3.374
  194    H    ASP  25           HN       ASP  25 -31.307   7.970   3.637
  195    HA   ASP  25           HA       ASP  25 -30.226  10.259   2.133
  196    HB2  ASP  25           HB2      ASP  25 -29.646   9.549   5.030
  197    HB3  ASP  25           HB1      ASP  25 -29.073  10.966   4.166
  198    H    ALA  26           HN       ALA  26 -27.911  10.469   1.977
  199    HA   ALA  26           HA       ALA  26 -26.672   8.023   1.193
  200    HB1  ALA  26           HB1      ALA  26 -24.747   9.453   0.636
  201    HB2  ALA  26           HB2      ALA  26 -25.523  10.808   1.456
  202    HB3  ALA  26           HB3      ALA  26 -26.258  10.121   0.008
  203    H    ALA  27           HN       ALA  27 -26.227  10.301   3.873
  204    HA   ALA  27           HA       ALA  27 -24.007   9.090   5.073
  205    HB1  ALA  27           HB1      ALA  27 -26.242  10.678   6.328
  206    HB2  ALA  27           HB2      ALA  27 -24.714  11.306   5.711
  207    HB3  ALA  27           HB3      ALA  27 -24.730  10.264   7.134
  208    H    THR  28           HN       THR  28 -27.447   8.412   5.340
  209    HA   THR  28           HA       THR  28 -27.264   6.551   7.483
  210    HB   THR  28           HB       THR  28 -29.413   6.500   5.368
  211    HG1  THR  28           HG1      THR  28 -29.894   8.118   7.541
  212   HG21  THR  28          HG21      THR  28 -30.845   5.932   7.285
  213   HG22  THR  28          HG22      THR  28 -29.450   6.048   8.358
  214   HG23  THR  28          HG23      THR  28 -29.509   4.786   7.128
  215    H    ALA  29           HN       ALA  29 -26.868   6.358   4.027
  216    HA   ALA  29           HA       ALA  29 -27.121   3.503   3.842
  217    HB1  ALA  29           HB1      ALA  29 -25.971   5.506   1.898
  218    HB2  ALA  29           HB2      ALA  29 -27.642   4.944   1.942
  219    HB3  ALA  29           HB3      ALA  29 -26.343   3.819   1.538
  220    H    GLU  30           HN       GLU  30 -24.551   5.841   4.275
  221    HA   GLU  30           HA       GLU  30 -22.360   4.143   3.805
  222    HB2  GLU  30           HB2      GLU  30 -22.490   6.758   4.216
  223    HB3  GLU  30           HB1      GLU  30 -22.238   6.290   5.887
  224    HG2  GLU  30           HG2      GLU  30 -20.177   5.106   5.209
  225    HG3  GLU  30           HG1      GLU  30 -20.404   5.742   3.579
  226    H    LYS  31           HN       LYS  31 -23.852   5.153   6.876
  227    HA   LYS  31           HA       LYS  31 -22.552   3.704   8.730
  228    HB2  LYS  31           HB2      LYS  31 -25.546   4.026   8.636
  229    HB3  LYS  31           HB1      LYS  31 -24.636   3.565  10.049
  230    HG2  LYS  31           HG2      LYS  31 -23.597   5.742  10.087
  231    HG3  LYS  31           HG1      LYS  31 -24.443   6.194   8.608
  232    HD2  LYS  31           HD2      LYS  31 -26.576   5.909   9.709
  233    HD3  LYS  31           HD1      LYS  31 -25.776   5.355  11.177
  234    HE2  LYS  31           HE2      LYS  31 -24.688   7.557  11.376
  235    HE3  LYS  31           HE1      LYS  31 -25.584   8.106   9.959
  236    HZ1  LYS  31           HZ1      LYS  31 -27.656   7.730  11.147
  237    HZ2  LYS  31           HZ2      LYS  31 -26.662   8.770  12.036
  238    HZ3  LYS  31           HZ3      LYS  31 -26.811   7.146  12.497
  239    H    VAL  32           HN       VAL  32 -25.106   2.373   6.644
  240    HA   VAL  32           HA       VAL  32 -25.317  -0.092   8.078
  241    HB   VAL  32           HB       VAL  32 -26.182   0.534   5.243
  242   HG11  VAL  32          HG11      VAL  32 -27.685  -1.356   5.470
  243   HG12  VAL  32          HG12      VAL  32 -27.091  -1.664   7.100
  244   HG13  VAL  32          HG13      VAL  32 -26.018  -1.877   5.716
  245   HG21  VAL  32          HG21      VAL  32 -27.186   2.045   6.895
  246   HG22  VAL  32          HG22      VAL  32 -27.768   0.650   7.805
  247   HG23  VAL  32          HG23      VAL  32 -28.380   0.961   6.181
  248    H    PHE  33           HN       PHE  33 -23.714   0.882   5.059
  249    HA   PHE  33           HA       PHE  33 -22.707  -1.743   4.551
  250    HB2  PHE  33           HB2      PHE  33 -22.076   0.958   3.403
  251    HB3  PHE  33           HB1      PHE  33 -21.195  -0.475   2.923
  252    HD1  PHE  33           HD1      PHE  33 -23.442  -2.455   2.882
  253    HD2  PHE  33           HD2      PHE  33 -23.210   1.553   1.459
  254    HE1  PHE  33           HE1      PHE  33 -25.174  -2.951   1.203
  255    HE2  PHE  33           HE2      PHE  33 -24.943   1.060  -0.215
  256    HZ   PHE  33           HZ       PHE  33 -25.925  -1.192  -0.348
  257    H    LYS  34           HN       LYS  34 -21.717   0.753   6.651
  258    HA   LYS  34           HA       LYS  34 -18.919   0.217   6.606
  259    HB2  LYS  34           HB2      LYS  34 -20.656   1.484   8.757
  260    HB3  LYS  34           HB1      LYS  34 -18.912   1.499   8.776
  261    HG2  LYS  34           HG2      LYS  34 -19.548   2.524   6.321
  262    HG3  LYS  34           HG1      LYS  34 -20.695   3.256   7.463
  263    HD2  LYS  34           HD2      LYS  34 -18.744   4.576   7.465
  264    HD3  LYS  34           HD1      LYS  34 -18.734   3.686   8.967
  265    HE2  LYS  34           HE2      LYS  34 -17.174   2.076   8.028
  266    HE3  LYS  34           HE1      LYS  34 -17.246   2.887   6.469
  267    HZ1  LYS  34           HZ1      LYS  34 -16.163   4.778   7.355
  268    HZ2  LYS  34           HZ2      LYS  34 -15.253   3.419   7.809
  269    HZ3  LYS  34           HZ3      LYS  34 -16.256   4.185   8.941
  270    H    GLN  35           HN       GLN  35 -21.673  -0.888   8.487
  271    HA   GLN  35           HA       GLN  35 -20.243  -2.601  10.250
  272    HB2  GLN  35           HB2      GLN  35 -22.788  -1.699  10.148
  273    HB3  GLN  35           HB1      GLN  35 -23.024  -3.265   9.422
  274    HG2  GLN  35           HG2      GLN  35 -23.480  -3.331  11.809
  275    HG3  GLN  35           HG1      GLN  35 -22.145  -4.391  11.369
  276   HE21  GLN  35          HE21      GLN  35 -22.843  -3.246  13.948
  277   HE22  GLN  35          HE22      GLN  35 -21.462  -2.340  14.464
  278    H    TYR  36           HN       TYR  36 -21.924  -2.930   7.229
  279    HA   TYR  36           HA       TYR  36 -21.642  -5.675   6.771
  280    HB2  TYR  36           HB2      TYR  36 -23.116  -4.390   5.398
  281    HB3  TYR  36           HB1      TYR  36 -21.812  -3.338   4.869
  282    HD1  TYR  36           HD1      TYR  36 -20.474  -3.908   2.984
  283    HD2  TYR  36           HD2      TYR  36 -23.165  -6.748   4.626
  284    HE1  TYR  36           HE1      TYR  36 -20.128  -5.352   1.023
  285    HE2  TYR  36           HE2      TYR  36 -22.828  -8.210   2.693
  286    HH   TYR  36           HH       TYR  36 -20.371  -7.565   0.304
  287    H    ALA  37           HN       ALA  37 -19.520  -3.045   5.572
  288    HA   ALA  37           HA       ALA  37 -17.603  -4.824   4.471
  289    HB1  ALA  37           HB1      ALA  37 -16.139  -2.834   4.345
  290    HB2  ALA  37           HB2      ALA  37 -17.320  -1.928   5.293
  291    HB3  ALA  37           HB3      ALA  37 -17.754  -2.537   3.693
  292    H    ASN  38           HN       ASN  38 -18.168  -3.577   7.652
  293    HA   ASN  38           HA       ASN  38 -15.597  -4.127   8.778
  294    HB2  ASN  38           HB2      ASN  38 -17.258  -2.561   9.825
  295    HB3  ASN  38           HB1      ASN  38 -18.283  -3.945  10.192
  296   HD21  ASN  38          HD21      ASN  38 -17.702  -5.353  11.860
  297   HD22  ASN  38          HD22      ASN  38 -16.432  -4.952  13.033
  298    H    ASP  39           HN       ASP  39 -18.512  -5.929   8.237
  299    HA   ASP  39           HA       ASP  39 -18.031  -8.157   9.886
  300    HB2  ASP  39           HB2      ASP  39 -20.227  -7.640   8.910
  301    HB3  ASP  39           HB1      ASP  39 -19.595  -7.971   7.302
  302    H    ASN  40           HN       ASN  40 -17.067  -7.420   6.569
  303    HA   ASN  40           HA       ASN  40 -15.751 -10.021   6.372
  304    HB2  ASN  40           HB2      ASN  40 -15.195  -9.059   3.987
  305    HB3  ASN  40           HB1      ASN  40 -16.783  -9.724   4.344
  306   HD21  ASN  40          HD21      ASN  40 -18.565  -8.422   4.310
  307   HD22  ASN  40          HD22      ASN  40 -18.494  -6.722   3.790
  308    H    GLY  41           HN       GLY  41 -15.027  -6.756   7.096
  309    HA2  GLY  41           HA2      GLY  41 -13.036  -6.066   8.101
  310    HA3  GLY  41           HA1      GLY  41 -12.274  -7.547   7.557
  311    H    VAL  42           HN       VAL  42 -14.023  -5.327   5.452
  312    HA   VAL  42           HA       VAL  42 -11.532  -4.914   3.991
  313    HB   VAL  42           HB       VAL  42 -14.402  -4.386   3.161
  314   HG11  VAL  42          HG11      VAL  42 -11.820  -4.047   1.629
  315   HG12  VAL  42          HG12      VAL  42 -12.896  -2.758   2.161
  316   HG13  VAL  42          HG13      VAL  42 -13.438  -3.910   0.939
  317   HG21  VAL  42          HG21      VAL  42 -13.868  -6.738   3.250
  318   HG22  VAL  42          HG22      VAL  42 -12.385  -6.468   2.329
  319   HG23  VAL  42          HG23      VAL  42 -13.956  -6.220   1.566
  320    H    ASP  43           HN       ASP  43 -10.444  -3.181   4.363
  321    HA   ASP  43           HA       ASP  43 -11.858  -0.683   5.031
  322    HB2  ASP  43           HB2      ASP  43 -10.815  -1.530   7.122
  323    HB3  ASP  43           HB1      ASP  43  -9.256  -1.610   6.314
  324    H    GLY  44           HN       GLY  44 -11.174   1.092   3.894
  325    HA2  GLY  44           HA2      GLY  44  -8.692   1.485   2.728
  326    HA3  GLY  44           HA1      GLY  44  -9.707   0.692   1.527
  327    H    GLU  45           HN       GLU  45  -9.188   2.876   0.479
  328    HA   GLU  45           HA       GLU  45 -10.403   5.241   1.384
  329    HB2  GLU  45           HB2      GLU  45  -9.725   4.284  -1.394
  330    HB3  GLU  45           HB1      GLU  45 -10.455   5.853  -1.096
  331    HG2  GLU  45           HG2      GLU  45  -8.150   6.217  -1.311
  332    HG3  GLU  45           HG1      GLU  45  -8.510   6.357   0.407
  333    H    TRP  46           HN       TRP  46 -12.410   6.036   1.277
  334    HA   TRP  46           HA       TRP  46 -14.492   4.230   0.226
  335    HB2  TRP  46           HB2      TRP  46 -14.460   6.095   2.565
  336    HB3  TRP  46           HB1      TRP  46 -15.964   5.962   1.681
  337    HD1  TRP  46           HD1      TRP  46 -13.377   3.563   3.294
  338    HE1  TRP  46           HE1      TRP  46 -14.636   1.602   4.373
  339    HE3  TRP  46           HE3      TRP  46 -18.210   4.807   1.985
  340    HZ2  TRP  46           HZ2      TRP  46 -17.281   0.702   4.651
  341    HZ3  TRP  46           HZ3      TRP  46 -20.026   3.328   2.717
  342    HH2  TRP  46           HH2      TRP  46 -19.570   1.317   4.016
  343    H    THR  47           HN       THR  47 -14.912   4.792  -1.807
  344    HA   THR  47           HA       THR  47 -14.919   7.625  -2.525
  345    HB   THR  47           HB       THR  47 -15.087   6.626  -4.908
  346    HG1  THR  47           HG1      THR  47 -13.893   4.368  -3.713
  347   HG21  THR  47          HG21      THR  47 -13.074   7.695  -3.965
  348   HG22  THR  47          HG22      THR  47 -12.676   6.342  -5.024
  349   HG23  THR  47          HG23      THR  47 -12.593   6.143  -3.275
  350    H    TYR  48           HN       TYR  48 -16.611   8.421  -3.931
  351    HA   TYR  48           HA       TYR  48 -19.122   7.004  -3.997
  352    HB2  TYR  48           HB2      TYR  48 -19.503   7.895  -1.844
  353    HB3  TYR  48           HB1      TYR  48 -18.701   9.407  -2.196
  354    HD1  TYR  48           HD1      TYR  48 -19.903  11.202  -3.350
  355    HD2  TYR  48           HD2      TYR  48 -21.855   7.503  -2.476
  356    HE1  TYR  48           HE1      TYR  48 -22.081  12.221  -3.845
  357    HE2  TYR  48           HE2      TYR  48 -24.020   8.525  -2.980
  358    HH   TYR  48           HH       TYR  48 -25.084  10.620  -3.182
  359    H    ASP  49           HN       ASP  49 -20.607   7.983  -5.494
  360    HA   ASP  49           HA       ASP  49 -19.329  10.133  -7.091
  361    HB2  ASP  49           HB2      ASP  49 -19.805   9.094  -9.158
  362    HB3  ASP  49           HB1      ASP  49 -19.299   7.728  -8.184
  363    H    ASP  50           HN       ASP  50 -20.865  11.527  -8.184
  364    HA   ASP  50           HA       ASP  50 -23.209  11.885  -6.455
  365    HB2  ASP  50           HB2      ASP  50 -21.725  13.829  -6.838
  366    HB3  ASP  50           HB1      ASP  50 -21.981  13.688  -8.570
  367    H    ALA  51           HN       ALA  51 -22.528  10.544  -9.500
