*HEADER   HYDROLASE(ENDORIBONUCLEASE)             20-NOV-92   2AAS    
*COMPND   RIBONUCLEASE A (E.C.3.1.27.5) (NMR, 32 STRUCTURES)          
*SOURCE   BOVINE (BOS TAURUS) PANCREAS                                
*AUTHOR   J.SANTORO,C.GONZALEZ,M.BRUIX,J.L.NEIRA,J.L.NIETO,J.HERRANZ, 
*AUTHOR  2 M.RICO                                                     
*REVDAT  2   31-JUL-94 2AASA   3       ATOM                           
*REVDAT  1   31-JAN-94 2AAS    0                                      

        Distance constraints used in the calculation of the solution structure
 of Rnase A (Bovine pancreatic). (Santoro et al.,JMB in press)
         Characters in colummns 10-40 indicate the atoms involved in the
 constraint (P means pseudoatoms for methylene groups. Methyl groups are
 represented by its carbon atom). The real number indicate the distance 
 constraint (a positive number means upper bound constraint and a negative
 number means lower bound constraint). All distances are in angstroms.  



 Total number of constraints:  1920


     Aminoacid    1  LYS

    1    PD   1 LYS      PE   1 LYS     4.80 
    2    PG   1 LYS      PE   1 LYS     5.80 
    3    PB   1 LYS       H   2 GLU     3.90 
    4    HA   1 LYS       H   2 GLU     2.44 
    5    HA   1 LYS       H   2 GLU    -1.94 



     Aminoacid    2  GLU

    1     H   2 GLU      PB   1 LYS     3.90 
    2     H   2 GLU      HA   1 LYS     2.44 
    3     H   2 GLU      HA   1 LYS    -1.94 
    4     H   2 GLU      PG   2 GLU     4.90 
    5     H   2 GLU     Hb3   2 GLU     3.69 
    6     H   2 GLU     Hb3   2 GLU    -2.72 
    7     H   2 GLU     Hb2   2 GLU     3.00 
    8    PG   2 GLU      PB   2 GLU     5.80 
    9    HA   2 GLU     Hb3   2 GLU     4.00 
   10    HA   2 GLU     Hb2   2 GLU     3.00 
   11    HA   2 GLU     Hg3   2 GLU     3.00 
   12    HA   2 GLU     Hg2   2 GLU     5.00 
   13    HA   2 GLU       H   3 THR     3.00 
   14   Hg2   2 GLU       H   3 THR     5.00 
   15    HA   2 GLU      CB   6 ALA     5.00 
   16   Hg3   2 GLU      CB   6 ALA     3.80 
   17   Hg3   2 GLU      CB   6 ALA    -3.08 
   18   Hg2   2 GLU      CB   6 ALA     3.55 
   19   Hg2   2 GLU      CB   6 ALA    -2.73 
   20   Hg3   2 GLU       H   7 LYS     5.00 
   21   Hg2   2 GLU       H   7 LYS     4.00 



     Aminoacid    3  THR

    1     H   3 THR      HA   2 GLU     3.00 
    2     H   3 THR     Hg2   2 GLU     5.00 
    3     H   3 THR      CG   3 THR     3.41 
    4     H   3 THR      CG   3 THR    -2.79 
    5    HA   3 THR      HB   3 THR     3.00 
    6    HA   3 THR      CG   3 THR     4.00 
    7    HB   3 THR      CG   3 THR     5.00 
    8    CG   3 THR       H   4 ALA     4.00 
    9    HB   3 THR       H   4 ALA     3.00 
   10    HA   3 THR       H   4 ALA     2.84 
   11    HA   3 THR       H   4 ALA    -2.34 
   12     H   3 THR      CB   6 ALA     3.89 
   13     H   3 THR      CB   6 ALA    -3.11 
   14     H   3 THR       H   7 LYS     5.45 
   15     H   3 THR       H   7 LYS    -4.29 



     Aminoacid    4  ALA

    1     H   4 ALA      CG   3 THR     4.00 
    2     H   4 ALA      HB   3 THR     3.00 
    3     H   4 ALA      HA   3 THR     2.84 
    4     H   4 ALA      HA   3 THR    -2.34 
    5     H   4 ALA      CB   4 ALA     3.28 
    6     H   4 ALA      CB   4 ALA    -2.53 
    7    HA   4 ALA      CB   4 ALA     3.04 
    8    HA   4 ALA      CB   4 ALA    -2.32 
    9     H   4 ALA      HA   4 ALA     3.00 
   10    CB   4 ALA       H   5 ALA     4.30 
   11    CB   4 ALA       H   5 ALA    -3.25 
   12     H   4 ALA       H   5 ALA     4.00 
   13    CB   4 ALA     CG1 118 VAL     7.00 
   14    CB   4 ALA     CG2 118 VAL     5.00 
   15    CB   4 ALA      HA 118 VAL     6.00 
   16    CB   4 ALA      PB   7 LYS     5.90 
   17    HA   4 ALA      PB   7 LYS     4.90 



     Aminoacid    5  ALA

    1     H   5 ALA      CB   4 ALA     4.30 
    2     H   5 ALA      CB   4 ALA    -3.25 
    3     H   5 ALA       H   4 ALA     4.00 
    4     H   5 ALA      CB   5 ALA     3.17 
    5     H   5 ALA      CB   5 ALA    -2.46 
    6    CB   5 ALA      HA   5 ALA     3.42 
    7    CB   5 ALA      HA   5 ALA    -2.64 
    8    CB   5 ALA       H   6 ALA     3.85 
    9    CB   5 ALA       H   6 ALA    -3.00 
   10    HA   5 ALA       H   8 PHE     5.00 
   11    HA   5 ALA       H   6 ALA     5.00 
   12     H   5 ALA       H   6 ALA     3.00 
   13    CB   5 ALA     CG2 116 VAL     4.20 
   14    HA   5 ALA     CG1 118 VAL     4.10 
   15    HA   5 ALA     Hb3   8 PHE     3.00 
   16    HA   5 ALA     Hb2   8 PHE     5.00 



     Aminoacid    6  ALA

    1    CB   6 ALA      HA   2 GLU     5.00 
    2    CB   6 ALA     Hg3   2 GLU     3.80 
    3    CB   6 ALA     Hg3   2 GLU    -3.08 
    4    CB   6 ALA     Hg2   2 GLU     3.55 
    5    CB   6 ALA     Hg2   2 GLU    -2.73 
    6    CB   6 ALA       H   3 THR     3.89 
    7    CB   6 ALA       H   3 THR    -3.11 
    8     H   6 ALA      CB   5 ALA     3.85 
    9     H   6 ALA      CB   5 ALA    -3.00 
   10     H   6 ALA      HA   5 ALA     5.00 
   11     H   6 ALA       H   5 ALA     3.00 
   12     H   6 ALA      CB   6 ALA     3.16 
   13     H   6 ALA      CB   6 ALA    -2.54 
   14    CB   6 ALA      HA   6 ALA     3.35 
   15    CB   6 ALA      HA   6 ALA    -2.61 
   16    CB   6 ALA       H   7 LYS     3.28 
   17    CB   6 ALA       H   7 LYS    -2.42 
   18    CB   6 ALA      PB   9 GLU     5.90 
   19     H   6 ALA       H   7 LYS     3.00 



     Aminoacid    7  LYS

    1     H   7 LYS     Hg3   2 GLU     5.00 
    2     H   7 LYS     Hg2   2 GLU     4.00 
    3     H   7 LYS       H   3 THR     5.45 
    4     H   7 LYS       H   3 THR    -4.29 
    5    PB   7 LYS      CB   4 ALA     5.90 
    6    PB   7 LYS      HA   4 ALA     4.90 
    7     H   7 LYS      CB   6 ALA     3.28 
    8     H   7 LYS      CB   6 ALA    -2.42 
    9     H   7 LYS       H   6 ALA     3.00 
   10     H   7 LYS      PB   7 LYS     3.90 
   11    HA   7 LYS      PB   7 LYS     3.90 
   12    HA   7 LYS      PG   7 LYS     4.90 
   13    PB   7 LYS       H   8 PHE     3.90 
   14     H   7 LYS       H   8 PHE     2.82 
   15     H   7 LYS       H   8 PHE    -2.32 
   16    HA   7 LYS       H  10 ARG     3.17 
   17    HA   7 LYS       H  10 ARG    -2.67 
   18    HA   7 LYS      HE  10 ARG     3.21 
   19    HA   7 LYS      HE  10 ARG    -2.71 



     Aminoacid    8  PHE

    1     H   8 PHE      HA   5 ALA     5.00 
    2   Hb3   8 PHE      HA   5 ALA     3.00 
    3   Hb2   8 PHE      HA   5 ALA     5.00 
    4     H   8 PHE      PB   7 LYS     3.90 
    5     H   8 PHE       H   7 LYS     2.82 
    6     H   8 PHE       H   7 LYS    -2.32 
    7     H   8 PHE     Hb3   8 PHE     2.73 
    8     H   8 PHE     Hb3   8 PHE    -2.23 
    9     H   8 PHE     Hb2   8 PHE     2.82 
   10     H   8 PHE     Hb2   8 PHE    -2.32 
   11    HA   8 PHE     Hb3   8 PHE     3.00 
   12    HA   8 PHE     Hb2   8 PHE     2.71 
   13    HA   8 PHE     Hb2   8 PHE    -2.21 
   14     H   8 PHE       H   9 GLU     4.00 
   15   Hb3   8 PHE       H   9 GLU     2.95 
   16   Hb3   8 PHE       H   9 GLU    -2.45 
   17   Hb2   8 PHE       H   9 GLU     3.35 
   18   Hb2   8 PHE       H   9 GLU    -2.85 
   19    HA   8 PHE       H   9 GLU     5.00 
   20    HA   8 PHE     HD2  12 HIS     3.00 
   21    HA   8 PHE       H  11 GLN     5.00 
   22    HA   8 PHE       H  12 HIS     5.00 
   23   Hb2   8 PHE     HD2  12 HIS     5.00 
   24     H   8 PHE     HD2  12 HIS     5.00 
   25   HD1   8 PHE      HA   8 PHE     3.20 
   26   HD1   8 PHE      HA   8 PHE    -2.70 
   27    CG   8 PHE       H   8 PHE     7.10 
   28    CG   8 PHE      PB   8 PHE     6.00 
   29   HD2   8 PHE      HA   9 GLU     2.81 
   30   HD2   8 PHE      HA   9 GLU    -2.31 
   31   HD2   8 PHE       H   9 GLU     3.09 
   32   HD2   8 PHE       H   9 GLU    -2.59 
   33   HD1   8 PHE     CG1 108 VAL     4.00 
   34   HD1   8 PHE      HA 119 HIS     3.11 
   35   HD1   8 PHE      HA 119 HIS    -2.61 
   36   HD1   8 PHE     Hb3 120 PHE     4.00 
   37   HD1   8 PHE     Hb2 120 PHE     2.64 
   38   HD1   8 PHE     Hb2 120 PHE    -2.14 
   39   HD1   8 PHE       H 119 HIS     3.62 
   40   HD1   8 PHE       H 119 HIS    -3.12 
   41   HD1   8 PHE      PB 117 PRO     4.90 
   42   HD1   8 PHE      HA 120 PHE     4.00 
   43   HE2   8 PHE     CG1  54 VAL     4.00 
   44   HE2   8 PHE     CG2  54 VAL     5.00 
   45   HE2   8 PHE      CG  51 LEU     7.20 
   46   HE1   8 PHE     CG1 108 VAL     3.94 
   47   HE1   8 PHE     CG1 108 VAL    -3.04 
   48   HE1   8 PHE     CG2 108 VAL     6.00 
   49   HE1   8 PHE     Hb2 120 PHE     4.00 
   50   HE1   8 PHE      HA 120 PHE     5.00 
   51    CZ   8 PHE      PB 117 PRO     8.00 
   52    HZ   8 PHE     CG1  54 VAL     6.00 
   53    HZ   8 PHE     CG2  54 VAL     6.00 
   54    CG   8 PHE     Hb2  12 HIS     4.00 
   55   HD2   8 PHE      CE  13 MET     5.00 
   56   HD2   8 PHE      PG   9 GLU     5.90 
   57   HD2   8 PHE      PG  13 MET     3.90 
   58    HZ   8 PHE      PB 117 PRO     5.90 
   59   HE2   8 PHE     Hb3  12 HIS     5.00 
   60   HD2   8 PHE      CG  51 LEU     5.20 
   61    HZ   8 PHE     CG1 108 VAL     6.00 
   62    HZ   8 PHE     CG2 108 VAL     6.00 
   63   HD1   8 PHE       H 120 PHE     3.43 
   64   HD1   8 PHE       H 120 PHE    -2.93 



     Aminoacid    9  GLU

    1    PB   9 GLU      CB   6 ALA     5.90 
    2     H   9 GLU       H   8 PHE     4.00 
    3     H   9 GLU     Hb3   8 PHE     2.95 
    4     H   9 GLU     Hb3   8 PHE    -2.45 
    5     H   9 GLU     Hb2   8 PHE     3.35 
    6     H   9 GLU     Hb2   8 PHE    -2.85 
    7     H   9 GLU      HA   8 PHE     5.00 
    8    HA   9 GLU     HD2   8 PHE     2.81 
    9    HA   9 GLU     HD2   8 PHE    -2.31 
   10     H   9 GLU     HD2   8 PHE     3.09 
   11     H   9 GLU     HD2   8 PHE    -2.59 
   12    PG   9 GLU     HD2   8 PHE     5.90 
   13     H   9 GLU     Hb3   9 GLU     3.36 
   14     H   9 GLU     Hb3   9 GLU    -2.50 
   15     H   9 GLU     Hb2   9 GLU     3.70 
   16     H   9 GLU     Hb2   9 GLU    -3.20 
   17    HA   9 GLU     Hb3   9 GLU     3.00 
   18    HA   9 GLU     Hb2   9 GLU     4.00 
   19   Hg2   9 GLU      HA   9 GLU     3.00 
   20     H   9 GLU     Hg2   9 GLU     2.64 
   21     H   9 GLU     Hg2   9 GLU    -2.14 
   22     H   9 GLU     Hg3   9 GLU     4.00 
   23    HA   9 GLU       H  12 HIS     4.04 
   24    HA   9 GLU       H  12 HIS    -3.41 
   25   Hb2   9 GLU      PG   9 GLU     4.90 
   26     H   9 GLU       H  10 ARG     2.85 
   27     H   9 GLU       H  10 ARG    -2.35 
   28   Hb3   9 GLU       H  10 ARG     4.00 
   29   Hb2   9 GLU       H  10 ARG     2.44 
   30   Hb2   9 GLU       H  10 ARG    -1.94 
   31    HA   9 GLU       H  13 MET     3.12 
   32    HA   9 GLU       H  13 MET    -2.62 
   33    HA   9 GLU     Hb2  13 MET     4.00 
   34    HA   9 GLU      PG  13 MET     3.90 
   35    HA   9 GLU       H  12 HIS     4.04 
   36    HA   9 GLU       H  12 HIS    -3.41 