  368    HA   ALA  51           HA       ALA  51 -25.046  11.314 -10.683
  369    HB1  ALA  51           HB1      ALA  51 -24.322   9.999 -12.623
  370    HB2  ALA  51           HB2      ALA  51 -22.898   9.470 -11.728
  371    HB3  ALA  51           HB3      ALA  51 -23.108  11.172 -12.119
  372    H    THR  52           HN       THR  52 -23.625   8.274  -9.429
  373    HA   THR  52           HA       THR  52 -26.319   7.118  -9.669
  374    HB   THR  52           HB       THR  52 -25.065   4.888  -9.638
  375    HG1  THR  52           HG1      THR  52 -22.951   6.724  -9.736
  376   HG21  THR  52          HG21      THR  52 -26.105   5.756 -11.657
  377   HG22  THR  52          HG22      THR  52 -24.537   5.050 -12.054
  378   HG23  THR  52          HG23      THR  52 -24.713   6.803 -11.950
  379    H    LYS  53           HN       LYS  53 -24.290   8.285  -7.332
  380    HA   LYS  53           HA       LYS  53 -24.119   8.045  -5.054
  381    HB2  LYS  53           HB2      LYS  53 -26.836   6.819  -5.521
  382    HB3  LYS  53           HB1      LYS  53 -26.127   6.912  -3.915
  383    HG2  LYS  53           HG2      LYS  53 -27.622   8.768  -4.261
  384    HG3  LYS  53           HG1      LYS  53 -25.962   9.349  -4.132
  385    HD2  LYS  53           HD2      LYS  53 -25.954   9.261  -6.705
  386    HD3  LYS  53           HD1      LYS  53 -27.710   9.150  -6.561
  387    HE2  LYS  53           HE2      LYS  53 -25.997  11.349  -5.412
  388    HE3  LYS  53           HE1      LYS  53 -26.938  11.463  -6.897
  389    HZ1  LYS  53           HZ1      LYS  53 -28.135  12.465  -5.113
  390    HZ2  LYS  53           HZ2      LYS  53 -28.002  11.072  -4.159
  391    HZ3  LYS  53           HZ3      LYS  53 -28.941  11.044  -5.569
  392    H    THR  54           HN       THR  54 -22.712   6.305  -6.558
  393    HA   THR  54           HA       THR  54 -23.019   3.663  -5.378
  394    HB   THR  54           HB       THR  54 -20.989   4.609  -7.443
  395    HG1  THR  54           HG1      THR  54 -22.889   4.799  -8.490
  396   HG21  THR  54          HG21      THR  54 -20.679   2.365  -6.100
  397   HG22  THR  54          HG22      THR  54 -20.538   2.321  -7.859
  398   HG23  THR  54          HG23      THR  54 -22.036   1.791  -7.083
  399    H    TYR  55           HN       TYR  55 -21.847   3.014  -3.677
  400    HA   TYR  55           HA       TYR  55 -19.615   4.712  -2.770
  401    HB2  TYR  55           HB2      TYR  55 -21.455   2.837  -1.264
  402    HB3  TYR  55           HB1      TYR  55 -19.894   3.293  -0.606
  403    HD1  TYR  55           HD1      TYR  55 -23.141   4.725  -1.781
  404    HD2  TYR  55           HD2      TYR  55 -19.644   5.262   0.585
  405    HE1  TYR  55           HE1      TYR  55 -24.131   6.731  -0.782
  406    HE2  TYR  55           HE2      TYR  55 -20.627   7.281   1.586
  407    HH   TYR  55           HH       TYR  55 -22.301   8.878   1.248
  408    H    THR  56           HN       THR  56 -17.585   3.880  -2.814
  409    HA   THR  56           HA       THR  56 -17.322   0.984  -3.297
  410    HB   THR  56           HB       THR  56 -15.844   3.187  -4.756
  411    HG1  THR  56           HG1      THR  56 -18.103   2.395  -5.317
  412   HG21  THR  56          HG21      THR  56 -14.781   1.320  -6.039
  413   HG22  THR  56          HG22      THR  56 -15.475   0.178  -4.888
  414   HG23  THR  56          HG23      THR  56 -14.290   1.361  -4.343
  415    H    VAL  57           HN       VAL  57 -15.831  -0.036  -2.118
  416    HA   VAL  57           HA       VAL  57 -13.913   1.630  -0.621
  417    HB   VAL  57           HB       VAL  57 -15.569   0.607   0.945
  418   HG11  VAL  57          HG11      VAL  57 -16.184  -1.439  -0.126
  419   HG12  VAL  57          HG12      VAL  57 -15.395  -1.847   1.393
  420   HG13  VAL  57          HG13      VAL  57 -14.512  -2.006  -0.120
  421   HG21  VAL  57          HG21      VAL  57 -13.325   1.108   1.723
  422   HG22  VAL  57          HG22      VAL  57 -12.761  -0.470   1.174
  423   HG23  VAL  57          HG23      VAL  57 -13.925  -0.361   2.493
  424    H    THR  58           HN       THR  58 -11.917   1.352  -1.251
  425    HA   THR  58           HA       THR  58 -11.261  -1.097  -2.750
  426    HB   THR  58           HB       THR  58  -9.871   1.574  -2.991
  427    HG1  THR  58           HG1      THR  58 -12.319   1.096  -3.687
  428   HG21  THR  58          HG21      THR  58  -8.607  -0.376  -3.781
  429   HG22  THR  58          HG22      THR  58  -9.096   0.652  -5.127
  430   HG23  THR  58          HG23      THR  58  -9.969  -0.846  -4.798
  431    H    GLU  59           HN       GLU  59  -9.572  -2.313  -2.131
  432    HA   GLU  59           HA       GLU  59  -8.185  -1.526   0.313
  433    HB2  GLU  59           HB2      GLU  59  -7.998  -4.151  -1.183
  434    HB3  GLU  59           HB1      GLU  59  -7.370  -3.827   0.412
  435    HG2  GLU  59           HG2      GLU  59  -9.913  -3.302   0.932
  436    HG3  GLU  59           HG1      GLU  59 -10.154  -4.373  -0.448
  437    H    GLY  60           HN       GLY  60  -5.841  -1.651   0.457
  438    HA2  GLY  60           HA2      GLY  60  -3.682  -1.615  -0.471
  439    HA3  GLY  60           HA1      GLY  60  -4.391  -1.589  -2.086
  440    H    SER  61           HN       SER  61  -2.978   0.229   0.363
  441    HA   SER  61           HA       SER  61  -3.612   2.710  -1.082
  442    HB2  SER  61           HB2      SER  61  -4.877   2.297   1.186
  443    HB3  SER  61           HB1      SER  61  -3.331   2.716   1.917
  444    HG   SER  61           HG       SER  61  -5.219   4.336   0.925
  445    H    GLY  62           HN       GLY  62  -1.461   1.050   1.225
  446    HA2  GLY  62           HA2      GLY  62   0.937   1.302   0.181
  447    HA3  GLY  62           HA1      GLY  62   0.657   2.981   0.610
  448    H    GLY  63           HN       GLY  63   1.518  -0.160   1.789
  449    HA2  GLY  63           HA2      GLY  63   1.530   0.849   4.549
  450    HA3  GLY  63           HA1      GLY  63   1.662  -0.835   4.061
  451    H    ALA  64           HN       ALA  64   3.464   1.734   2.558
  452    HA   ALA  64           HA       ALA  64   5.937   0.422   3.408
  453    HB1  ALA  64           HB1      ALA  64   5.480   2.429   1.201
  454    HB2  ALA  64           HB2      ALA  64   5.599   0.681   0.998
  455    HB3  ALA  64           HB3      ALA  64   6.996   1.602   1.554
  456    H    GLY  65           HN       GLY  65   7.648   1.592   4.319
  457    HA2  GLY  65           HA2      GLY  65   8.677   3.587   5.121
  458    HA3  GLY  65           HA1      GLY  65   7.113   4.386   5.062
  459    H    GLY  66           HN       GLY  66   7.478   1.210   6.410
  460    HA2  GLY  66           HA2      GLY  66   6.415   2.099   8.921
  461    HA3  GLY  66           HA1      GLY  66   6.846   0.450   8.495
  462    H    GLN  67           HN       GLN  67   9.474   2.299   7.772
  463    HA   GLN  67           HA       GLN  67  10.768   1.566  10.299
  464    HB2  GLN  67           HB2      GLN  67  11.717   0.892   8.022
  465    HB3  GLN  67           HB1      GLN  67  12.105   2.615   7.787
  466    HG2  GLN  67           HG2      GLN  67  14.082   1.742   8.587
  467    HG3  GLN  67           HG1      GLN  67  13.332   2.391  10.045
  468   HE21  GLN  67          HE21      GLN  67  15.333   0.307   9.718
  469   HE22  GLN  67          HE22      GLN  67  14.690  -1.112  10.468
  470    H    GLY  68           HN       GLY  68  11.138   4.263   7.985
  471    HA2  GLY  68           HA2      GLY  68  10.932   6.545   8.355
  472    HA3  GLY  68           HA1      GLY  68  10.519   6.216  10.031
  473    H    MET  69           HN       MET  69  12.238   5.759  11.516
  474    HA   MET  69           HA       MET  69  14.469   7.491  11.063
  475    HB2  MET  69           HB2      MET  69  15.184   6.750  13.356
  476    HB3  MET  69           HB1      MET  69  13.589   7.480  13.270
  477    HG2  MET  69           HG2      MET  69  12.571   5.268  13.349
  478    HG3  MET  69           HG1      MET  69  14.168   4.529  13.406
  479    HE1  MET  69           HE1      MET  69  15.715   6.642  15.320
  480    HE2  MET  69           HE2      MET  69  15.891   4.889  15.406
  481    HE3  MET  69           HE3      MET  69  15.525   5.812  16.864
  482    H    ILE  70           HN       ILE  70  16.301   6.942  10.023
  483    HA   ILE  70           HA       ILE  70  17.433   4.273  10.410
  484    HB   ILE  70           HB       ILE  70  16.972   5.479   7.654
  485   HG12  ILE  70          HG12      ILE  70  15.961   2.886   8.859
  486   HG13  ILE  70          HG11      ILE  70  15.001   4.348   8.643
  487   HG21  ILE  70          HG21      ILE  70  18.130   3.540   6.734
  488   HG22  ILE  70          HG22      ILE  70  18.394   2.890   8.350
  489   HG23  ILE  70          HG23      ILE  70  19.199   4.381   7.862
  490   HD11  ILE  70          HD11      ILE  70  15.255   4.174   6.223
  491   HD12  ILE  70          HD12      ILE  70  14.567   2.691   6.889
  492   HD13  ILE  70          HD13      ILE  70  16.268   2.747   6.422
  493    H    GLN  71           HN       GLN  71  17.722   7.552   9.247
  494    HA   GLN  71           HA       GLN  71  20.619   7.481   9.056
  495    HB2  GLN  71           HB2      GLN  71  18.602   9.714   8.732
  496    HB3  GLN  71           HB1      GLN  71  20.325   9.879   8.429
  497    HG2  GLN  71           HG2      GLN  71  20.240   8.637   6.499
  498    HG3  GLN  71           HG1      GLN  71  18.780   7.778   6.988
  499   HE21  GLN  71          HE21      GLN  71  20.065  10.746   5.680
  500   HE22  GLN  71          HE22      GLN  71  18.566  11.336   5.042
  501    H    GLU  72           HN       GLU  72  19.093   7.099  11.618
  502    HA   GLU  72           HA       GLU  72  19.511   9.499  13.152
  503    HB2  GLU  72           HB2      GLU  72  18.650   6.726  14.001
  504    HB3  GLU  72           HB1      GLU  72  18.695   8.134  15.056
  505    HG2  GLU  72           HG2      GLU  72  16.992   7.825  12.591
  506    HG3  GLU  72           HG1      GLU  72  16.445   7.685  14.260
  507    HA   PRO  73           HA       PRO  73  23.501   8.395  14.763
  508    HB2  PRO  73           HB2      PRO  73  23.579  10.016  16.930
  509    HB3  PRO  73           HB1      PRO  73  23.695  10.655  15.251
  510    HG2  PRO  73           HG2      PRO  73  21.323  10.590  17.098
  511    HG3  PRO  73           HG1      PRO  73  21.863  11.876  15.998
  512    HD2  PRO  73           HD2      PRO  73  19.840  10.105  15.430
  513    HD3  PRO  73           HD1      PRO  73  20.839  10.931  14.190
  514    H    ALA  74           HN       ALA  74  24.382   8.132  17.175
  515    HA   ALA  74           HA       ALA  74  24.474   6.936  19.076
  516    HB1  ALA  74           HB1      ALA  74  21.472   6.763  18.913
  517    HB2  ALA  74           HB2      ALA  74  22.382   8.054  19.696
  518    HB3  ALA  74           HB3      ALA  74  22.466   6.409  20.327
  519    H    LEU  75           HN       LEU  75  23.627   4.689  20.013
  520    HA   LEU  75           HA       LEU  75  24.024   2.795  17.825
  521    HB2  LEU  75           HB2      LEU  75  24.629   2.669  20.747
  522    HB3  LEU  75           HB1      LEU  75  24.564   1.222  19.785
  523    HG   LEU  75           HG       LEU  75  26.841   1.842  19.960
  524   HD11  LEU  75          HD11      LEU  75  25.770   2.659  17.271
  525   HD12  LEU  75          HD12      LEU  75  26.189   1.026  17.787
  526   HD13  LEU  75          HD13      LEU  75  27.450   2.248  17.617
  527   HD21  LEU  75          HD21      LEU  75  26.071   4.590  18.976
  528   HD22  LEU  75          HD22      LEU  75  27.706   4.029  19.331
  529   HD23  LEU  75          HD23      LEU  75  26.524   4.178  20.631
  530    HA   PRO  76           HA       PRO  76  19.839   1.263  18.537
  531    HB2  PRO  76           HB2      PRO  76  20.840  -1.031  16.905
  532    HB3  PRO  76           HB1      PRO  76  19.428  -0.007  16.611
  533    HG2  PRO  76           HG2      PRO  76  21.593   0.230  15.079
  534    HG3  PRO  76           HG1      PRO  76  20.705   1.698  15.644
  535    HD2  PRO  76           HD2      PRO  76  23.260   0.486  16.776
  536    HD3  PRO  76           HD1      PRO  76  22.893   2.183  16.385
  537    HA   PRO  77           HA       PRO  77  20.172  -1.604  21.898
  538    HB2  PRO  77           HB2      PRO  77  18.138  -3.170  20.321
  539    HB3  PRO  77           HB1      PRO  77  18.150  -2.805  22.054
  540    HG2  PRO  77           HG2      PRO  77  16.609  -1.360  20.530
  541    HG3  PRO  77           HG1      PRO  77  17.675  -0.533  21.691