     Aminoacid   10  ARG

    1     H  10 ARG      HA   7 LYS     3.17 
    2     H  10 ARG      HA   7 LYS    -2.67 
    3    HE  10 ARG      HA   7 LYS     3.21 
    4    HE  10 ARG      HA   7 LYS    -2.71 
    5     H  10 ARG       H   9 GLU     2.85 
    6     H  10 ARG       H   9 GLU    -2.35 
    7     H  10 ARG     Hb3   9 GLU     4.00 
    8     H  10 ARG     Hb2   9 GLU     2.44 
    9     H  10 ARG     Hb2   9 GLU    -1.94 
   10     H  10 ARG     Hb3  10 ARG     2.83 
   11     H  10 ARG     Hb3  10 ARG    -2.33 
   12     H  10 ARG     Hb2  10 ARG     2.61 
   13     H  10 ARG     Hb2  10 ARG    -2.11 
   14    HA  10 ARG     Hb3  10 ARG     4.00 
   15   Hb2  10 ARG      HA  10 ARG     2.92 
   16   Hb2  10 ARG      HA  10 ARG    -2.42 
   17   Hg3  10 ARG      HA  10 ARG     4.81 
   18   Hg3  10 ARG      HA  10 ARG    -2.93 
   19    HA  10 ARG     Hg2  10 ARG     4.00 
   20   Hb2  10 ARG     Hd2  10 ARG     2.99 
   21   Hb2  10 ARG     Hd2  10 ARG    -2.49 
   22   Hd3  10 ARG      HA  10 ARG     3.61 
   23   Hd3  10 ARG      HA  10 ARG    -3.11 
   24    HA  10 ARG     Hd2  10 ARG     5.00 
   25   Hd3  10 ARG     Hg2  10 ARG     4.00 
   26   Hd2  10 ARG     Hg2  10 ARG     4.00 
   27   Hd3  10 ARG     Hg3  10 ARG     4.00 
   28   Hd2  10 ARG     Hg3  10 ARG     2.33 
   29   Hd2  10 ARG     Hg3  10 ARG    -1.83 
   30    HE  10 ARG     Hb3  10 ARG     3.53 
   31    HE  10 ARG     Hb3  10 ARG    -2.66 
   32    HE  10 ARG     Hb2  10 ARG     4.00 
   33    HE  10 ARG     Hg3  10 ARG     5.00 
   34    HE  10 ARG     Hg2  10 ARG     4.00 
   35    HE  10 ARG     Hd3  10 ARG     3.25 
   36    HE  10 ARG     Hd3  10 ARG    -2.75 
   37    HE  10 ARG     Hd2  10 ARG     2.65 
   38    HE  10 ARG     Hd2  10 ARG    -2.15 
   39   Hb3  10 ARG       H  11 GLN     3.00 
   40     H  10 ARG       H  11 GLN     2.99 
   41     H  10 ARG       H  11 GLN    -2.49 



     Aminoacid   11  GLN

    1     H  11 GLN      HA   8 PHE     5.00 
    2     H  11 GLN     Hb3  10 ARG     3.00 
    3     H  11 GLN       H  10 ARG     2.99 
    4     H  11 GLN       H  10 ARG    -2.49 
    5     H  11 GLN     Hb3  11 GLN     3.08 
    6     H  11 GLN     Hb3  11 GLN    -2.58 
    7     H  11 GLN     Hb2  11 GLN     3.00 
    8     H  11 GLN     Hg3  11 GLN     2.73 
    9     H  11 GLN     Hg3  11 GLN    -2.23 
   10     H  11 GLN     Hg2  11 GLN     4.00 
   11    PG  11 GLN     Hb3  11 GLN     4.90 
   12    PG  11 GLN     Hb2  11 GLN     4.90 
   13    HA  11 GLN     Hb3  11 GLN     3.00 
   14    HA  11 GLN     Hb2  11 GLN     3.08 
   15    HA  11 GLN     Hb2  11 GLN    -2.58 
   16   Hg3  11 GLN      HA  11 GLN     4.00 
   17   Hg2  11 GLN      HA  11 GLN     2.61 
   18   Hg2  11 GLN      HA  11 GLN    -2.11 
   19     H  11 GLN       H  12 HIS     3.01 
   20     H  11 GLN       H  12 HIS    -2.51 
   21   Hb3  11 GLN       H  12 HIS     3.36 
   22   Hb3  11 GLN       H  12 HIS    -2.86 
   23   Hb2  11 GLN       H  12 HIS     3.31 
   24   Hb2  11 GLN       H  12 HIS    -2.81 
   25    PG  11 GLN       H  12 HIS     5.90 
   26    HA  11 GLN       H  12 HIS     3.82 
   27    HA  11 GLN       H  12 HIS    -3.32 
   28    HA  11 GLN     Hb3  35 LEU     5.00 
   29    HA  11 GLN     CD1  35 LEU     5.00 
   30    HA  11 GLN     CD2  35 LEU     5.00 
   31    PG  11 GLN     CD2  35 LEU     5.00 
   32    HA  11 GLN     HE1  46 PHE     4.00 
   33   NE2  11 GLN     Hb3  11 GLN     5.00 
   34     H  11 GLN     HD2  12 HIS     5.00 
   35   Hb3  11 GLN     HD2  12 HIS     3.00 
   36   Hb2  11 GLN     HD2  12 HIS     3.00 