  542    HD2  PRO  77           HD2      PRO  77  18.037  -0.870  18.710
  543    HD3  PRO  77           HD1      PRO  77  18.314   0.585  19.738
  544    H    GLY  78           HN       GLY  78  21.756  -2.981  22.230
  545    HA2  GLY  78           HA2      GLY  78  22.780  -5.108  22.025
  546    HA3  GLY  78           HA1      GLY  78  22.105  -5.258  20.415
  547    H    TRP  79           HN       TRP  79  23.129  -2.471  19.724
  548    HA   TRP  79           HA       TRP  79  25.765  -3.431  18.881
  549    HB2  TRP  79           HB2      TRP  79  24.163  -0.958  18.166
  550    HB3  TRP  79           HB1      TRP  79  25.796  -1.228  17.586
  551    HD1  TRP  79           HD1      TRP  79  22.225  -2.638  17.256
  552    HE1  TRP  79           HE1      TRP  79  22.070  -3.945  15.049
  553    HE3  TRP  79           HE3      TRP  79  27.156  -2.489  15.843
  554    HZ2  TRP  79           HZ2      TRP  79  23.781  -4.801  12.997
  555    HZ3  TRP  79           HZ3      TRP  79  27.799  -3.586  13.741
  556    HH2  TRP  79           HH2      TRP  79  26.152  -4.718  12.348
  557    H    GLU  80           HN       GLU  80  27.739  -2.599  19.537
  558    HA   GLU  80           HA       GLU  80  27.714  -0.347  21.439
  559    HB2  GLU  80           HB2      GLU  80  29.504  -2.775  21.314
  560    HB3  GLU  80           HB1      GLU  80  29.911  -1.350  22.252
  561    HG2  GLU  80           HG2      GLU  80  27.916  -1.666  23.610
  562    HG3  GLU  80           HG1      GLU  80  27.484  -3.087  22.655
  563    H    MET  81           HN       MET  81  29.138   1.330  21.041
  564    HA   MET  81           HA       MET  81  30.844   1.059  18.647
  565    HB2  MET  81           HB2      MET  81  29.056   2.710  18.316
  566    HB3  MET  81           HB1      MET  81  29.581   3.573  19.786
  567    HG2  MET  81           HG2      MET  81  31.689   4.114  18.743
  568    HG3  MET  81           HG1      MET  81  31.269   3.175  17.315
  569    HE1  MET  81           HE1      MET  81  28.280   5.272  15.850
  570    HE2  MET  81           HE2      MET  81  28.156   3.934  16.994
  571    HE3  MET  81           HE3      MET  81  29.288   3.842  15.645
  572    H    LYS  82           HN       LYS  82  33.012   1.144  19.045
  573    HA   LYS  82           HA       LYS  82  33.988   2.773  21.224
  574    HB2  LYS  82           HB2      LYS  82  34.485  -0.231  21.220
  575    HB3  LYS  82           HB1      LYS  82  35.380   0.914  22.201
  576    HG2  LYS  82           HG2      LYS  82  33.470   1.482  23.474
  577    HG3  LYS  82           HG1      LYS  82  32.392   0.627  22.333
  578    HD2  LYS  82           HD2      LYS  82  34.474  -0.661  24.112
  579    HD3  LYS  82           HD1      LYS  82  32.736  -0.630  24.410
  580    HE2  LYS  82           HE2      LYS  82  32.487  -1.770  22.147
  581    HE3  LYS  82           HE1      LYS  82  34.229  -2.049  22.218
  582    HZ1  LYS  82           HZ1      LYS  82  33.746  -3.096  24.472
  583    HZ2  LYS  82           HZ2      LYS  82  33.272  -3.970  23.105
  584    HZ3  LYS  82           HZ3      LYS  82  32.114  -3.111  23.997
  585    H    TYR  83           HN       TYR  83  36.301   3.143  21.089
  586    HA   TYR  83           HA       TYR  83  37.292   2.691  18.333
  587    HB2  TYR  83           HB2      TYR  83  37.648   5.062  20.208
  588    HB3  TYR  83           HB1      TYR  83  38.690   4.809  18.786
  589    HD1  TYR  83           HD1      TYR  83  38.128   5.974  16.901
  590    HD2  TYR  83           HD2      TYR  83  35.013   4.941  19.612
  591    HE1  TYR  83           HE1      TYR  83  36.517   7.208  15.514
  592    HE2  TYR  83           HE2      TYR  83  33.395   6.158  18.225
  593    HH   TYR  83           HH       TYR  83  34.230   7.415  15.082
  594    H    THR  84           HN       THR  84  39.538   2.283  18.082
  595    HA   THR  84           HA       THR  84  40.761   0.995  20.371
  596    HB   THR  84           HB       THR  84  42.448   0.195  18.871
  597    HG1  THR  84           HG1      THR  84  42.879   1.129  16.943
  598   HG21  THR  84          HG21      THR  84  41.134  -0.862  17.081
  599   HG22  THR  84          HG22      THR  84  39.803   0.251  17.403
  600   HG23  THR  84          HG23      THR  84  40.290  -0.915  18.629
  601    H    SER  85           HN       SER  85  43.310   1.536  20.525
  602    HA   SER  85           HA       SER  85  43.352   4.193  21.531
  603    HB2  SER  85           HB2      SER  85  45.592   2.260  21.336
  604    HB3  SER  85           HB1      SER  85  45.511   3.648  22.401
  605    HG   SER  85           HG       SER  85  44.937   1.508  23.317
  606    H    GLU  86           HN       GLU  86  43.604   3.346  18.425
  607    HA   GLU  86           HA       GLU  86  45.599   5.478  17.892
  608    HB2  GLU  86           HB2      GLU  86  46.158   4.249  15.767
  609    HB3  GLU  86           HB1      GLU  86  46.558   3.329  17.218
  610    HG2  GLU  86           HG2      GLU  86  44.338   2.157  16.916
  611    HG3  GLU  86           HG1      GLU  86  44.271   2.917  15.326
  612    H    GLY  87           HN       GLY  87  42.439   4.970  17.959
  613    HA2  GLY  87           HA2      GLY  87  40.874   6.503  17.110
  614    HA3  GLY  87           HA1      GLY  87  41.994   6.903  15.820
  615    H    VAL  88           HN       VAL  88  41.672   3.544  16.145
  616    HA   VAL  88           HA       VAL  88  40.161   3.432  13.677
  617    HB   VAL  88           HB       VAL  88  41.329   1.209  15.362
  618   HG11  VAL  88          HG11      VAL  88  40.866  -0.252  13.449
  619   HG12  VAL  88          HG12      VAL  88  40.012   1.073  12.657
  620   HG13  VAL  88          HG13      VAL  88  39.386   0.388  14.159
  621   HG21  VAL  88          HG21      VAL  88  43.003   2.602  14.286
  622   HG22  VAL  88          HG22      VAL  88  42.193   2.395  12.734
  623   HG23  VAL  88          HG23      VAL  88  42.940   1.010  13.529
  624    H    ARG  89           HN       ARG  89  38.081   2.977  13.474
  625    HA   ARG  89           HA       ARG  89  36.461   2.802  15.896
  626    HB2  ARG  89           HB2      ARG  89  36.115   4.410  13.880
  627    HB3  ARG  89           HB1      ARG  89  35.431   3.010  13.075
  628    HG2  ARG  89           HG2      ARG  89  33.763   2.828  14.900
  629    HG3  ARG  89           HG1      ARG  89  34.418   4.319  15.588
  630    HD2  ARG  89           HD2      ARG  89  34.003   5.304  13.231
  631    HD3  ARG  89           HD1      ARG  89  32.943   3.917  13.010
  632    HE   ARG  89           HE       ARG  89  32.169   5.048  15.384
  633   HH11  ARG  89          HH11      ARG  89  32.428   6.141  12.059
  634   HH12  ARG  89          HH12      ARG  89  31.164   7.317  12.229
  635   HH21  ARG  89          HH21      ARG  89  30.523   6.630  15.600
  636   HH22  ARG  89          HH22      ARG  89  30.080   7.584  14.214
  637    H    TYR  90           HN       TYR  90  35.699   0.863  16.587
  638    HA   TYR  90           HA       TYR  90  35.152  -1.151  14.534
  639    HB2  TYR  90           HB2      TYR  90  35.949  -2.968  15.892
  640    HB3  TYR  90           HB1      TYR  90  37.232  -1.795  15.710
  641    HD1  TYR  90           HD1      TYR  90  37.750  -0.261  17.690
  642    HD2  TYR  90           HD2      TYR  90  35.221  -3.664  17.978
  643    HE1  TYR  90           HE1      TYR  90  38.088  -0.295  20.126
  644    HE2  TYR  90           HE2      TYR  90  35.540  -3.712  20.415
  645    HH   TYR  90           HH       TYR  90  37.045  -1.125  22.132
  646    H    PHE  91           HN       PHE  91  33.383  -2.664  15.138
  647    HA   PHE  91           HA       PHE  91  31.614  -1.474  17.124
  648    HB2  PHE  91           HB2      PHE  91  31.034  -2.833  14.496
  649    HB3  PHE  91           HB1      PHE  91  29.837  -2.462  15.676
  650    HD1  PHE  91           HD1      PHE  91  29.353  -0.054  16.255
  651    HD2  PHE  91           HD2      PHE  91  31.867  -1.165  12.991
  652    HE1  PHE  91           HE1      PHE  91  29.113   2.197  15.298
  653    HE2  PHE  91           HE2      PHE  91  31.621   1.088  12.048
  654    HZ   PHE  91           HZ       PHE  91  30.289   2.754  13.166
  655    H    VAL  92           HN       VAL  92  30.185  -2.955  18.237
  656    HA   VAL  92           HA       VAL  92  31.176  -5.722  18.346
  657    HB   VAL  92           HB       VAL  92  30.536  -4.043  20.779
  658   HG11  VAL  92          HG11      VAL  92  31.737  -6.794  20.539
  659   HG12  VAL  92          HG12      VAL  92  30.118  -6.399  21.122
  660   HG13  VAL  92          HG13      VAL  92  31.534  -5.888  22.037
  661   HG21  VAL  92          HG21      VAL  92  32.567  -3.208  19.787
  662   HG22  VAL  92          HG22      VAL  92  33.221  -4.841  19.676
  663   HG23  VAL  92          HG23      VAL  92  32.951  -4.106  21.255
  664    H    ASP  93           HN       ASP  93  29.564  -7.182  18.246
  665    HA   ASP  93           HA       ASP  93  26.785  -6.295  18.644
  666    HB2  ASP  93           HB2      ASP  93  28.057  -8.431  17.097
  667    HB3  ASP  93           HB1      ASP  93  26.858  -9.106  18.203
  668    H    HIS  94           HN       HIS  94  26.069  -6.343  20.763
  669    HA   HIS  94           HA       HIS  94  27.640  -7.702  22.733
  670    HB2  HIS  94           HB2      HIS  94  26.632  -5.490  23.141
  671    HB3  HIS  94           HB1      HIS  94  25.027  -6.199  23.025
  672    HD1  HIS  94           HD1      HIS  94  27.743  -5.479  25.342
  673    HD2  HIS  94           HD2      HIS  94  24.436  -8.000  25.231
  674    HE1  HIS  94           HE1      HIS  94  27.370  -6.224  27.723
  675    HE2  HIS  94           HE2      HIS  94  25.298  -7.657  27.652
  676    H    ASN  95           HN       ASN  95  24.753  -8.461  20.979
  677    HA   ASN  95           HA       ASN  95  23.692 -10.328  22.867
  678    HB2  ASN  95           HB2      ASN  95  22.236 -11.061  20.942
  679    HB3  ASN  95           HB1      ASN  95  22.155  -9.333  21.279
  680   HD21  ASN  95          HD21      ASN  95  23.059  -7.881  19.824
  681   HD22  ASN  95          HD22      ASN  95  23.542  -8.339  18.219
  682    H    THR  96           HN       THR  96  25.594 -10.717  19.867
  683    HA   THR  96           HA       THR  96  25.801 -13.578  20.364
  684    HB   THR  96           HB       THR  96  27.235 -13.466  18.241
  685    HG1  THR  96           HG1      THR  96  26.066 -11.099  17.497
  686   HG21  THR  96          HG21      THR  96  24.358 -12.539  18.112
  687   HG22  THR  96          HG22      THR  96  24.905 -14.214  18.192
  688   HG23  THR  96          HG23      THR  96  25.269 -13.234  16.771
  689    H    ARG  97           HN       ARG  97  27.434 -10.763  21.178
  690    HA   ARG  97           HA       ARG  97  29.454 -10.248  22.069
  691    HB2  ARG  97           HB2      ARG  97  29.144 -13.095  22.903
  692    HB3  ARG  97           HB1      ARG  97  30.662 -12.257  23.210
  693    HG2  ARG  97           HG2      ARG  97  29.465 -10.499  24.377
  694    HG3  ARG  97           HG1      ARG  97  27.944 -11.341  24.094
  695    HD2  ARG  97           HD2      ARG  97  30.273 -12.486  25.629
  696    HD3  ARG  97           HD1      ARG  97  28.850 -11.741  26.357
  697    HE   ARG  97           HE       ARG  97  27.975 -13.737  24.608
  698   HH11  ARG  97          HH11      ARG  97  29.785 -13.483  27.595
  699   HH12  ARG  97          HH12      ARG  97  29.199 -14.994  28.216
  700   HH21  ARG  97          HH21      ARG  97  27.234 -15.739  25.417
  701   HH22  ARG  97          HH22      ARG  97  27.764 -16.278  26.982
  702    H    THR  98           HN       THR  98  29.754 -10.011  19.752
  703    HA   THR  98           HA       THR  98  32.195 -11.436  18.942
  704    HB   THR  98           HB       THR  98  31.318 -11.314  16.543
  705    HG1  THR  98           HG1      THR  98  28.728 -11.212  17.699
  706   HG21  THR  98          HG21      THR  98  30.064 -13.409  16.736
  707   HG22  THR  98          HG22      THR  98  29.803 -13.117  18.455
  708   HG23  THR  98          HG23      THR  98  31.429 -13.427  17.852
  709    H    THR  99           HN       THR  99  33.561 -10.173  17.483
  710    HA   THR  99           HA       THR  99  32.981  -7.277  17.586
  711    HB   THR  99           HB       THR  99  35.551  -7.203  17.026
  712    HG1  THR  99           HG1      THR  99  36.549  -9.075  17.059
  713   HG21  THR  99          HG21      THR  99  34.525  -8.132  19.746
  714   HG22  THR  99          HG22      THR  99  34.746  -6.459  19.229
  715   HG23  THR  99          HG23      THR  99  36.149  -7.501  19.472