     Aminoacid   12  HIS

    1   HD2  12 HIS      HA   8 PHE     3.00 
    2     H  12 HIS      HA   8 PHE     5.00 
    3   HD2  12 HIS     Hb2   8 PHE     5.00 
    4   HD2  12 HIS       H   8 PHE     5.00 
    5   Hb2  12 HIS      CG   8 PHE     4.00 
    6   Hb3  12 HIS     HE2   8 PHE     5.00 
    7     H  12 HIS      HA   9 GLU     4.04 
    8     H  12 HIS      HA   9 GLU    -3.41 
    9     H  12 HIS      HA   9 GLU     4.04 
   10     H  12 HIS      HA   9 GLU    -3.41 
   11     H  12 HIS       H  11 GLN     3.01 
   12     H  12 HIS       H  11 GLN    -2.51 
   13     H  12 HIS     Hb3  11 GLN     3.36 
   14     H  12 HIS     Hb3  11 GLN    -2.86 
   15     H  12 HIS     Hb2  11 GLN     3.31 
   16     H  12 HIS     Hb2  11 GLN    -2.81 
   17     H  12 HIS      PG  11 GLN     5.90 
   18     H  12 HIS      HA  11 GLN     3.82 
   19     H  12 HIS      HA  11 GLN    -3.32 
   20   HD2  12 HIS       H  11 GLN     5.00 
   21   HD2  12 HIS     Hb3  11 GLN     3.00 
   22   HD2  12 HIS     Hb2  11 GLN     3.00 
   23     H  12 HIS     Hb3  12 HIS     5.00 
   24     H  12 HIS     Hb2  12 HIS     3.00 
   25     H  12 HIS     Hb2  12 HIS    -2.50 
   26    HA  12 HIS     Hb3  12 HIS     2.94 
   27    HA  12 HIS     Hb3  12 HIS    -2.44 
   28   Hb2  12 HIS      HA  12 HIS     3.33 
   29   Hb2  12 HIS      HA  12 HIS    -2.83 
   30     H  12 HIS       H  13 MET     3.00 
   31   Hb2  12 HIS       H  13 MET     5.00 
   32    HA  12 HIS       H  47 VAL     5.00 
   33    HA  12 HIS       H  13 MET     3.75 
   34    HA  12 HIS       H  13 MET    -3.25 
   35    HA  12 HIS     CG1  47 VAL     6.00 
   36   HD1  12 HIS      HA  12 HIS     4.00 
   37   HD1  12 HIS     Hb3  12 HIS     4.00 
   38   HD1  12 HIS     Hb2  12 HIS     5.00 
   39   HE1  12 HIS      HA  44 ASN     4.00 
   40   HE1  12 HIS     Hb3 120 PHE     4.00 
   41   HE1  12 HIS     Hb2 120 PHE     4.00 
   42   HD2  12 HIS     Hb2  12 HIS     3.00 
   43   HD2  12 HIS      HA 119 HIS     5.00 
   44    HA  12 HIS     HD1  46 PHE     3.00 
   45   HD2  12 HIS      HA  12 HIS     5.00 
   46   Hb2  12 HIS     HD2 120 PHE     5.00 
   47   HD1  12 HIS       H  45 THR     4.00 
   48   HE1  12 HIS       H  45 THR     3.00 
   49   HE1  12 HIS       H  45 THR    -2.50 
   50   HD1  12 HIS      HB  45 THR     5.00 
   51   HD2  12 HIS     Hb3 120 PHE     5.00 
   52   HD2  12 HIS     Hb2 120 PHE     5.00 
   53   HD1  12 HIS     Hb2 120 PHE     5.00 
   54     H  12 HIS     HD2  12 HIS     3.42 
   55     H  12 HIS     HD2  12 HIS    -2.92 



     Aminoacid   13  MET

    1    CE  13 MET     HD2   8 PHE     5.00 
    2    PG  13 MET     HD2   8 PHE     3.90 
    3     H  13 MET      HA   9 GLU     3.12 
    4     H  13 MET      HA   9 GLU    -2.62 
    5   Hb2  13 MET      HA   9 GLU     4.00 
    6    PG  13 MET      HA   9 GLU     3.90 
    7     H  13 MET       H  12 HIS     3.00 
    8     H  13 MET     Hb2  12 HIS     5.00 
    9     H  13 MET      HA  12 HIS     3.75 
   10     H  13 MET      HA  12 HIS    -3.25 
   11     H  13 MET     Hb3  13 MET     3.57 
   12     H  13 MET     Hb3  13 MET    -3.07 
   13     H  13 MET     Hb2  13 MET     2.97 
   14     H  13 MET     Hb2  13 MET    -2.47 
   15     H  13 MET     Hg3  13 MET     3.14 
   16     H  13 MET     Hg3  13 MET    -2.64 
   17     H  13 MET      CE  13 MET     6.00 
   18   Hb3  13 MET      PG  13 MET     4.90 
   19   Hb2  13 MET      PG  13 MET     4.90 
   20    CE  13 MET     Hg2  13 MET     4.05 
   21    CE  13 MET     Hg2  13 MET    -3.30 
   22    CE  13 MET     Hb2  13 MET     3.86 
   23    CE  13 MET     Hb2  13 MET    -3.17 
   24    HA  13 MET     Hb3  13 MET     3.13 
   25    HA  13 MET     Hb3  13 MET    -2.63 
   26    HA  13 MET     Hb2  13 MET     2.90 
   27    HA  13 MET     Hb2  13 MET    -2.40 
   28    HA  13 MET     Hg2  13 MET     3.19 
   29    HA  13 MET     Hg2  13 MET    -2.69 
   30    HA  13 MET     Hg3  13 MET     3.97 
   31    HA  13 MET     Hg3  13 MET    -3.37 
   32    HA  13 MET      CE  13 MET     3.93 
   33    HA  13 MET      CE  13 MET    -3.13 
   34    HA  13 MET       H  14 ASP     2.49 
   35    HA  13 MET       H  14 ASP    -1.99 
   36    HA  13 MET      HB  47 VAL     2.97 
   37    HA  13 MET      HB  47 VAL    -2.47 
   38    HA  13 MET       H  47 VAL     3.18 
   39    HA  13 MET       H  47 VAL    -2.68 
   40    HA  13 MET      HA  46 PHE     5.00 
   41   Hb3  13 MET     Hg2  13 MET     2.65 
   42   Hb3  13 MET     Hg2  13 MET    -2.15 
   43    CE  13 MET     CG1  54 VAL     5.00 
   44    PG  13 MET      CG  51 LEU     7.10 
   45    PB  13 MET      CG  51 LEU     7.10 
   46    CE  13 MET       H  47 VAL     7.00 
   47    CE  13 MET      HA  51 LEU     3.47 
   48    CE  13 MET      HA  51 LEU    -2.76 
   49    HA  13 MET     HD1  46 PHE     5.00 



     Aminoacid   14  ASP

    1     H  14 ASP      HA  13 MET     2.49 
    2     H  14 ASP      HA  13 MET    -1.99 
    3     H  14 ASP      PB  14 ASP     3.90 
    4    HA  14 ASP      PB  14 ASP     3.90 
    5    PB  14 ASP       H  15 SER     5.90 
    6    HA  14 ASP       H  15 SER     3.00 
    7    HA  14 ASP       H  16 SER     4.58 
    8    HA  14 ASP       H  16 SER    -3.83 
    9     H  14 ASP       H  47 VAL     4.60 
   10     H  14 ASP       H  47 VAL    -4.10 
   11     H  14 ASP      PB  46 PHE     5.90 
   12    PB  14 ASP     HD1  46 PHE     4.90 
   13    PB  14 ASP     HE1  48 HIS     3.90 



     Aminoacid   15  SER

    1     H  15 SER      PB  14 ASP     5.90 
    2     H  15 SER      HA  14 ASP     3.00 
    3     H  15 SER      PB  15 SER     4.90 
    4    HA  15 SER      PB  15 SER     3.90 
    5     H  15 SER       H  16 SER     3.18 
    6     H  15 SER       H  16 SER    -2.68 
    7    PB  15 SER      HA  50 SER     4.90 
    8    HA  15 SER      HA  48 HIS     3.51 
    9    HA  15 SER      HA  48 HIS    -3.01 



     Aminoacid   16  SER

    1     H  16 SER      HA  14 ASP     4.58 
    2     H  16 SER      HA  14 ASP    -3.83 
    3     H  16 SER       H  15 SER     3.18 
    4     H  16 SER       H  15 SER    -2.68 
    5     H  16 SER      PB  16 SER     3.90 
    6    HA  16 SER      PB  16 SER     3.90 
    7     H  16 SER       H  17 THR     3.06 
    8     H  16 SER       H  17 THR    -2.56 
    9    HA  16 SER       H  17 THR     5.00 



     Aminoacid   17  THR

    1     H  17 THR       H  16 SER     3.06 
    2     H  17 THR       H  16 SER    -2.56 
    3     H  17 THR      HA  16 SER     5.00 
    4     H  17 THR      CG  17 THR     4.25 
    5     H  17 THR      CG  17 THR    -3.56 
    6    HA  17 THR      CG  17 THR     4.00 
    7    HB  17 THR      CG  17 THR     4.00 
    8    HA  17 THR      HB  17 THR     3.00 
    9    HA  17 THR       H  18 SER     3.00 
   10    HB  17 THR       H  19 ALA     3.11 
   11    HB  17 THR       H  19 ALA    -2.61 
   12    CG  17 THR     HE1  25 TYR     4.81 
   13    CG  17 THR     HE1  25 TYR    -3.98 
   14    HB  17 THR     HE1  25 TYR     5.00 
   15    HB  17 THR     HE1  48 HIS     5.00 
   16    CG  17 THR     HE1  48 HIS     5.00 



     Aminoacid   18  SER

    1     H  18 SER      HA  17 THR     3.00 
    2     H  18 SER      PB  18 SER     4.90 
    3    HA  18 SER      PB  18 SER     3.90 
    4    HA  18 SER       H  19 ALA     3.34 
    5    HA  18 SER       H  19 ALA    -2.84 
    6     H  18 SER       H  19 ALA     3.03 
    7     H  18 SER       H  19 ALA    -2.53 
    8    HA  18 SER      PB  48 HIS     3.90 



     Aminoacid   19  ALA

    1     H  19 ALA      HB  17 THR     3.11 
    2     H  19 ALA      HB  17 THR    -2.61 
    3     H  19 ALA      HA  18 SER     3.34 
    4     H  19 ALA      HA  18 SER    -2.84 
    5     H  19 ALA       H  18 SER     3.03 
    6     H  19 ALA       H  18 SER    -2.53 
    7     H  19 ALA      CB  19 ALA     3.85 
    8     H  19 ALA      CB  19 ALA    -3.18 
    9    CB  19 ALA     NE2 101 GLN     7.10 
   10    CB  19 ALA      HA  19 ALA     4.00 
   11    CB  19 ALA       H  20 ALA     4.10 
   12    CB  19 ALA       H  20 ALA    -3.20 
   13    HA  19 ALA       H  20 ALA     3.00 
   14    CB  19 ALA      PG 101 GLN     5.90 
   15    HA  19 ALA     HD2  48 HIS     3.35 
   16    HA  19 ALA     HD2  48 HIS    -2.85 
   17    HA  19 ALA     NE2 101 GLN     5.10 
   18    HA  19 ALA     HE1  48 HIS     4.87 
   19    HA  19 ALA     HE1  48 HIS    -4.10 



     Aminoacid   20  ALA

    1     H  20 ALA      CB  19 ALA     4.10 
    2     H  20 ALA      CB  19 ALA    -3.20 
    3     H  20 ALA      HA  19 ALA     3.00 
    4     H  20 ALA      CB  20 ALA     4.00 
    5    CB  20 ALA      HA  20 ALA     3.32 
    6    CB  20 ALA      HA  20 ALA    -2.68 
    7    HA  20 ALA       H  21 SER     4.00 
    8    CB  20 ALA       H  21 SER     4.26 
    9    CB  20 ALA       H  21 SER    -3.52 
   10    CB  20 ALA       H  25 TYR     5.00 
   11    CB  20 ALA      CG  99 THR     5.00 
   12    HA  20 ALA      CG  82 THR     6.00 
   13    CB  20 ALA     Hb2  25 TYR     3.84 
   14    CB  20 ALA     Hb2  25 TYR    -3.10 
   15    CB  20 ALA     Hb3  25 TYR     3.89 
   16    CB  20 ALA     Hb3  25 TYR    -3.23 
   17    CB  20 ALA      HA  25 TYR     6.00 
   18    CB  20 ALA      HA  82 THR     6.00 
   19    CB  20 ALA      HA 101 GLN     7.00 
   20    CB  20 ALA      PB 101 GLN     5.90 
   21    CB  20 ALA      CG  25 TYR     6.10 
   22    CB  20 ALA     HE2  25 TYR     5.00 
   23    HA  20 ALA     HD1  25 TYR     3.28 
   24    HA  20 ALA     HD1  25 TYR    -2.78 
   25    HA  20 ALA     HE1  25 TYR     4.40 
   26    HA  20 ALA     HE1  25 TYR    -3.90 
   27    HA  20 ALA       H  25 TYR     5.00 
   28    CB  20 ALA     HE1  48 HIS     4.87 
   29    CB  20 ALA     HE1  48 HIS    -4.01 
   30    HA  20 ALA     HE1  48 HIS     3.57 
   31    HA  20 ALA     HE1  48 HIS    -3.07 
   32    CB  20 ALA     HD2  48 HIS     7.00 



     Aminoacid   21  SER

    1     H  21 SER      HA  20 ALA     4.00 
    2     H  21 SER      CB  20 ALA     4.26 
    3     H  21 SER      CB  20 ALA    -3.52 
    4     H  21 SER      PB  21 SER     4.90 
    5    HA  21 SER      PB  21 SER     3.90 
    6    HA  21 SER       H  22 SER     3.32 
    7    HA  21 SER       H  22 SER    -2.82 
    8     H  21 SER       H  22 SER     2.76 
    9     H  21 SER       H  22 SER    -2.26 
   10     H  21 SER     HD1  25 TYR     3.92 
   11     H  21 SER     HD1  25 TYR    -3.42 



     Aminoacid   22  SER

    1     H  22 SER      HA  21 SER     3.32 
    2     H  22 SER      HA  21 SER    -2.82 
    3     H  22 SER       H  21 SER     2.76 
    4     H  22 SER       H  21 SER    -2.26 
    5    HA  22 SER      PB  22 SER     3.90 
    6     H  22 SER      PB  22 SER     4.90 
    7    HA  22 SER       H  23 SER     3.00 
    8     H  22 SER       H  23 SER     4.07 
    9     H  22 SER       H  23 SER    -3.57 
   10    PB  22 SER       H  23 SER     4.90 



     Aminoacid   23  SER

    1     H  23 SER      HA  22 SER     3.00 
    2     H  23 SER       H  22 SER     4.07 
    3     H  23 SER       H  22 SER    -3.57 
    4     H  23 SER      PB  22 SER     4.90 
    5    HA  23 SER      PB  23 SER     3.90 
    6     H  23 SER       H  24 ASN     3.32 
    7     H  23 SER       H  24 ASN    -2.82 
    8    PB  23 SER       H  24 ASN     5.90 
    9    HA  23 SER      HB  99 THR     3.00 
   10    HA  23 SER      CG  99 THR     4.96 
   11    HA  23 SER      CG  99 THR    -3.99 



     Aminoacid   24  ASN

    1     H  24 ASN       H  23 SER     3.32 
    2     H  24 ASN       H  23 SER    -2.82 
    3     H  24 ASN      PB  23 SER     5.90 
    4    HA  24 ASN      PB  24 ASN     3.90 
    5     H  24 ASN      PB  24 ASN     3.90 
    6    PB  24 ASN       H  25 TYR     3.90 
    7    HA  24 ASN       H  25 TYR     3.36 
    8    HA  24 ASN       H  25 TYR    -2.86 
    9     H  24 ASN       H  25 TYR     2.84 
   10     H  24 ASN       H  25 TYR    -2.34 
   11    HA  24 ASN      PB  27 ASN     4.90 
   12   ND2  24 ASN      PB  24 ASN     4.90 
   13   ND2  24 ASN      HA  24 ASN     6.00 