  716    H    THR 100           HN       THR 100  32.931  -6.127  15.582
  717    HA   THR 100           HA       THR 100  33.780  -7.562  13.206
  718    HB   THR 100           HB       THR 100  31.456  -8.291  13.451
  719    HG1  THR 100           HG1      THR 100  32.216  -7.976  11.326
  720   HG21  THR 100          HG21      THR 100  29.605  -6.662  13.235
  721   HG22  THR 100          HG22      THR 100  30.778  -5.349  13.332
  722   HG23  THR 100          HG23      THR 100  30.537  -6.421  14.712
  723    H    PHE 101           HN       PHE 101  34.645  -6.293  11.741
  724    HA   PHE 101           HA       PHE 101  34.502  -3.412  12.102
  725    HB2  PHE 101           HB2      PHE 101  36.218  -5.266  10.444
  726    HB3  PHE 101           HB1      PHE 101  36.135  -3.493  10.059
  727    HD1  PHE 101           HD1      PHE 101  37.262  -1.913  11.426
  728    HD2  PHE 101           HD2      PHE 101  37.096  -5.993  12.623
  729    HE1  PHE 101           HE1      PHE 101  38.960  -1.476  13.158
  730    HE2  PHE 101           HE2      PHE 101  38.787  -5.563  14.355
  731    HZ   PHE 101           HZ       PHE 101  39.730  -3.261  14.603
  732    H    LYS 102           HN       LYS 102  32.621  -2.653  11.385
  733    HA   LYS 102           HA       LYS 102  31.874  -3.217   8.600
  734    HB2  LYS 102           HB2      LYS 102  30.425  -4.429  10.282
  735    HB3  LYS 102           HB1      LYS 102  29.918  -2.858  10.882
  736    HG2  LYS 102           HG2      LYS 102  29.019  -2.328   8.643
  737    HG3  LYS 102           HG1      LYS 102  29.459  -3.954   8.112
  738    HD2  LYS 102           HD2      LYS 102  27.543  -3.270  10.341
  739    HD3  LYS 102           HD1      LYS 102  27.103  -3.838   8.732
  740    HE2  LYS 102           HE2      LYS 102  28.784  -5.395  10.691
  741    HE3  LYS 102           HE1      LYS 102  27.050  -5.609  10.464
  742    HZ1  LYS 102           HZ1      LYS 102  28.263  -7.256   9.208
  743    HZ2  LYS 102           HZ2      LYS 102  29.159  -6.057   8.413
  744    HZ3  LYS 102           HZ3      LYS 102  27.490  -6.192   8.134
  745    H    ASP 103           HN       ASP 103  30.748  -1.416   7.573
  746    HA   ASP 103           HA       ASP 103  31.745   1.117   8.447
  747    HB2  ASP 103           HB2      ASP 103  29.802   0.419   6.226
  748    HB3  ASP 103           HB1      ASP 103  30.514   2.001   6.486
  749    HA   PRO 104           HA       PRO 104  28.378   2.519  11.002
  750    HB2  PRO 104           HB2      PRO 104  28.303   5.161  10.040
  751    HB3  PRO 104           HB1      PRO 104  29.325   4.598  11.367
  752    HG2  PRO 104           HG2      PRO 104  29.996   5.012   8.491
  753    HG3  PRO 104           HG1      PRO 104  30.988   5.296   9.932
  754    HD2  PRO 104           HD2      PRO 104  31.401   3.173   8.362
  755    HD3  PRO 104           HD1      PRO 104  31.562   3.051  10.128
  756    H    ARG 105           HN       ARG 105  28.430   3.233   7.561
  757    HA   ARG 105           HA       ARG 105  25.514   2.947   7.520
  758    HB2  ARG 105           HB2      ARG 105  27.368   4.468   5.691
  759    HB3  ARG 105           HB1      ARG 105  25.757   4.006   5.173
  760    HG2  ARG 105           HG2      ARG 105  25.616   6.243   5.880
  761    HG3  ARG 105           HG1      ARG 105  24.868   5.280   7.169
  762    HD2  ARG 105           HD2      ARG 105  26.255   6.939   8.231
  763    HD3  ARG 105           HD1      ARG 105  27.090   5.388   8.374
  764    HE   ARG 105           HE       ARG 105  28.062   6.516   6.065
  765   HH11  ARG 105          HH11      ARG 105  27.867   7.520   9.422
  766   HH12  ARG 105          HH12      ARG 105  29.361   8.402   9.366
  767   HH21  ARG 105          HH21      ARG 105  30.007   7.711   6.005
  768   HH22  ARG 105          HH22      ARG 105  30.566   8.520   7.439
  769    HA   PRO 106           HA       PRO 106  26.681  -1.026   5.933
  770    HB2  PRO 106           HB2      PRO 106  24.268  -1.845   4.926
  771    HB3  PRO 106           HB1      PRO 106  24.683  -1.872   6.682
  772    HG2  PRO 106           HG2      PRO 106  23.069   0.120   5.127
  773    HG3  PRO 106           HG1      PRO 106  22.798  -0.531   6.751
  774    HD2  PRO 106           HD2      PRO 106  23.855   1.920   6.281
  775    HD3  PRO 106           HD1      PRO 106  24.262   0.941   7.732
  776    H    GLY 107           HN       GLY 107  27.825  -1.356   4.153
  777    HA2  GLY 107           HA2      GLY 107  28.180  -1.724   1.889
  778    HA3  GLY 107           HA1      GLY 107  26.611  -0.966   1.527
  779    H    PHE 108           HN       PHE 108  27.368   1.418   3.207
  780    HA   PHE 108           HA       PHE 108  28.151   3.556   2.770
  781    HB2  PHE 108           HB2      PHE 108  30.311   1.961   3.128
  782    HB3  PHE 108           HB1      PHE 108  30.608   2.516   1.443
  783    HD1  PHE 108           HD1      PHE 108  30.229   3.606   4.956
  784    HD2  PHE 108           HD2      PHE 108  31.242   4.769   0.986
  785    HE1  PHE 108           HE1      PHE 108  31.163   5.713   5.811
  786    HE2  PHE 108           HE2      PHE 108  32.176   6.878   1.840
  787    HZ   PHE 108           HZ       PHE 108  32.121   7.359   4.246
  788    H    GLU 109           HN       GLU 109  26.338   3.170   1.058
  789    HA   GLU 109           HA       GLU 109  27.231   4.207  -1.431
  790    HB2  GLU 109           HB2      GLU 109  26.203   2.339  -2.857
  791    HB3  GLU 109           HB1      GLU 109  27.754   1.986  -2.109
  792    HG2  GLU 109           HG2      GLU 109  26.780   0.529  -0.538
  793    HG3  GLU 109           HG1      GLU 109  25.151   1.111  -0.887
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1 -40.428  10.899   3.067
    2    H2   GLY   1           HT2      GLY   1 -42.056  10.436   3.186
    3    H3   GLY   1           HT3      GLY   1 -41.418  10.909   1.690
    4    HA2  GLY   1           HA1      GLY   1 -40.524   8.529   3.218
    5    HA3  GLY   1           HA2      GLY   1 -41.696   8.476   1.911
    6    H    SER   2           HN       SER   2 -40.844   7.724   0.142
    7    HA   SER   2           HA       SER   2 -39.485   7.273  -1.583
    8    HB2  SER   2           HB2      SER   2 -38.077   9.129  -2.471
    9    HB3  SER   2           HB1      SER   2 -39.751   9.582  -2.167
   10    HG   SER   2           HG       SER   2 -38.054   9.993  -0.035
   11    H    HIS   3           HN       HIS   3 -38.240   5.602  -1.164
   12    HA   HIS   3           HA       HIS   3 -35.802   5.927   0.420
   13    HB2  HIS   3           HB2      HIS   3 -37.051   3.448  -0.820
   14    HB3  HIS   3           HB1      HIS   3 -35.590   3.447   0.157
   15    HD1  HIS   3           HD1      HIS   3 -39.251   3.305   0.405
   16    HD2  HIS   3           HD2      HIS   3 -36.039   4.133   2.919
   17    HE1  HIS   3           HE1      HIS   3 -40.161   3.161   2.748
   18    HE2  HIS   3           HE2      HIS   3 -38.166   3.480   4.255
   19    H    MET   4           HN       MET   4 -33.727   5.197  -0.486
   20    HA   MET   4           HA       MET   4 -33.645   5.454  -3.415
   21    HB2  MET   4           HB2      MET   4 -31.722   6.647  -1.402
   22    HB3  MET   4           HB1      MET   4 -31.413   6.575  -3.126
   23    HG2  MET   4           HG2      MET   4 -33.735   8.005  -1.858
   24    HG3  MET   4           HG1      MET   4 -32.232   8.762  -2.383
   25    HE1  MET   4           HE1      MET   4 -33.669  10.480  -3.835
   26    HE2  MET   4           HE2      MET   4 -35.155   9.687  -3.320
   27    HE3  MET   4           HE3      MET   4 -34.863   9.988  -5.035
   28    H    GLN   5           HN       GLN   5 -32.423   3.984  -4.491
   29    HA   GLN   5           HA       GLN   5 -31.279   1.795  -2.961
   30    HB2  GLN   5           HB2      GLN   5 -32.691   1.296  -4.918
   31    HB3  GLN   5           HB1      GLN   5 -31.578   2.184  -5.949
   32    HG2  GLN   5           HG2      GLN   5 -31.012  -0.041  -6.282
   33    HG3  GLN   5           HG1      GLN   5 -29.804   0.539  -5.147
   34   HE21  GLN   5          HE21      GLN   5 -32.549  -1.499  -5.633
   35   HE22  GLN   5          HE22      GLN   5 -32.414  -2.382  -4.120
   36    H    TYR   6           HN       TYR   6 -29.199   1.795  -2.417
   37    HA   TYR   6           HA       TYR   6 -27.300   3.292  -4.133
   38    HB2  TYR   6           HB2      TYR   6 -27.253   2.822  -1.113
   39    HB3  TYR   6           HB1      TYR   6 -25.825   3.354  -1.986
   40    HD1  TYR   6           HD1      TYR   6 -25.749   5.599  -2.961
   41    HD2  TYR   6           HD2      TYR   6 -29.090   4.325  -0.655
   42    HE1  TYR   6           HE1      TYR   6 -26.477   7.936  -2.740
   43    HE2  TYR   6           HE2      TYR   6 -29.826   6.660  -0.425
   44    HH   TYR   6           HH       TYR   6 -28.905   8.908  -0.548
   45    H    LYS   7           HN       LYS   7 -25.266   2.245  -4.500
   46    HA   LYS   7           HA       LYS   7 -25.236  -0.598  -3.772
   47    HB2  LYS   7           HB2      LYS   7 -23.858  -0.728  -6.076
   48    HB3  LYS   7           HB1      LYS   7 -25.607  -0.980  -5.993
   49    HG2  LYS   7           HG2      LYS   7 -25.876   1.466  -6.533
   50    HG3  LYS   7           HG1      LYS   7 -24.135   1.490  -6.849
   51    HD2  LYS   7           HD2      LYS   7 -24.342  -0.104  -8.591
   52    HD3  LYS   7           HD1      LYS   7 -26.019  -0.454  -8.166
   53    HE2  LYS   7           HE2      LYS   7 -26.568   1.913  -8.758
   54    HE3  LYS   7           HE1      LYS   7 -24.915   2.093  -9.345
   55    HZ1  LYS   7           HZ1      LYS   7 -26.191   1.583 -11.217
   56    HZ2  LYS   7           HZ2      LYS   7 -27.062   0.377 -10.414
   57    HZ3  LYS   7           HZ3      LYS   7 -25.437   0.114 -10.816
   58    H    LEU   8           HN       LEU   8 -23.136  -1.609  -3.920
   59    HA   LEU   8           HA       LEU   8 -20.885   0.193  -3.368
   60    HB2  LEU   8           HB2      LEU   8 -22.011  -0.342  -1.181
   61    HB3  LEU   8           HB1      LEU   8 -21.808  -2.029  -1.534
   62    HG   LEU   8           HG       LEU   8 -19.279  -1.537  -1.564
   63   HD11  LEU   8          HD11      LEU   8 -20.253   0.858  -0.007
   64   HD12  LEU   8          HD12      LEU   8 -19.425   0.903  -1.564
   65   HD13  LEU   8          HD13      LEU   8 -18.583   0.309  -0.138
   66   HD21  LEU   8          HD21      LEU   8 -20.314  -2.888   0.102
   67   HD22  LEU   8          HD22      LEU   8 -20.968  -1.469   0.915
   68   HD23  LEU   8          HD23      LEU   8 -19.227  -1.756   0.909
   69    H    ILE   9           HN       ILE   9 -18.930  -0.649  -3.873
   70    HA   ILE   9           HA       ILE   9 -18.908  -3.387  -4.963
   71    HB   ILE   9           HB       ILE   9 -17.420  -0.961  -6.036
   72   HG12  ILE   9          HG12      ILE   9 -19.490  -2.741  -7.406
   73   HG13  ILE   9          HG11      ILE   9 -19.855  -1.122  -6.721
   74   HG21  ILE   9          HG21      ILE   9 -16.541  -2.491  -7.758
   75   HG22  ILE   9          HG22      ILE   9 -17.262  -3.853  -6.899
   76   HG23  ILE   9          HG23      ILE   9 -15.984  -2.904  -6.137
   77   HD11  ILE   9          HD11      ILE   9 -17.919  -1.716  -8.977
   78   HD12  ILE   9          HD12      ILE   9 -18.285  -0.122  -8.316
   79   HD13  ILE   9          HD13      ILE   9 -19.543  -1.043  -9.143
   80    H    LEU  10           HN       LEU  10 -17.663  -4.625  -3.662
   81    HA   LEU  10           HA       LEU  10 -15.717  -3.306  -1.954
   82    HB2  LEU  10           HB2      LEU  10 -16.460  -6.227  -2.045
   83    HB3  LEU  10           HB1      LEU  10 -15.332  -5.517  -0.925
   84    HG   LEU  10           HG       LEU  10 -17.154  -5.710   0.403
   85   HD11  LEU  10          HD11      LEU  10 -16.500  -3.359   0.301
   86   HD12  LEU  10          HD12      LEU  10 -18.164  -3.641   0.811
   87   HD13  LEU  10          HD13      LEU  10 -17.830  -3.088  -0.835
   88   HD21  LEU  10          HD21      LEU  10 -18.617  -6.634  -1.362
   89   HD22  LEU  10          HD22      LEU  10 -19.016  -4.985  -1.847
   90   HD23  LEU  10          HD23      LEU  10 -19.460  -5.566  -0.244
   91    H    ASN  11           HN       ASN  11 -13.962  -2.745  -3.011
   92    HA   ASN  11           HA       ASN  11 -12.752  -4.674  -4.866
   93    HB2  ASN  11           HB2      ASN  11 -13.147  -2.145  -5.353
   94    HB3  ASN  11           HB1      ASN  11 -11.793  -1.872  -4.267
   95   HD21  ASN  11          HD21      ASN  11 -12.089  -1.270  -7.049
   96   HD22  ASN  11          HD22      ASN  11 -10.825  -2.090  -7.890