     Aminoacid   25  TYR

    1   HE1  25 TYR      CG  17 THR     4.81 
    2   HE1  25 TYR      CG  17 THR    -3.98 
    3   HE1  25 TYR      HB  17 THR     5.00 
    4     H  25 TYR      CB  20 ALA     5.00 
    5   Hb2  25 TYR      CB  20 ALA     3.84 
    6   Hb2  25 TYR      CB  20 ALA    -3.10 
    7   Hb3  25 TYR      CB  20 ALA     3.89 
    8   Hb3  25 TYR      CB  20 ALA    -3.23 
    9    HA  25 TYR      CB  20 ALA     6.00 
   10    CG  25 TYR      CB  20 ALA     6.10 
   11   HE2  25 TYR      CB  20 ALA     5.00 
   12   HD1  25 TYR      HA  20 ALA     3.28 
   13   HD1  25 TYR      HA  20 ALA    -2.78 
   14   HE1  25 TYR      HA  20 ALA     4.40 
   15   HE1  25 TYR      HA  20 ALA    -3.90 
   16     H  25 TYR      HA  20 ALA     5.00 
   17   HD1  25 TYR       H  21 SER     3.92 
   18   HD1  25 TYR       H  21 SER    -3.42 
   19     H  25 TYR      PB  24 ASN     3.90 
   20     H  25 TYR      HA  24 ASN     3.36 
   21     H  25 TYR      HA  24 ASN    -2.86 
   22     H  25 TYR       H  24 ASN     2.84 
   23     H  25 TYR       H  24 ASN    -2.34 
   24     H  25 TYR     Hb3  25 TYR     3.00 
   25   Hb2  25 TYR       H  25 TYR     2.92 
   26   Hb2  25 TYR       H  25 TYR    -2.42 
   27   Hb3  25 TYR      HA  25 TYR     2.65 
   28   Hb3  25 TYR      HA  25 TYR    -2.15 
   29   Hb2  25 TYR      HA  25 TYR     2.74 
   30   Hb2  25 TYR      HA  25 TYR    -2.24 
   31   Hb3  25 TYR       H  26 CYS     2.83 
   32   Hb3  25 TYR       H  26 CYS    -2.33 
   33   Hb2  25 TYR       H  26 CYS     5.00 
   34     H  25 TYR       H  26 CYS     5.00 
   35     H  25 TYR      CG  99 THR     4.95 
   36     H  25 TYR      CG  99 THR    -2.87 
   37   Hb3  25 TYR      CG  99 THR     4.00 
   38   Hb2  25 TYR      CG  99 THR     5.00 
   39    CG  25 TYR      PB  25 TYR     6.00 
   40   HD2  25 TYR      CG  82 THR     3.38 
   41   HD2  25 TYR      CG  82 THR    -2.74 
   42   HD2  25 TYR      CG  99 THR     4.00 
   43   HD2  25 TYR      HA  26 CYS     2.89 
   44   HD2  25 TYR      HA  26 CYS    -2.39 
   45   HD1  25 TYR      HA  25 TYR     3.19 
   46   HD1  25 TYR      HA  25 TYR    -2.69 
   47   HE2  25 TYR      CG  82 THR     3.82 
   48   HE2  25 TYR      CG  82 THR    -2.99 
   49    CZ  25 TYR      PB  25 TYR     8.00 
   50   HE2  25 TYR      HB  82 THR     2.86 
   51   HE2  25 TYR      HB  82 THR    -2.36 
   52   HE2  25 TYR     HD2  46 PHE     2.93 
   53   HE2  25 TYR     HD2  46 PHE    -2.43 
   54   HE2  25 TYR     Hb2  29 MET     5.00 
   55   HE1  25 TYR     HE1  48 HIS     3.93 
   56   HE1  25 TYR     HE1  48 HIS    -3.43 
   57   HE2  25 TYR     Hb3  46 PHE     5.00 
   58   HE2  25 TYR     Hb2  46 PHE     4.00 
   59   HD2  25 TYR       H  26 CYS     3.01 
   60   HD2  25 TYR       H  26 CYS    -2.51 
   61    CG  25 TYR       H  25 TYR     6.10 
   62   HE2  25 TYR      CG  99 THR     6.00 



     Aminoacid   26  CYS

    1     H  26 CYS     Hb3  25 TYR     2.83 
    2     H  26 CYS     Hb3  25 TYR    -2.33 
    3     H  26 CYS     Hb2  25 TYR     5.00 
    4     H  26 CYS       H  25 TYR     5.00 
    5    HA  26 CYS     HD2  25 TYR     2.89 
    6    HA  26 CYS     HD2  25 TYR    -2.39 
    7     H  26 CYS     HD2  25 TYR     3.01 
    8     H  26 CYS     HD2  25 TYR    -2.51 
    9     H  26 CYS     Hb2  26 CYS     2.89 
   10     H  26 CYS     Hb2  26 CYS    -2.39 
   11    HA  26 CYS     Hb3  26 CYS     3.27 
   12    HA  26 CYS     Hb3  26 CYS    -2.77 
   13   Hb2  26 CYS      HA  26 CYS     3.09 
   14   Hb2  26 CYS      HA  26 CYS    -2.59 
   15   Hb3  26 CYS       H  27 ASN     4.82 
   16   Hb3  26 CYS       H  27 ASN    -3.69 
   17   Hb2  26 CYS       H  27 ASN     3.53 
   18   Hb2  26 CYS       H  27 ASN    -3.03 
   19     H  26 CYS       H  27 ASN     3.33 
   20     H  26 CYS       H  27 ASN    -2.83 
   21   Hb2  26 CYS      HA  99 THR     3.89 
   22   Hb2  26 CYS      HA  99 THR    -3.39 
   23   Hb2  26 CYS     Hb3  97 TYR     2.91 
   24   Hb2  26 CYS     Hb3  97 TYR    -2.41 
   25   Hb2  26 CYS     Hb2  97 TYR     3.42 
   26   Hb2  26 CYS     Hb2  97 TYR    -2.92 
   27    HA  26 CYS       H  30 MET     3.77 
   28    HA  26 CYS       H  30 MET    -3.27 
   29     H  26 CYS      CG  99 THR     4.00 
   30    HA  26 CYS     Hb3  29 MET     3.00 
   31    HA  26 CYS     Hb2  29 MET     3.00 
   32    HA  26 CYS      PG  30 MET     6.90 



     Aminoacid   27  ASN

    1    PB  27 ASN      HA  24 ASN     4.90 
    2     H  27 ASN     Hb3  26 CYS     4.82 
    3     H  27 ASN     Hb3  26 CYS    -3.69 
    4     H  27 ASN     Hb2  26 CYS     3.53 
    5     H  27 ASN     Hb2  26 CYS    -3.03 
    6     H  27 ASN       H  26 CYS     3.33 
    7     H  27 ASN       H  26 CYS    -2.83 
    8     H  27 ASN      PB  27 ASN     3.90 
    9    HA  27 ASN      PB  27 ASN     3.90 
   10    PB  27 ASN       H  28 GLN     3.90 
   11     H  27 ASN       H  28 GLN     3.64 
   12     H  27 ASN       H  28 GLN    -2.96 
   13    PB  27 ASN      HA  28 GLN     5.90 
   14    HA  27 ASN       H  30 MET     5.00 
   15   ND2  27 ASN      PB  27 ASN     5.00 
   16    HA  27 ASN      CZ  97 TYR     7.10 