   97    H    GLY  12           HN       GLY  12 -12.199  -6.055  -3.153
   98    HA2  GLY  12           HA2      GLY  12  -9.700  -5.246  -1.857
   99    HA3  GLY  12           HA1      GLY  12 -10.969  -6.007  -0.880
  100    H    LYS  13           HN       LYS  13  -8.173  -6.651  -2.371
  101    HA   LYS  13           HA       LYS  13  -8.618  -8.916  -3.929
  102    HB2  LYS  13           HB2      LYS  13  -6.202  -8.221  -2.253
  103    HB3  LYS  13           HB1      LYS  13  -6.239  -9.468  -3.494
  104    HG2  LYS  13           HG2      LYS  13  -6.731  -7.803  -5.192
  105    HG3  LYS  13           HG1      LYS  13  -6.773  -6.540  -3.964
  106    HD2  LYS  13           HD2      LYS  13  -4.420  -6.893  -3.481
  107    HD3  LYS  13           HD1      LYS  13  -4.363  -8.228  -4.635
  108    HE2  LYS  13           HE2      LYS  13  -3.435  -6.246  -5.657
  109    HE3  LYS  13           HE1      LYS  13  -4.959  -6.649  -6.441
  110    HZ1  LYS  13           HZ1      LYS  13  -4.616  -4.561  -4.354
  111    HZ2  LYS  13           HZ2      LYS  13  -6.056  -4.918  -5.175
  112    HZ3  LYS  13           HZ3      LYS  13  -4.733  -4.263  -6.016
  113    H    THR  14           HN       THR  14  -9.026  -8.606  -0.550
  114    HA   THR  14           HA       THR  14  -8.541 -11.390   0.087
  115    HB   THR  14           HB       THR  14 -10.133  -9.432   1.751
  116    HG1  THR  14           HG1      THR  14  -7.672  -9.359   2.606
  117   HG21  THR  14          HG21      THR  14  -9.153 -10.707   3.619
  118   HG22  THR  14          HG22      THR  14  -8.328 -11.751   2.462
  119   HG23  THR  14          HG23      THR  14 -10.089 -11.745   2.542
  120    H    LEU  15           HN       LEU  15 -11.296  -9.329  -0.694
  121    HA   LEU  15           HA       LEU  15 -12.937 -11.589  -1.351
  122    HB2  LEU  15           HB2      LEU  15 -13.251 -11.365   1.137
  123    HB3  LEU  15           HB1      LEU  15 -13.787  -9.727   0.883
  124    HG   LEU  15           HG       LEU  15 -15.569 -11.475   1.314
  125   HD11  LEU  15          HD11      LEU  15 -17.106 -10.479  -0.373
  126   HD12  LEU  15          HD12      LEU  15 -15.704  -9.684  -1.099
  127   HD13  LEU  15          HD13      LEU  15 -16.176  -9.301   0.558
  128   HD21  LEU  15          HD21      LEU  15 -14.871 -12.188  -1.521
  129   HD22  LEU  15          HD22      LEU  15 -16.308 -12.741  -0.660
  130   HD23  LEU  15          HD23      LEU  15 -14.705 -13.217  -0.100
  131    H    LYS  16           HN       LYS  16 -13.818 -10.954  -3.239
  132    HA   LYS  16           HA       LYS  16 -14.393  -8.083  -3.565
  133    HB2  LYS  16           HB2      LYS  16 -13.833 -10.097  -5.751
  134    HB3  LYS  16           HB1      LYS  16 -14.122  -8.385  -5.980
  135    HG2  LYS  16           HG2      LYS  16 -11.844  -8.425  -6.113
  136    HG3  LYS  16           HG1      LYS  16 -12.031  -8.159  -4.385
  137    HD2  LYS  16           HD2      LYS  16 -10.378  -9.885  -5.045
  138    HD3  LYS  16           HD1      LYS  16 -11.600 -10.432  -3.900
  139    HE2  LYS  16           HE2      LYS  16 -12.855 -11.344  -5.912
  140    HE3  LYS  16           HE1      LYS  16 -11.397 -11.023  -6.849
  141    HZ1  LYS  16           HZ1      LYS  16 -10.165 -12.478  -5.330
  142    HZ2  LYS  16           HZ2      LYS  16 -11.430 -13.307  -6.102
  143    HZ3  LYS  16           HZ3      LYS  16 -11.598 -12.822  -4.490
  144    H    GLY  17           HN       GLY  17 -16.349  -7.470  -4.466
  145    HA2  GLY  17           HA2      GLY  17 -18.349  -9.122  -5.403
  146    HA3  GLY  17           HA1      GLY  17 -18.550  -9.065  -3.657
  147    H    GLU  18           HN       GLU  18 -20.645  -8.143  -4.698
  148    HA   GLU  18           HA       GLU  18 -20.497  -5.232  -4.472
  149    HB2  GLU  18           HB2      GLU  18 -21.945  -6.645  -6.738
  150    HB3  GLU  18           HB1      GLU  18 -21.897  -4.908  -6.462
  151    HG2  GLU  18           HG2      GLU  18 -19.844  -4.687  -7.369
  152    HG3  GLU  18           HG1      GLU  18 -19.284  -6.238  -6.744
  153    H    THR  19           HN       THR  19 -22.781  -4.323  -4.226
  154    HA   THR  19           HA       THR  19 -24.915  -6.106  -3.613
  155    HB   THR  19           HB       THR  19 -23.477  -6.549  -1.651
  156    HG1  THR  19           HG1      THR  19 -25.385  -5.323  -0.234
  157   HG21  THR  19          HG21      THR  19 -23.942  -3.616  -1.049
  158   HG22  THR  19          HG22      THR  19 -22.398  -4.339  -1.498
  159   HG23  THR  19          HG23      THR  19 -23.162  -4.769   0.037
  160    H    THR  20           HN       THR  20 -26.744  -4.935  -2.487
  161    HA   THR  20           HA       THR  20 -26.723  -2.038  -2.954
  162    HB   THR  20           HB       THR  20 -29.125  -2.303  -3.794
  163    HG1  THR  20           HG1      THR  20 -29.167  -4.600  -3.130
  164   HG21  THR  20          HG21      THR  20 -26.847  -3.365  -5.476
  165   HG22  THR  20          HG22      THR  20 -27.356  -1.681  -5.341
  166   HG23  THR  20          HG23      THR  20 -28.411  -2.865  -6.117
  167    H    THR  21           HN       THR  21 -28.483  -0.908  -1.801
  168    HA   THR  21           HA       THR  21 -29.891  -2.361   0.255
  169    HB   THR  21           HB       THR  21 -27.521  -1.997   1.208
  170    HG1  THR  21           HG1      THR  21 -29.658  -0.807   2.689
  171   HG21  THR  21          HG21      THR  21 -27.236   0.362   0.430
  172   HG22  THR  21          HG22      THR  21 -27.080   0.231   2.185
  173   HG23  THR  21          HG23      THR  21 -28.572   0.846   1.474
  174    H    GLU  22           HN       GLU  22 -31.500  -1.073   1.285
  175    HA   GLU  22           HA       GLU  22 -32.172   1.310  -0.279
  176    HB2  GLU  22           HB2      GLU  22 -34.398   1.110   0.737
  177    HB3  GLU  22           HB1      GLU  22 -33.932  -0.454   0.075
  178    HG2  GLU  22           HG2      GLU  22 -33.431   0.160   2.972
  179    HG3  GLU  22           HG1      GLU  22 -35.075  -0.316   2.407
  180    H    ALA  23           HN       ALA  23 -31.959   3.333   0.505
  181    HA   ALA  23           HA       ALA  23 -31.899   3.738   3.426
  182    HB1  ALA  23           HB1      ALA  23 -29.759   4.857   1.593
  183    HB2  ALA  23           HB2      ALA  23 -29.539   3.463   2.651
  184    HB3  ALA  23           HB3      ALA  23 -29.870   5.050   3.345
  185    H    VAL  24           HN       VAL  24 -32.302   6.034   3.994
  186    HA   VAL  24           HA       VAL  24 -33.755   7.404   1.851
  187    HB   VAL  24           HB       VAL  24 -34.757   8.762   3.697
  188   HG11  VAL  24          HG11      VAL  24 -35.950   6.880   2.755
  189   HG12  VAL  24          HG12      VAL  24 -36.238   6.964   4.494
  190   HG13  VAL  24          HG13      VAL  24 -35.114   5.772   3.840
  191   HG21  VAL  24          HG21      VAL  24 -33.378   6.739   5.462
  192   HG22  VAL  24          HG22      VAL  24 -34.555   7.940   5.993
  193   HG23  VAL  24          HG23      VAL  24 -32.992   8.457   5.361
  194    H    ASP  25           HN       ASP  25 -30.731   7.463   2.839
  195    HA   ASP  25           HA       ASP  25 -30.223  10.117   1.972
  196    HB2  ASP  25           HB2      ASP  25 -30.911  10.609   4.311
  197    HB3  ASP  25           HB1      ASP  25 -29.647   9.533   4.890
  198    H    ALA  26           HN       ALA  26 -27.884  10.564   1.935
  199    HA   ALA  26           HA       ALA  26 -26.471   8.238   1.074
  200    HB1  ALA  26           HB1      ALA  26 -25.527  11.084   1.445
  201    HB2  ALA  26           HB2      ALA  26 -26.165  10.377  -0.041
  202    HB3  ALA  26           HB3      ALA  26 -24.627   9.812   0.617
  203    H    ALA  27           HN       ALA  27 -26.159  10.418   3.865
  204    HA   ALA  27           HA       ALA  27 -23.783   9.221   4.876
  205    HB1  ALA  27           HB1      ALA  27 -24.463  11.502   5.469
  206    HB2  ALA  27           HB2      ALA  27 -24.209  10.502   6.899
  207    HB3  ALA  27           HB3      ALA  27 -25.848  10.856   6.350
  208    H    THR  28           HN       THR  28 -27.140   8.460   5.097
  209    HA   THR  28           HA       THR  28 -26.940   6.754   7.382
  210    HB   THR  28           HB       THR  28 -29.094   6.605   5.268
  211    HG1  THR  28           HG1      THR  28 -28.545   8.600   7.164
  212   HG21  THR  28          HG21      THR  28 -29.070   6.063   8.244
  213   HG22  THR  28          HG22      THR  28 -29.173   4.854   6.965
  214   HG23  THR  28          HG23      THR  28 -30.502   5.991   7.217
  215    H    ALA  29           HN       ALA  29 -26.313   6.404   4.003
  216    HA   ALA  29           HA       ALA  29 -26.677   3.540   3.908
  217    HB1  ALA  29           HB1      ALA  29 -25.798   3.707   1.642
  218    HB2  ALA  29           HB2      ALA  29 -25.353   5.390   1.924
  219    HB3  ALA  29           HB3      ALA  29 -27.052   4.920   1.904
  220    H    GLU  30           HN       GLU  30 -24.058   5.855   4.150
  221    HA   GLU  30           HA       GLU  30 -21.827   4.221   3.975
  222    HB2  GLU  30           HB2      GLU  30 -21.985   6.797   4.266
  223    HB3  GLU  30           HB1      GLU  30 -22.096   6.449   5.981
  224    HG2  GLU  30           HG2      GLU  30 -19.930   5.041   5.534
  225    HG3  GLU  30           HG1      GLU  30 -19.791   6.134   4.156
  226    H    LYS  31           HN       LYS  31 -23.462   5.280   6.943
  227    HA   LYS  31           HA       LYS  31 -22.048   3.848   8.803
  228    HB2  LYS  31           HB2      LYS  31 -25.010   4.430   8.928
  229    HB3  LYS  31           HB1      LYS  31 -23.944   4.135  10.293
  230    HG2  LYS  31           HG2      LYS  31 -23.627   6.452   8.398
  231    HG3  LYS  31           HG1      LYS  31 -24.531   6.529   9.913
  232    HD2  LYS  31           HD2      LYS  31 -22.508   5.927  11.153
  233    HD3  LYS  31           HD1      LYS  31 -21.607   5.829   9.638
  234    HE2  LYS  31           HE2      LYS  31 -21.860   8.159   9.239
  235    HE3  LYS  31           HE1      LYS  31 -23.028   8.323  10.546
  236    HZ1  LYS  31           HZ1      LYS  31 -21.249   7.774  12.118
  237    HZ2  LYS  31           HZ2      LYS  31 -20.897   9.173  11.232
  238    HZ3  LYS  31           HZ3      LYS  31 -20.134   7.708  10.844
  239    H    VAL  32           HN       VAL  32 -24.776   2.704   6.857
  240    HA   VAL  32           HA       VAL  32 -25.032   0.230   8.296
  241    HB   VAL  32           HB       VAL  32 -26.152   1.042   5.611
  242   HG11  VAL  32          HG11      VAL  32 -26.762  -1.357   7.335
  243   HG12  VAL  32          HG12      VAL  32 -26.034  -1.356   5.729
  244   HG13  VAL  32          HG13      VAL  32 -27.712  -0.853   5.937
  245   HG21  VAL  32          HG21      VAL  32 -26.977   2.418   7.440
  246   HG22  VAL  32          HG22      VAL  32 -27.441   0.972   8.339
  247   HG23  VAL  32          HG23      VAL  32 -28.247   1.365   6.821
  248    H    PHE  33           HN       PHE  33 -23.943   1.046   4.999
  249    HA   PHE  33           HA       PHE  33 -23.023  -1.536   4.354
  250    HB2  PHE  33           HB2      PHE  33 -22.620   1.172   3.205
  251    HB3  PHE  33           HB1      PHE  33 -21.425  -0.039   2.793
  252    HD1  PHE  33           HD1      PHE  33 -23.583  -2.329   2.929
  253    HD2  PHE  33           HD2      PHE  33 -23.322   1.407   0.909
  254    HE1  PHE  33           HE1      PHE  33 -25.024  -3.201   1.136
  255    HE2  PHE  33           HE2      PHE  33 -24.766   0.547  -0.886
  256    HZ   PHE  33           HZ       PHE  33 -25.622  -1.763  -0.775
  257    H    LYS  34           HN       LYS  34 -21.499   0.977   6.241
  258    HA   LYS  34           HA       LYS  34 -18.865  -0.011   5.997
  259    HB2  LYS  34           HB2      LYS  34 -20.252   1.802   7.930
  260    HB3  LYS  34           HB1      LYS  34 -18.590   1.340   8.203
  261    HG2  LYS  34           HG2      LYS  34 -18.256   2.139   5.748
  262    HG3  LYS  34           HG1      LYS  34 -19.763   3.016   6.031
  263    HD2  LYS  34           HD2      LYS  34 -17.920   4.499   6.546
  264    HD3  LYS  34           HD1      LYS  34 -18.739   4.042   8.041
  265    HE2  LYS  34           HE2      LYS  34 -17.047   2.457   8.583
  266    HE3  LYS  34           HE1      LYS  34 -16.283   2.650   7.008
  267    HZ1  LYS  34           HZ1      LYS  34 -15.241   3.841   8.975
  268    HZ2  LYS  34           HZ2      LYS  34 -16.551   4.919   8.886
  269    HZ3  LYS  34           HZ3      LYS  34 -15.497   4.758   7.570
  270    H    GLN  35           HN       GLN  35 -21.469  -0.621   8.311
  271    HA   GLN  35           HA       GLN  35 -19.935  -2.415   9.913
  272    HB2  GLN  35           HB2      GLN  35 -22.026  -1.262  10.688
  273    HB3  GLN  35           HB1      GLN  35 -22.956  -2.292   9.613
  274    HG2  GLN  35           HG2      GLN  35 -23.043  -3.099  11.896
  275    HG3  GLN  35           HG1      GLN  35 -22.219  -4.259  10.854
  276   HE21  GLN  35          HE21      GLN  35 -21.838  -1.928  13.423
  277   HE22  GLN  35          HE22      GLN  35 -20.257  -2.439  13.906
  278    H    TYR  36           HN       TYR  36 -21.869  -2.640   7.044
  279    HA   TYR  36           HA       TYR  36 -22.077  -5.438   6.780
  280    HB2  TYR  36           HB2      TYR  36 -23.456  -4.136   5.356
  281    HB3  TYR  36           HB1      TYR  36 -22.113  -3.116   4.863
  282    HD1  TYR  36           HD1      TYR  36 -23.120  -6.735   4.659
  283    HD2  TYR  36           HD2      TYR  36 -21.264  -3.393   2.801
  284    HE1  TYR  36           HE1      TYR  36 -22.776  -8.066   2.612
  285    HE2  TYR  36           HE2      TYR  36 -20.913  -4.692   0.756
  286    HH   TYR  36           HH       TYR  36 -22.379  -7.799   0.282
  287    H    ALA  37           HN       ALA  37 -19.783  -3.123   5.380
  288    HA   ALA  37           HA       ALA  37 -18.073  -5.019   4.190
  289    HB1  ALA  37           HB1      ALA  37 -18.168  -2.606   3.615
  290    HB2  ALA  37           HB2      ALA  37 -16.527  -3.169   3.938
  291    HB3  ALA  37           HB3      ALA  37 -17.397  -2.239   5.157
  292    H    ASN  38           HN       ASN  38 -18.214  -3.566   7.373
  293    HA   ASN  38           HA       ASN  38 -15.698  -4.293   8.374
  294    HB2  ASN  38           HB2      ASN  38 -17.176  -2.667   9.514
  295    HB3  ASN  38           HB1      ASN  38 -18.305  -3.965   9.901
  296   HD21  ASN  38          HD21      ASN  38 -17.867  -5.344  11.590
  297   HD22  ASN  38          HD22      ASN  38 -16.500  -5.115  12.698
  298    H    ASP  39           HN       ASP  39 -18.751  -6.075   8.351
  299    HA   ASP  39           HA       ASP  39 -17.918  -8.242   9.940
  300    HB2  ASP  39           HB2      ASP  39 -20.273  -7.809   9.462
  301    HB3  ASP  39           HB1      ASP  39 -20.007  -8.142   7.755
  302    H    ASN  40           HN       ASN  40 -17.341  -7.454   6.615
  303    HA   ASN  40           HA       ASN  40 -16.354 -10.146   6.028
  304    HB2  ASN  40           HB2      ASN  40 -17.066  -7.770   4.343
  305    HB3  ASN  40           HB1      ASN  40 -15.974  -8.991   3.707
  306   HD21  ASN  40          HD21      ASN  40 -19.228  -8.213   4.566
  307   HD22  ASN  40          HD22      ASN  40 -19.963  -9.705   3.976
  308    H    GLY  41           HN       GLY  41 -15.228  -7.356   7.360
  309    HA2  GLY  41           HA2      GLY  41 -13.086  -6.748   7.954
  310    HA3  GLY  41           HA1      GLY  41 -12.491  -8.157   7.089
  311    H    VAL  42           HN       VAL  42 -14.532  -5.877   5.457
  312    HA   VAL  42           HA       VAL  42 -12.220  -5.093   3.852
  313    HB   VAL  42           HB       VAL  42 -15.167  -5.110   3.165
  314   HG11  VAL  42          HG11      VAL  42 -12.791  -4.387   1.439
  315   HG12  VAL  42          HG12      VAL  42 -13.962  -3.242   2.094
  316   HG13  VAL  42          HG13      VAL  42 -14.477  -4.457   0.922
  317   HG21  VAL  42          HG21      VAL  42 -12.822  -6.783   2.285
  318   HG22  VAL  42          HG22      VAL  42 -14.421  -6.837   1.538
  319   HG23  VAL  42          HG23      VAL  42 -14.217  -7.317   3.225
  320    H    ASP  43           HN       ASP  43 -11.426  -3.325   4.761
  321    HA   ASP  43           HA       ASP  43 -13.199  -1.010   4.876
  322    HB2  ASP  43           HB2      ASP  43 -12.242  -0.193   6.993
  323    HB3  ASP  43           HB1      ASP  43 -12.869  -1.821   7.243
  324    H    GLY  44           HN       GLY  44 -12.322   0.851   4.066
  325    HA2  GLY  44           HA2      GLY  44  -9.577   1.311   3.635
  326    HA3  GLY  44           HA1      GLY  44 -10.299   0.631   2.183
  327    H    GLU  45           HN       GLU  45  -9.583   2.799   1.364
  328    HA   GLU  45           HA       GLU  45 -10.789   5.207   2.184
  329    HB2  GLU  45           HB2      GLU  45  -9.449   4.273  -0.318
  330    HB3  GLU  45           HB1      GLU  45 -10.314   5.803  -0.341
  331    HG2  GLU  45           HG2      GLU  45  -7.878   5.992   0.102
  332    HG3  GLU  45           HG1      GLU  45  -8.900   6.718   1.343
  333    H    TRP  46           HN       TRP  46 -12.590   6.323   1.473
  334    HA   TRP  46           HA       TRP  46 -14.574   4.614   0.121
  335    HB2  TRP  46           HB2      TRP  46 -14.859   6.344   2.536
  336    HB3  TRP  46           HB1      TRP  46 -16.223   6.267   1.437
  337    HD1  TRP  46           HD1      TRP  46 -13.850   3.652   3.056
  338    HE1  TRP  46           HE1      TRP  46 -15.255   1.679   3.899
  339    HE3  TRP  46           HE3      TRP  46 -18.545   5.259   1.654
  340    HZ2  TRP  46           HZ2      TRP  46 -17.932   0.901   3.979
  341    HZ3  TRP  46           HZ3      TRP  46 -20.454   3.813   2.184
  342    HH2  TRP  46           HH2      TRP  46 -20.151   1.680   3.312
  343    H    THR  47           HN       THR  47 -15.359   5.321  -1.707
  344    HA   THR  47           HA       THR  47 -15.263   8.202  -2.283
  345    HB   THR  47           HB       THR  47 -15.003   7.453  -4.731
  346    HG1  THR  47           HG1      THR  47 -14.422   5.053  -3.332
  347   HG21  THR  47          HG21      THR  47 -13.212   8.564  -3.494
  348   HG22  THR  47          HG22      THR  47 -12.553   7.296  -4.531
  349   HG23  THR  47          HG23      THR  47 -12.722   7.020  -2.799
  350    H    TYR  48           HN       TYR  48 -16.921   8.904  -3.865
  351    HA   TYR  48           HA       TYR  48 -19.215   7.112  -4.014
  352    HB2  TYR  48           HB2      TYR  48 -19.726   8.233  -1.965
  353    HB3  TYR  48           HB1      TYR  48 -19.350   9.802  -2.619
  354    HD1  TYR  48           HD1      TYR  48 -21.085  11.092  -3.776
  355    HD2  TYR  48           HD2      TYR  48 -21.742   6.994  -2.754
  356    HE1  TYR  48           HE1      TYR  48 -23.455  11.323  -4.344
  357    HE2  TYR  48           HE2      TYR  48 -24.116   7.239  -3.330
  358    HH   TYR  48           HH       TYR  48 -25.780   9.040  -3.485
  359    H    ASP  49           HN       ASP  49 -20.536   7.437  -5.780
  360    HA   ASP  49           HA       ASP  49 -19.759   9.708  -7.531
  361    HB2  ASP  49           HB2      ASP  49 -20.282   8.285  -9.485
  362    HB3  ASP  49           HB1      ASP  49 -19.060   7.488  -8.501
  363    H    ASP  50           HN       ASP  50 -21.505  10.731  -8.664
  364    HA   ASP  50           HA       ASP  50 -24.083  10.382  -7.258
  365    HB2  ASP  50           HB2      ASP  50 -23.024  12.702  -7.452
  366    HB3  ASP  50           HB1      ASP  50 -23.335  12.609  -9.181
  367    H    ALA  51           HN       ALA  51 -22.483  10.033 -10.279
  368    HA   ALA  51           HA       ALA  51 -24.626  10.009 -12.062
  369    HB1  ALA  51           HB1      ALA  51 -22.274  10.139 -12.747
  370    HB2  ALA  51           HB2      ALA  51 -23.140   8.859 -13.596
  371    HB3  ALA  51           HB3      ALA  51 -22.050   8.453 -12.272
  372    H    THR  52           HN       THR  52 -23.386   7.426  -9.991
  373    HA   THR  52           HA       THR  52 -25.662   5.837 -10.905
  374    HB   THR  52           HB       THR  52 -23.718   4.948 -12.102
  375    HG1  THR  52           HG1      THR  52 -23.947   2.719 -10.979
  376   HG21  THR  52          HG21      THR  52 -22.133   3.553 -10.742
  377   HG22  THR  52          HG22      THR  52 -22.673   4.514  -9.366
  378   HG23  THR  52          HG23      THR  52 -21.893   5.299 -10.735
  379    H    LYS  53           HN       LYS  53 -24.872   7.442  -8.429
  380    HA   LYS  53           HA       LYS  53 -24.930   7.296  -6.115
  381    HB2  LYS  53           HB2      LYS  53 -27.220   5.549  -7.016
  382    HB3  LYS  53           HB1      LYS  53 -26.863   5.760  -5.318
  383    HG2  LYS  53           HG2      LYS  53 -28.610   7.283  -6.029
  384    HG3  LYS  53           HG1      LYS  53 -27.178   8.164  -5.502
  385    HD2  LYS  53           HD2      LYS  53 -26.530   8.382  -7.911
  386    HD3  LYS  53           HD1      LYS  53 -28.093   7.687  -8.336
  387    HE2  LYS  53           HE2      LYS  53 -29.242   9.512  -7.247
  388    HE3  LYS  53           HE1      LYS  53 -27.711  10.175  -6.681
  389    HZ1  LYS  53           HZ1      LYS  53 -28.282  11.431  -8.546
  390    HZ2  LYS  53           HZ2      LYS  53 -28.758  10.082  -9.446
  391    HZ3  LYS  53           HZ3      LYS  53 -27.111  10.350  -9.124
  392    H    THR  54           HN       THR  54 -22.912   5.766  -7.127
  393    HA   THR  54           HA       THR  54 -23.142   3.219  -5.701
  394    HB   THR  54           HB       THR  54 -21.394   3.960  -8.091
  395    HG1  THR  54           HG1      THR  54 -23.782   3.401  -8.161
  396   HG21  THR  54          HG21      THR  54 -20.238   2.367  -6.496
  397   HG22  THR  54          HG22      THR  54 -20.654   1.610  -8.037
  398   HG23  THR  54          HG23      THR  54 -21.639   1.294  -6.606
  399    H    TYR  55           HN       TYR  55 -21.986   2.877  -3.961
  400    HA   TYR  55           HA       TYR  55 -19.873   4.744  -3.192
  401    HB2  TYR  55           HB2      TYR  55 -21.398   2.618  -1.650
  402    HB3  TYR  55           HB1      TYR  55 -19.855   3.222  -1.062
  403    HD1  TYR  55           HD1      TYR  55 -23.323   4.125  -1.823
  404    HD2  TYR  55           HD2      TYR  55 -19.666   5.424  -0.074
  405    HE1  TYR  55           HE1      TYR  55 -24.501   6.006  -0.766
  406    HE2  TYR  55           HE2      TYR  55 -20.837   7.307   0.984
  407    HH   TYR  55           HH       TYR  55 -24.286   7.520   1.045
  408    H    THR  56           HN       THR  56 -17.760   4.245  -3.282
  409    HA   THR  56           HA       THR  56 -17.090   1.468  -4.002
  410    HB   THR  56           HB       THR  56 -15.540   3.910  -4.879
  411    HG1  THR  56           HG1      THR  56 -17.927   3.110  -5.731
  412   HG21  THR  56          HG21      THR  56 -14.543   2.372  -6.507
  413   HG22  THR  56          HG22      THR  56 -15.550   1.054  -5.910
  414   HG23  THR  56          HG23      THR  56 -14.309   1.752  -4.872
  415    H    VAL  57           HN       VAL  57 -15.936   0.503  -2.476
  416    HA   VAL  57           HA       VAL  57 -14.209   2.175  -0.774
  417    HB   VAL  57           HB       VAL  57 -15.897   0.952   0.595
  418   HG11  VAL  57          HG11      VAL  57 -16.331  -1.038  -0.642
  419   HG12  VAL  57          HG12      VAL  57 -15.613  -1.530   0.888
  420   HG13  VAL  57          HG13      VAL  57 -14.637  -1.513  -0.577
  421   HG21  VAL  57          HG21      VAL  57 -14.356  -0.028   2.203
  422   HG22  VAL  57          HG22      VAL  57 -13.732   1.490   1.561
  423   HG23  VAL  57          HG23      VAL  57 -13.081  -0.047   0.988
  424    H    THR  58           HN       THR  58 -12.093   1.876  -0.928
  425    HA   THR  58           HA       THR  58 -11.193  -0.380  -2.588
  426    HB   THR  58           HB       THR  58  -9.913   2.352  -2.609
  427    HG1  THR  58           HG1      THR  58 -12.251   1.546  -3.700
  428   HG21  THR  58          HG21      THR  58  -9.795   0.054  -4.574
  429   HG22  THR  58          HG22      THR  58  -8.542   0.444  -3.395
  430   HG23  THR  58          HG23      THR  58  -8.918   1.582  -4.688
  431    H    GLU  59           HN       GLU  59 -10.111  -1.701  -1.398
  432    HA   GLU  59           HA       GLU  59  -8.746  -1.084   0.979
  433    HB2  GLU  59           HB2      GLU  59  -8.634  -3.488  -0.831
  434    HB3  GLU  59           HB1      GLU  59  -7.619  -3.369   0.577
  435    HG2  GLU  59           HG2      GLU  59  -9.805  -4.619   0.833
  436    HG3  GLU  59           HG1      GLU  59  -9.394  -3.419   2.055
  437    H    GLY  60           HN       GLY  60  -7.304   0.670   0.615
  438    HA2  GLY  60           HA2      GLY  60  -5.303   0.654  -1.407
  439    HA3  GLY  60           HA1      GLY  60  -5.276   1.623   0.070
  440    H    SER  61           HN       SER  61  -3.882  -0.898  -1.592
  441    HA   SER  61           HA       SER  61  -2.221  -1.618   0.687
  442    HB2  SER  61           HB2      SER  61  -2.472  -4.089  -0.108
  443    HB3  SER  61           HB1      SER  61  -3.772  -3.396   0.870
  444    HG   SER  61           HG       SER  61  -4.975  -3.074  -0.995
  445    H    GLY  62           HN       GLY  62  -2.764  -2.851  -2.608