     Aminoacid   28  GLN

    1     H  28 GLN      PB  27 ASN     3.90 
    2     H  28 GLN       H  27 ASN     3.64 
    3     H  28 GLN       H  27 ASN    -2.96 
    4    HA  28 GLN      PB  27 ASN     5.90 
    5     H  28 GLN     Hb3  28 GLN     2.93 
    6     H  28 GLN     Hb3  28 GLN    -2.43 
    7     H  28 GLN     Hb2  28 GLN     3.00 
    8     H  28 GLN      PG  28 GLN     3.90 
    9    HA  28 GLN     Hb3  28 GLN     3.00 
   10    HA  28 GLN     Hb2  28 GLN     4.00 
   11    HA  28 GLN      PG  28 GLN     4.90 
   12    HA  28 GLN       H  29 MET     4.00 
   13     H  28 GLN       H  29 MET     2.78 
   14     H  28 GLN       H  29 MET    -2.28 
   15    PG  28 GLN       H  29 MET     5.90 
   16   Hb3  28 GLN       H  29 MET     2.86 
   17   Hb3  28 GLN       H  29 MET    -2.36 
   18   Hb2  28 GLN       H  29 MET     3.35 
   19   Hb2  28 GLN       H  29 MET    -2.85 
   20   NE2  28 GLN      PG  28 GLN     4.90 
   21   NE2  28 GLN     Hb3  28 GLN     5.00 
   22    HA  28 GLN       H  31 LYS     3.62 
   23    HA  28 GLN       H  31 LYS    -3.12 



     Aminoacid   29  MET

    1   Hb2  29 MET     HE2  25 TYR     5.00 
    2   Hb3  29 MET      HA  26 CYS     3.00 
    3   Hb2  29 MET      HA  26 CYS     3.00 
    4     H  29 MET      HA  28 GLN     4.00 
    5     H  29 MET       H  28 GLN     2.78 
    6     H  29 MET       H  28 GLN    -2.28 
    7     H  29 MET      PG  28 GLN     5.90 
    8     H  29 MET     Hb3  28 GLN     2.86 
    9     H  29 MET     Hb3  28 GLN    -2.36 
   10     H  29 MET     Hb2  28 GLN     3.35 
   11     H  29 MET     Hb2  28 GLN    -2.85 
   12     H  29 MET      PG  29 MET     4.90 
   13   Hb3  29 MET       H  29 MET     2.67 
   14   Hb3  29 MET       H  29 MET    -2.17 
   15     H  29 MET     Hb2  29 MET     3.48 
   16     H  29 MET     Hb2  29 MET    -2.46 
   17    CE  29 MET     Hb3  29 MET     4.00 
   18   Hb2  29 MET      PG  29 MET     3.90 
   19   Hb3  29 MET      HA  29 MET     3.11 
   20   Hb3  29 MET      HA  29 MET    -2.61 
   21    HA  29 MET     Hb2  29 MET     2.76 
   22    HA  29 MET     Hb2  29 MET    -2.26 
   23   Hb3  29 MET       H  30 MET     4.00 
   24   Hb2  29 MET       H  30 MET     3.14 
   25   Hb2  29 MET       H  30 MET    -2.64 
   26     H  29 MET       H  30 MET     2.92 
   27     H  29 MET       H  30 MET    -2.42 
   28    HA  29 MET       H  30 MET     4.66 
   29    HA  29 MET       H  30 MET    -3.84 
   30    HA  29 MET      PB  32 SER     5.90 
   31    PG  29 MET      CG  46 PHE     8.10 
   32    PG  29 MET      CZ  46 PHE     8.10 
   33    PB  29 MET     HE2  46 PHE     4.90 



     Aminoacid   30  MET

    1     H  30 MET      HA  26 CYS     3.77 
    2     H  30 MET      HA  26 CYS    -3.27 
    3    PG  30 MET      HA  26 CYS     6.90 
    4     H  30 MET      HA  27 ASN     5.00 
    5     H  30 MET     Hb3  29 MET     4.00 
    6     H  30 MET     Hb2  29 MET     3.14 
    7     H  30 MET     Hb2  29 MET    -2.64 
    8     H  30 MET       H  29 MET     2.92 
    9     H  30 MET       H  29 MET    -2.42 
   10     H  30 MET      HA  29 MET     4.66 
   11     H  30 MET      HA  29 MET    -3.84 
   12     H  30 MET      CE  30 MET     6.00 
   13   Hb3  30 MET      PG  30 MET     4.00 
   14   Hb2  30 MET      PG  30 MET     4.00 
   15     H  30 MET      PG  30 MET     3.90 
   16     H  30 MET     Hb3  30 MET     5.00 
   17     H  30 MET     Hb2  30 MET     4.00 
   18    HA  30 MET     Hb3  30 MET     3.92 
   19    HA  30 MET     Hb3  30 MET    -3.26 
   20    HA  30 MET     Hb2  30 MET     5.00 
   21    HA  30 MET      PG  30 MET     5.90 
   22    PG  30 MET      CE  30 MET     4.90 
   23   Hb2  30 MET       H  31 LYS     4.00 
   24     H  30 MET       H  31 LYS     2.91 
   25     H  30 MET       H  31 LYS    -2.41 
   26    HA  30 MET     Hb3  35 LEU     5.00 
   27    HA  30 MET     CD1  35 LEU     4.00 
   28    HA  30 MET      HG  35 LEU     5.00 
   29    HA  30 MET      HZ  46 PHE     3.00 
   30    HA  30 MET     HE2  46 PHE     2.66 
   31    HA  30 MET     HE2  46 PHE    -2.16 
   32    PG  30 MET     HE2  46 PHE     5.90 
   33    CE  30 MET      PB  44 ASN     5.90 



     Aminoacid   31  LYS

    1     H  31 LYS     Hb2  30 MET     4.00 
    2     H  31 LYS       H  30 MET     2.91 
    3     H  31 LYS       H  30 MET    -2.41 
    4     H  31 LYS      PB  31 LYS     3.90 
    5    HA  31 LYS      PB  31 LYS     3.90 
    6    PB  31 LYS      PG  31 LYS     4.80 
    7    PB  31 LYS       H  32 SER     3.90 
    8     H  31 LYS       H  32 SER     3.02 
    9     H  31 LYS       H  32 SER    -2.52 
   10     H  31 LYS      HA  28 GLN     3.62 
   11     H  31 LYS      HA  28 GLN    -3.12 
   12    PB  31 LYS      HA  32 SER     4.90 
   13     H  31 LYS      CG  36 THR     6.00 
   14    HA  31 LYS      CG  36 THR     4.07 
   15    HA  31 LYS      CG  36 THR    -3.39 



     Aminoacid   32  SER

    1    PB  32 SER      HA  29 MET     5.90 
    2     H  32 SER      PB  31 LYS     3.90 
    3     H  32 SER       H  31 LYS     3.02 
    4     H  32 SER       H  31 LYS    -2.52 
    5    HA  32 SER      PB  31 LYS     4.90 
    6     H  32 SER      HA  32 SER     3.17 
    7     H  32 SER      HA  32 SER    -2.67 
    8     H  32 SER      PB  32 SER     3.90 
    9    HA  32 SER      PB  32 SER     3.90 
   10     H  32 SER       H  33 ARG     3.15 
   11     H  32 SER       H  33 ARG    -2.65 
   12    HA  32 SER       H  34 ASN     5.00 