  446    HA2  GLY  62           HA2      GLY  62  -0.741  -1.525  -3.940
  447    HA3  GLY  62           HA1      GLY  62   0.018  -2.937  -3.211
  448    H    GLY  63           HN       GLY  63  -0.060  -2.624  -5.960
  449    HA2  GLY  63           HA2      GLY  63  -2.072  -4.648  -6.743
  450    HA3  GLY  63           HA1      GLY  63  -1.499  -3.380  -7.822
  451    H    ALA  64           HN       ALA  64   1.235  -3.505  -7.152
  452    HA   ALA  64           HA       ALA  64   1.917  -6.042  -8.458
  453    HB1  ALA  64           HB1      ALA  64   2.590  -4.031  -9.669
  454    HB2  ALA  64           HB2      ALA  64   4.000  -4.947  -9.131
  455    HB3  ALA  64           HB3      ALA  64   3.512  -3.490  -8.267
  456    H    GLY  65           HN       GLY  65   2.078  -7.435  -6.760
  457    HA2  GLY  65           HA2      GLY  65   3.289  -6.796  -4.269
  458    HA3  GLY  65           HA1      GLY  65   2.875  -8.403  -4.843
  459    H    GLY  66           HN       GLY  66   4.597  -7.812  -7.303
  460    HA2  GLY  66           HA2      GLY  66   6.964  -9.023  -6.275
  461    HA3  GLY  66           HA1      GLY  66   6.723  -8.464  -7.923
  462    H    GLN  67           HN       GLN  67   6.087  -5.777  -7.189
  463    HA   GLN  67           HA       GLN  67   7.083  -3.754  -7.073
  464    HB2  GLN  67           HB2      GLN  67   7.147  -4.479  -4.648
  465    HB3  GLN  67           HB1      GLN  67   8.844  -4.956  -4.916
  466    HG2  GLN  67           HG2      GLN  67   9.173  -2.556  -5.747
  467    HG3  GLN  67           HG1      GLN  67   7.622  -2.211  -4.985
  468   HE21  GLN  67          HE21      GLN  67   8.461  -0.856  -3.481
  469   HE22  GLN  67          HE22      GLN  67   9.472  -1.374  -2.178
  470    H    GLY  68           HN       GLY  68   9.956  -5.628  -6.158
  471    HA2  GLY  68           HA2      GLY  68  11.545  -6.144  -8.034
  472    HA3  GLY  68           HA1      GLY  68  11.312  -4.468  -8.513
  473    H    MET  69           HN       MET  69  11.220  -3.808  -5.523
  474    HA   MET  69           HA       MET  69  12.661  -2.900  -4.017
  475    HB2  MET  69           HB2      MET  69  14.256  -5.350  -4.795
  476    HB3  MET  69           HB1      MET  69  14.727  -4.261  -3.496
  477    HG2  MET  69           HG2      MET  69  12.656  -4.738  -2.322
  478    HG3  MET  69           HG1      MET  69  12.136  -5.790  -3.635
  479    HE1  MET  69           HE1      MET  69  12.885  -8.269  -0.660
  480    HE2  MET  69           HE2      MET  69  11.683  -7.756  -1.846
  481    HE3  MET  69           HE3      MET  69  12.188  -6.651  -0.568
  482    H    ILE  70           HN       ILE  70  12.753  -1.927  -6.691
  483    HA   ILE  70           HA       ILE  70  15.492  -0.891  -6.759
  484    HB   ILE  70           HB       ILE  70  13.971  -1.823  -9.229
  485   HG12  ILE  70          HG12      ILE  70  16.593  -2.804  -8.073
  486   HG13  ILE  70          HG11      ILE  70  15.043  -3.628  -7.913
  487   HG21  ILE  70          HG21      ILE  70  16.725  -0.571  -9.093
  488   HG22  ILE  70          HG22      ILE  70  15.263   0.284  -9.589
  489   HG23  ILE  70          HG23      ILE  70  15.861  -1.076 -10.545
  490   HD11  ILE  70          HD11      ILE  70  16.484  -3.066 -10.500
  491   HD12  ILE  70          HD12      ILE  70  14.935  -3.893 -10.339
  492   HD13  ILE  70          HD13      ILE  70  16.397  -4.626  -9.677
  493    H    GLN  71           HN       GLN  71  14.557   0.967  -5.737
  494    HA   GLN  71           HA       GLN  71  12.731   2.504  -7.445
  495    HB2  GLN  71           HB2      GLN  71  12.128   3.784  -5.495
  496    HB3  GLN  71           HB1      GLN  71  12.003   2.081  -5.098
  497    HG2  GLN  71           HG2      GLN  71  14.455   3.670  -4.453
  498    HG3  GLN  71           HG1      GLN  71  13.056   3.641  -3.380
  499   HE21  GLN  71          HE21      GLN  71  12.383   0.881  -3.924
  500   HE22  GLN  71          HE22      GLN  71  13.571  -0.086  -3.112
  501    H    GLU  72           HN       GLU  72  15.777   2.094  -7.398
  502    HA   GLU  72           HA       GLU  72  16.867   4.674  -6.854
  503    HB2  GLU  72           HB2      GLU  72  17.994   2.273  -8.292
  504    HB3  GLU  72           HB1      GLU  72  18.906   3.737  -7.957
  505    HG2  GLU  72           HG2      GLU  72  18.543   3.394  -5.554
  506    HG3  GLU  72           HG1      GLU  72  17.701   1.885  -5.912
  507    HA   PRO  73           HA       PRO  73  15.802   6.415 -10.803
  508    HB2  PRO  73           HB2      PRO  73  16.913   8.842 -10.460
  509    HB3  PRO  73           HB1      PRO  73  15.463   8.327  -9.512
  510    HG2  PRO  73           HG2      PRO  73  18.367   8.355  -8.692
  511    HG3  PRO  73           HG1      PRO  73  16.940   8.883  -7.780
  512    HD2  PRO  73           HD2      PRO  73  18.150   6.443  -7.446
  513    HD3  PRO  73           HD1      PRO  73  16.412   6.757  -7.119
  514    H    ALA  74           HN       ALA  74  17.109   8.055 -12.291
  515    HA   ALA  74           HA       ALA  74  18.732   8.447 -13.779
  516    HB1  ALA  74           HB1      ALA  74  21.051   7.994 -13.294
  517    HB2  ALA  74           HB2      ALA  74  20.591   6.934 -11.960
  518    HB3  ALA  74           HB3      ALA  74  20.249   8.662 -11.872
  519    H    LEU  75           HN       LEU  75  18.276   7.485 -15.592
  520    HA   LEU  75           HA       LEU  75  18.468   4.578 -15.793
  521    HB2  LEU  75           HB2      LEU  75  17.145   6.674 -17.495
  522    HB3  LEU  75           HB1      LEU  75  17.408   5.052 -18.094
  523    HG   LEU  75           HG       LEU  75  15.145   5.232 -17.334
  524   HD11  LEU  75          HD11      LEU  75  16.770   3.691 -15.318
  525   HD12  LEU  75          HD12      LEU  75  16.253   3.112 -16.901
  526   HD13  LEU  75          HD13      LEU  75  15.053   3.470 -15.659
  527   HD21  LEU  75          HD21      LEU  75  15.387   7.125 -15.829
  528   HD22  LEU  75          HD22      LEU  75  16.260   6.115 -14.677
  529   HD23  LEU  75          HD23      LEU  75  14.563   5.786 -15.031
  530    HA   PRO  76           HA       PRO  76  22.162   4.930 -18.269
  531    HB2  PRO  76           HB2      PRO  76  21.303   2.591 -19.872
  532    HB3  PRO  76           HB1      PRO  76  22.671   2.700 -18.760
  533    HG2  PRO  76           HG2      PRO  76  20.529   1.212 -18.164
  534    HG3  PRO  76           HG1      PRO  76  21.372   2.181 -16.903
  535    HD2  PRO  76           HD2      PRO  76  18.842   2.905 -18.442
  536    HD3  PRO  76           HD1      PRO  76  19.139   2.953 -16.688
  537    HA   PRO  77           HA       PRO  77  21.075   6.970 -22.056
  538    HB2  PRO  77           HB2      PRO  77  23.138   6.363 -23.722
  539    HB3  PRO  77           HB1      PRO  77  23.315   7.488 -22.365
  540    HG2  PRO  77           HG2      PRO  77  23.948   4.568 -22.502
  541    HG3  PRO  77           HG1      PRO  77  24.985   5.893 -21.922
  542    HD2  PRO  77           HD2      PRO  77  23.653   4.380 -20.147
  543    HD3  PRO  77           HD1      PRO  77  23.750   6.171 -19.934
  544    H    GLY  78           HN       GLY  78  19.662   6.464 -23.609
  545    HA2  GLY  78           HA2      GLY  78  18.824   5.169 -25.409
  546    HA3  GLY  78           HA1      GLY  78  19.815   3.820 -24.877
  547    H    TRP  79           HN       TRP  79  18.814   4.179 -22.040
  548    HA   TRP  79           HA       TRP  79  16.382   2.575 -22.431
  549    HB2  TRP  79           HB2      TRP  79  18.132   3.095 -20.005
  550    HB3  TRP  79           HB1      TRP  79  16.593   2.254 -19.895
  551    HD1  TRP  79           HD1      TRP  79  20.105   1.833 -21.436
  552    HE1  TRP  79           HE1      TRP  79  20.498  -0.686 -21.837
  553    HE3  TRP  79           HE3      TRP  79  15.475   0.075 -20.191
  554    HZ2  TRP  79           HZ2      TRP  79  19.028  -3.095 -21.637
  555    HZ3  TRP  79           HZ3      TRP  79  15.043  -2.334 -20.320
  556    HH2  TRP  79           HH2      TRP  79  16.778  -3.890 -21.029
  557    H    GLU  80           HN       GLU  80  14.330   3.189 -21.698
  558    HA   GLU  80           HA       GLU  80  14.082   5.847 -20.455
  559    HB2  GLU  80           HB2      GLU  80  13.314   5.792 -22.832
  560    HB3  GLU  80           HB1      GLU  80  12.209   4.497 -22.415
  561    HG2  GLU  80           HG2      GLU  80  11.000   6.547 -22.567
  562    HG3  GLU  80           HG1      GLU  80  11.034   6.017 -20.887
  563    H    MET  81           HN       MET  81  12.473   6.087 -18.872
  564    HA   MET  81           HA       MET  81  11.240   3.588 -17.926
  565    HB2  MET  81           HB2      MET  81  13.162   3.981 -16.506
  566    HB3  MET  81           HB1      MET  81  12.669   5.668 -16.259
  567    HG2  MET  81           HG2      MET  81  10.583   4.759 -15.174
  568    HG3  MET  81           HG1      MET  81  11.367   3.191 -15.207
  569    HE1  MET  81           HE1      MET  81  10.740   3.433 -12.470
  570    HE2  MET  81           HE2      MET  81  10.314   5.135 -12.654
  571    HE3  MET  81           HE3      MET  81  11.509   4.651 -11.452
  572    H    LYS  82           HN       LYS  82   9.074   3.785 -17.481
  573    HA   LYS  82           HA       LYS  82   7.935   6.351 -16.780
  574    HB2  LYS  82           HB2      LYS  82   7.077   4.978 -19.356
  575    HB3  LYS  82           HB1      LYS  82   6.256   6.339 -18.628
  576    HG2  LYS  82           HG2      LYS  82   8.180   7.758 -19.010
  577    HG3  LYS  82           HG1      LYS  82   9.083   6.364 -19.680
  578    HD2  LYS  82           HD2      LYS  82   7.398   6.160 -21.453
  579    HD3  LYS  82           HD1      LYS  82   6.535   7.549 -20.797
  580    HE2  LYS  82           HE2      LYS  82   9.343   7.556 -21.891
  581    HE3  LYS  82           HE1      LYS  82   7.917   8.186 -22.706
  582    HZ1  LYS  82           HZ1      LYS  82   9.068  10.004 -21.738
  583    HZ2  LYS  82           HZ2      LYS  82   9.180   9.235 -20.230
  584    HZ3  LYS  82           HZ3      LYS  82   7.672   9.756 -20.801
  585    H    TYR  83           HN       TYR  83   5.595   6.096 -16.167
  586    HA   TYR  83           HA       TYR  83   5.152   3.355 -15.146
  587    HB2  TYR  83           HB2      TYR  83   4.262   6.061 -14.089
  588    HB3  TYR  83           HB1      TYR  83   3.513   4.540 -13.544
  589    HD1  TYR  83           HD1      TYR  83   4.491   3.351 -11.770
  590    HD2  TYR  83           HD2      TYR  83   6.793   6.277 -13.822
  591    HE1  TYR  83           HE1      TYR  83   6.284   3.094 -10.112
  592    HE2  TYR  83           HE2      TYR  83   8.598   6.027 -12.170
  593    HH   TYR  83           HH       TYR  83   8.779   3.474 -10.023
  594    H    THR  84           HN       THR  84   3.089   2.416 -15.258
  595    HA   THR  84           HA       THR  84   1.461   3.310 -17.489
  596    HB   THR  84           HB       THR  84   0.277   1.232 -17.328
  597    HG1  THR  84           HG1      THR  84   0.619  -0.179 -15.511
  598   HG21  THR  84          HG21      THR  84   3.151   0.651 -16.618
  599   HG22  THR  84          HG22      THR  84   2.557   1.059 -18.230
  600   HG23  THR  84          HG23      THR  84   2.030  -0.428 -17.446
  601    H    SER  85           HN       SER  85  -1.087   2.709 -16.824
  602    HA   SER  85           HA       SER  85  -1.752   4.843 -15.014
  603    HB2  SER  85           HB2      SER  85  -3.620   3.085 -16.493
  604    HB3  SER  85           HB1      SER  85  -3.941   4.696 -15.881
  605    HG   SER  85           HG       SER  85  -2.173   5.359 -17.353
  606    H    GLU  86           HN       GLU  86  -0.796   1.963 -14.266
  607    HA   GLU  86           HA       GLU  86  -2.860   1.503 -12.173
  608    HB2  GLU  86           HB2      GLU  86  -1.110  -0.573 -13.548
  609    HB3  GLU  86           HB1      GLU  86  -2.243  -0.905 -12.249
  610    HG2  GLU  86           HG2      GLU  86  -4.089  -0.173 -13.717
  611    HG3  GLU  86           HG1      GLU  86  -2.921   0.066 -15.014
  612    H    GLY  87           HN       GLY  87   0.101   2.698 -12.714
  613    HA2  GLY  87           HA2      GLY  87   1.711   3.302 -11.155
  614    HA3  GLY  87           HA1      GLY  87   0.998   2.174 -10.014
  615    H    VAL  88           HN       VAL  88   1.720   0.956 -13.165
  616    HA   VAL  88           HA       VAL  88   3.863  -0.643 -11.996
  617    HB   VAL  88           HB       VAL  88   2.400  -1.009 -14.619
  618   HG11  VAL  88          HG11      VAL  88   4.345  -2.845 -13.224
  619   HG12  VAL  88          HG12      VAL  88   4.683  -1.911 -14.681
  620   HG13  VAL  88          HG13      VAL  88   3.470  -3.190 -14.715
  621   HG21  VAL  88          HG21      VAL  88   0.942  -1.402 -12.735
  622   HG22  VAL  88          HG22      VAL  88   2.151  -2.432 -11.972
  623   HG23  VAL  88          HG23      VAL  88   1.377  -2.943 -13.472
  624    H    ARG  89           HN       ARG  89   5.916  -0.421 -12.516
  625    HA   ARG  89           HA       ARG  89   6.784   1.718 -14.235
  626    HB2  ARG  89           HB2      ARG  89   7.972   1.363 -12.189
  627    HB3  ARG  89           HB1      ARG  89   8.208  -0.337 -12.540
  628    HG2  ARG  89           HG2      ARG  89   9.754   0.245 -14.333
  629    HG3  ARG  89           HG1      ARG  89   9.494   1.960 -14.001
  630    HD2  ARG  89           HD2      ARG  89  10.503   1.808 -11.875
  631    HD3  ARG  89           HD1      ARG  89  10.441   0.049 -11.886
  632    HE   ARG  89           HE       ARG  89  12.043   0.583 -13.975
  633   HH11  ARG  89          HH11      ARG  89  12.077   1.731 -10.667
  634   HH12  ARG  89          HH12      ARG  89  13.800   1.874 -10.597
  635   HH21  ARG  89          HH21      ARG  89  14.320   0.748 -13.881
  636   HH22  ARG  89          HH22      ARG  89  15.078   1.314 -12.431
  637    H    TYR  90           HN       TYR  90   7.048   1.502 -16.392
  638    HA   TYR  90           HA       TYR  90   7.905  -1.133 -17.392
  639    HB2  TYR  90           HB2      TYR  90   6.539  -0.959 -19.357
  640    HB3  TYR  90           HB1      TYR  90   5.496  -0.641 -17.995
  641    HD1  TYR  90           HD1      TYR  90   4.698   1.682 -17.576
  642    HD2  TYR  90           HD2      TYR  90   6.905   0.666 -21.058
  643    HE1  TYR  90           HE1      TYR  90   4.031   3.812 -18.612
  644    HE2  TYR  90           HE2      TYR  90   6.250   2.786 -22.113
  645    HH   TYR  90           HH       TYR  90   4.671   4.515 -21.970
  646    H    PHE  91           HN       PHE  91   9.150  -0.976 -19.510
  647    HA   PHE  91           HA       PHE  91  10.712   1.520 -19.493
  648    HB2  PHE  91           HB2      PHE  91  11.629  -1.292 -20.102
  649    HB3  PHE  91           HB1      PHE  91  12.636   0.132 -20.251
  650    HD1  PHE  91           HD1      PHE  91  11.409   1.363 -17.570
  651    HD2  PHE  91           HD2      PHE  91  13.251  -2.363 -18.552
  652    HE1  PHE  91           HE1      PHE  91  12.120   1.109 -15.252
  653    HE2  PHE  91           HE2      PHE  91  13.950  -2.619 -16.229
  654    HZ   PHE  91           HZ       PHE  91  13.444  -0.927 -14.591
  655    H    VAL  92           HN       VAL  92  11.628   2.194 -21.463
  656    HA   VAL  92           HA       VAL  92  10.333   1.084 -23.868
  657    HB   VAL  92           HB       VAL  92  11.054   3.996 -23.585
  658   HG11  VAL  92          HG11      VAL  92  10.862   3.194 -25.850
  659   HG12  VAL  92          HG12      VAL  92   9.494   4.243 -25.476
  660   HG13  VAL  92          HG13      VAL  92   9.281   2.492 -25.503
  661   HG21  VAL  92          HG21      VAL  92   8.736   4.510 -23.142
  662   HG22  VAL  92          HG22      VAL  92   9.366   3.445 -21.882
  663   HG23  VAL  92          HG23      VAL  92   8.328   2.795 -23.151
  664    H    ASP  93           HN       ASP  93  11.981   0.013 -24.825
  665    HA   ASP  93           HA       ASP  93  14.714   1.004 -24.692
  666    HB2  ASP  93           HB2      ASP  93  14.404  -1.391 -24.772
  667    HB3  ASP  93           HB1      ASP  93  13.400  -1.284 -26.212
  668    H    HIS  94           HN       HIS  94  15.548   2.513 -26.141
  669    HA   HIS  94           HA       HIS  94  13.676   3.603 -28.048
  670    HB2  HIS  94           HB2      HIS  94  16.428   4.488 -27.189
  671    HB3  HIS  94           HB1      HIS  94  15.512   5.299 -28.448
  672    HD1  HIS  94           HD1      HIS  94  16.216   5.636 -25.020
  673    HD2  HIS  94           HD2      HIS  94  12.762   5.995 -27.298
  674    HE1  HIS  94           HE1      HIS  94  14.667   7.079 -23.671
  675    HE2  HIS  94           HE2      HIS  94  12.628   7.386 -25.121
  676    H    ASN  95           HN       ASN  95  16.373   1.429 -28.256
  677    HA   ASN  95           HA       ASN  95  17.005   2.196 -30.980
  678    HB2  ASN  95           HB2      ASN  95  18.676   0.408 -30.988
  679    HB3  ASN  95           HB1      ASN  95  18.837   1.369 -29.522
  680   HD21  ASN  95          HD21      ASN  95  18.524   0.436 -27.583
  681   HD22  ASN  95          HD22      ASN  95  18.204  -1.244 -27.350
  682    H    THR  96           HN       THR  96  15.079  -0.283 -29.383
  683    HA   THR  96           HA       THR  96  14.426  -1.408 -32.012
  684    HB   THR  96           HB       THR  96  13.103  -3.096 -30.742
  685    HG1  THR  96           HG1      THR  96  14.280  -1.826 -28.462
  686   HG21  THR  96          HG21      THR  96  14.987  -4.346 -29.883
  687   HG22  THR  96          HG22      THR  96  15.968  -2.886 -29.812
  688   HG23  THR  96          HG23      THR  96  15.452  -3.524 -31.372
  689    H    ARG  97           HN       ARG  97  13.155   0.547 -29.450
  690    HA   ARG  97           HA       ARG  97  11.346   1.928 -29.315
  691    HB2  ARG  97           HB2      ARG  97  11.075   1.264 -32.249
  692    HB3  ARG  97           HB1      ARG  97  10.108   2.478 -31.407
  693    HG2  ARG  97           HG2      ARG  97  12.041   3.765 -30.897
  694    HG3  ARG  97           HG1      ARG  97  13.101   2.485 -31.471
  695    HD2  ARG  97           HD2      ARG  97  11.101   3.698 -33.320
  696    HD3  ARG  97           HD1      ARG  97  12.600   4.555 -32.980
  697    HE   ARG  97           HE       ARG  97  12.951   1.802 -33.791
  698   HH11  ARG  97          HH11      ARG  97  12.610   5.111 -34.883
  699   HH12  ARG  97          HH12      ARG  97  13.527   4.863 -36.340
  700   HH21  ARG  97          HH21      ARG  97  14.149   1.463 -35.728
  701   HH22  ARG  97          HH22      ARG  97  14.384   2.794 -36.828
  702    H    THR  98           HN       THR  98  11.223  -0.475 -28.398
  703    HA   THR  98           HA       THR  98   8.465  -1.415 -28.891
  704    HB   THR  98           HB       THR  98  10.448  -3.251 -27.591
  705    HG1  THR  98           HG1      THR  98  11.747  -2.728 -29.269
  706   HG21  THR  98          HG21      THR  98   8.195  -4.084 -27.919
  707   HG22  THR  98          HG22      THR  98   9.266  -4.920 -29.038
  708   HG23  THR  98          HG23      THR  98   8.227  -3.627 -29.626
  709    H    THR  99           HN       THR  99   7.200  -1.897 -26.941
  710    HA   THR  99           HA       THR  99   8.170  -0.502 -24.565
  711    HB   THR  99           HB       THR  99   5.861  -1.348 -23.661
  712    HG1  THR  99           HG1      THR  99   5.519  -2.874 -25.338
  713   HG21  THR  99          HG21      THR  99   4.651   0.518 -24.760
  714   HG22  THR  99          HG22      THR  99   5.913   0.635 -25.983
  715   HG23  THR  99          HG23      THR  99   6.281   1.030 -24.304
  716    H    THR 100           HN       THR 100   9.412  -1.575 -23.125
  717    HA   THR 100           HA       THR 100   9.279  -4.491 -23.063
  718    HB   THR 100           HB       THR 100  11.427  -2.458 -22.841
  719    HG1  THR 100           HG1      THR 100  11.416  -3.700 -24.666
  720   HG21  THR 100          HG21      THR 100  12.854  -3.712 -21.454
  721   HG22  THR 100          HG22      THR 100  11.769  -5.103 -21.472
  722   HG23  THR 100          HG23      THR 100  11.295  -3.638 -20.601
  723    H    PHE 101           HN       PHE 101   9.336  -5.524 -21.010
  724    HA   PHE 101           HA       PHE 101   8.374  -3.856 -18.837
  725    HB2  PHE 101           HB2      PHE 101   7.931  -6.643 -19.614
  726    HB3  PHE 101           HB1      PHE 101   8.252  -6.410 -17.841
  727    HD1  PHE 101           HD1      PHE 101   5.749  -6.605 -20.203
  728    HD2  PHE 101           HD2      PHE 101   6.969  -4.194 -16.915
  729    HE1  PHE 101           HE1      PHE 101   3.431  -5.858 -19.902
  730    HE2  PHE 101           HE2      PHE 101   4.643  -3.442 -16.600
  731    HZ   PHE 101           HZ       PHE 101   2.917  -4.157 -18.060
  732    H    LYS 102           HN       LYS 102   9.186  -3.962 -16.843
  733    HA   LYS 102           HA       LYS 102  11.819  -3.540 -16.457
  734    HB2  LYS 102           HB2      LYS 102  11.411  -3.816 -14.043
  735    HB3  LYS 102           HB1      LYS 102  10.113  -2.921 -14.825
  736    HG2  LYS 102           HG2      LYS 102   8.654  -4.776 -14.748
  737    HG3  LYS 102           HG1      LYS 102   9.956  -5.875 -14.303
  738    HD2  LYS 102           HD2      LYS 102   8.632  -5.439 -12.359
  739    HD3  LYS 102           HD1      LYS 102  10.186  -4.631 -12.153
  740    HE2  LYS 102           HE2      LYS 102   9.223  -2.501 -12.652
  741    HE3  LYS 102           HE1      LYS 102   7.712  -3.248 -13.177
  742    HZ1  LYS 102           HZ1      LYS 102   7.612  -2.269 -10.916
  743    HZ2  LYS 102           HZ2      LYS 102   8.764  -3.402 -10.398
  744    HZ3  LYS 102           HZ3      LYS 102   7.246  -3.924 -10.949
  745    H    ASP 103           HN       ASP 103  13.437  -4.627 -15.257
  746    HA   ASP 103           HA       ASP 103  14.413  -6.905 -16.291
  747    HB2  ASP 103           HB2      ASP 103  14.802  -6.257 -13.373
  748    HB3  ASP 103           HB1      ASP 103  15.953  -6.975 -14.489
  749    HA   PRO 104           HA       PRO 104  11.462  -9.941 -14.678
  750    HB2  PRO 104           HB2      PRO 104  12.452 -12.034 -16.145
  751    HB3  PRO 104           HB1      PRO 104  11.310 -10.855 -16.795
  752    HG2  PRO 104           HG2      PRO 104  14.276 -11.002 -17.120
  753    HG3  PRO 104           HG1      PRO 104  13.036 -10.585 -18.316
  754    HD2  PRO 104           HD2      PRO 104  14.557  -8.720 -17.070
  755    HD3  PRO 104           HD1      PRO 104  12.886  -8.400 -17.579
  756    H    ARG 105           HN       ARG 105  14.891 -10.674 -15.180
  757    HA   ARG 105           HA       ARG 105  14.903 -12.162 -12.651
  758    HB2  ARG 105           HB2      ARG 105  16.451 -12.546 -15.194
  759    HB3  ARG 105           HB1      ARG 105  17.100 -13.116 -13.666
  760    HG2  ARG 105           HG2      ARG 105  16.020 -14.920 -14.824
  761    HG3  ARG 105           HG1      ARG 105  15.115 -14.532 -13.359
  762    HD2  ARG 105           HD2      ARG 105  13.523 -13.232 -14.761
  763    HD3  ARG 105           HD1      ARG 105  14.405 -13.765 -16.192
  764    HE   ARG 105           HE       ARG 105  13.773 -16.044 -15.634
  765   HH11  ARG 105          HH11      ARG 105  11.960 -13.469 -14.078
  766   HH12  ARG 105          HH12      ARG 105  10.590 -14.479 -13.735
  767   HH21  ARG 105          HH21      ARG 105  11.970 -17.343 -15.199
  768   HH22  ARG 105          HH22      ARG 105  10.585 -16.664 -14.398
  769    HA   PRO 106           HA       PRO 106  17.276  -8.502 -11.355
  770    HB2  PRO 106           HB2      PRO 106  18.065 -10.444  -9.209
  771    HB3  PRO 106           HB1      PRO 106  17.505  -8.736  -9.059
  772    HG2  PRO 106           HG2      PRO 106  15.886 -10.819  -8.512
  773    HG3  PRO 106           HG1      PRO 106  15.288  -9.343  -9.252
  774    HD2  PRO 106           HD2      PRO 106  15.669 -11.978 -10.424
  775    HD3  PRO 106           HD1      PRO 106  14.539 -10.679 -10.892
  776    H    GLY 107           HN       GLY 107  19.129  -8.097 -12.413
  777    HA2  GLY 107           HA2      GLY 107  21.439  -8.240 -12.736
  778    HA3  GLY 107           HA1      GLY 107  21.430  -9.841 -11.963
  779    H    PHE 108           HN       PHE 108  19.229 -10.819 -13.698
  780    HA   PHE 108           HA       PHE 108  19.411 -12.420 -15.416
  781    HB2  PHE 108           HB2      PHE 108  19.088 -11.184 -17.634
  782    HB3  PHE 108           HB1      PHE 108  17.916 -10.807 -16.329
  783    HD1  PHE 108           HD1      PHE 108  20.548  -9.505 -18.512
  784    HD2  PHE 108           HD2      PHE 108  18.032  -8.629 -15.184
  785    HE1  PHE 108           HE1      PHE 108  21.021  -7.116 -18.776
  786    HE2  PHE 108           HE2      PHE 108  18.513  -6.233 -15.455
  787    HZ   PHE 108           HZ       PHE 108  19.973  -5.474 -17.283
  788    H    GLU 109           HN       GLU 109  21.648 -13.055 -14.777
  789    HA   GLU 109           HA       GLU 109  23.447 -12.725 -17.053
  790    HB2  GLU 109           HB2      GLU 109  24.167 -11.034 -15.406
  791    HB3  GLU 109           HB1      GLU 109  24.292 -12.278 -14.173
  792    HG2  GLU 109           HG2      GLU 109  26.460 -11.620 -15.062
  793    HG3  GLU 109           HG1      GLU 109  26.110 -13.319 -15.350