     Aminoacid   33  ARG

    1     H  33 ARG       H  32 SER     3.15 
    2     H  33 ARG       H  32 SER    -2.65 
    3     H  33 ARG     Hb3  33 ARG     4.00 
    4     H  33 ARG     Hb2  33 ARG     3.00 
    5    HA  33 ARG     Hb3  33 ARG     4.00 
    6    HA  33 ARG     Hb2  33 ARG     4.00 
    7   Hb3  33 ARG      PD  33 ARG     4.90 
    8   Hb2  33 ARG      PD  33 ARG     4.90 
    9    HA  33 ARG      PD  33 ARG     3.90 
   10     H  33 ARG       H  34 ASN     4.00 
   11    PB  33 ARG      CG  35 LEU     6.90 
   12   Hb2  33 ARG      HZ  46 PHE     4.00 
   13    PB  33 ARG     HE1  46 PHE     7.10 
   14    PG  33 ARG      CG  46 PHE     7.00 
   15    HE  33 ARG      CZ  33 ARG     6.20 
   16    HE  33 ARG      PD  33 ARG     3.90 
   17    HE  33 ARG      PG  33 ARG     4.90 
   18    CZ  33 ARG     Hb2  33 ARG     5.60 
   19    HE  33 ARG       H  33 ARG     5.00 



     Aminoacid   34  ASN

    1     H  34 ASN      HA  32 SER     5.00 
    2     H  34 ASN       H  33 ARG     4.00 
    3     H  34 ASN      PB  34 ASN     5.90 
    4     H  34 ASN      HA  34 ASN     3.00 
    5    HA  34 ASN      PB  34 ASN     3.90 
    6    HA  34 ASN       H  35 LEU     5.00 
    7     H  34 ASN       H  35 LEU     3.19 
    8     H  34 ASN       H  35 LEU    -2.69 
    9    HA  34 ASN      PB  37 LYS     4.90 
   10   ND2  34 ASN      PB  34 ASN     5.90 



     Aminoacid   35  LEU

    1   Hb3  35 LEU      HA  11 GLN     5.00 
    2   CD1  35 LEU      HA  11 GLN     5.00 
    3   CD2  35 LEU      HA  11 GLN     5.00 
    4   CD2  35 LEU      PG  11 GLN     5.00 
    5   Hb3  35 LEU      HA  30 MET     5.00 
    6   CD1  35 LEU      HA  30 MET     4.00 
    7    HG  35 LEU      HA  30 MET     5.00 
    8    CG  35 LEU      PB  33 ARG     6.90 
    9     H  35 LEU      HA  34 ASN     5.00 
   10     H  35 LEU       H  34 ASN     3.19 
   11     H  35 LEU       H  34 ASN    -2.69 
   12     H  35 LEU     Hb3  35 LEU     4.00 
   13   Hb2  35 LEU       H  35 LEU     2.62 
   14   Hb2  35 LEU       H  35 LEU    -2.12 
   15     H  35 LEU      HG  35 LEU     3.00 
   16     H  35 LEU     CD1  35 LEU     4.17 
   17     H  35 LEU     CD1  35 LEU    -3.27 
   18    HA  35 LEU     CD2  35 LEU     4.00 
   19    HA  35 LEU     Hb3  35 LEU     3.00 
   20   Hb3  35 LEU     CD1  35 LEU     4.00 
   21   Hb3  35 LEU     CD2  35 LEU     4.00 
   22   Hb2  35 LEU     CD1  35 LEU     5.00 
   23     H  35 LEU       H  36 THR     2.83 
   24     H  35 LEU       H  36 THR    -2.33 
   25    CG  35 LEU      CZ  46 PHE     7.30 
   26    CG  35 LEU      HZ  46 PHE     5.20 



     Aminoacid   36  THR

    1    CG  36 THR       H  31 LYS     6.00 
    2    CG  36 THR      HA  31 LYS     4.07 
    3    CG  36 THR      HA  31 LYS    -3.39 
    4     H  36 THR       H  35 LEU     2.83 
    5     H  36 THR       H  35 LEU    -2.33 
    6     H  36 THR      CG  36 THR     3.88 
    7     H  36 THR      CG  36 THR    -3.23 
    8    HA  36 THR      CG  36 THR     3.50 
    9    HA  36 THR      CG  36 THR    -2.87 
   10    HA  36 THR       H  37 LYS     5.00 
   11    CG  36 THR       H  37 LYS     5.00 
   12    HA  36 THR       H  41 LYS     3.77 
   13    HA  36 THR       H  41 LYS    -3.27 
   14    CG  36 THR       H  41 LYS     5.00 
   15    CG  36 THR      HA  41 LYS     6.00 
   16    CG  36 THR     Hb3  95 CYS     5.00 
   17    CG  36 THR     Hb2  95 CYS     3.81 
   18    CG  36 THR     Hb2  95 CYS    -3.01 
   19    HB  36 THR     Hb2  95 CYS     5.00 
   20    HA  36 THR      HA  40 CYS     3.00 
   21    CG  36 THR      HH  97 TYR     4.70 
   22    CG  36 THR      HH  97 TYR    -3.92 
   23    CG  36 THR     HE2  97 TYR     4.82 
   24    CG  36 THR     HE2  97 TYR    -4.03 
   25    CG  36 THR     HD2  97 TYR     6.00 




     Aminoacid   37  LYS

    1    PB  37 LYS      HA  34 ASN     4.90 
    2     H  37 LYS      HA  36 THR     5.00 
    3     H  37 LYS      CG  36 THR     5.00 
    4    PB  37 LYS      HA  37 LYS     3.90 
    5    PB  37 LYS       H  38 ASP     4.90 
    6     H  37 LYS       H  38 ASP     2.95 
    7     H  37 LYS       H  38 ASP    -2.45 
    8    HA  37 LYS       H  38 ASP     3.00 
    9    HA  37 LYS      PG  37 LYS     4.90 
   10     H  37 LYS       H  39 ARG     5.00 
   11    HA  37 LYS     HD1  92 TYR     5.00 
   12    HA  37 LYS      PD  37 LYS     4.90 




     Aminoacid   38  ASP

    1     H  38 ASP      PB  37 LYS     4.90 
    2     H  38 ASP       H  37 LYS     2.95 
    3     H  38 ASP       H  37 LYS    -2.45 
    4     H  38 ASP      HA  37 LYS     3.00 
    5    PB  38 ASP      HA  38 ASP     3.90 
    6     H  38 ASP       H  39 ARG     2.59 
    7     H  38 ASP       H  39 ARG    -2.09 
    8    HA  38 ASP     HD1  92 TYR     5.00 
    9     H  38 ASP     HD1  92 TYR     5.00 




     Aminoacid   39  ARG

    1     H  39 ARG       H  37 LYS     5.00 
    2     H  39 ARG       H  38 ASP     2.59 
    3     H  39 ARG       H  38 ASP    -2.09 
    4     H  39 ARG     Hb3  39 ARG     3.16 
    5     H  39 ARG     Hb3  39 ARG    -2.66 
    6     H  39 ARG     Hb2  39 ARG     3.43 
    7     H  39 ARG     Hb2  39 ARG    -2.93 
    8    HA  39 ARG     Hb3  39 ARG     3.00 
    9    HA  39 ARG     Hb2  39 ARG     2.32 
   10    HA  39 ARG     Hb2  39 ARG    -1.82 
   11    HA  39 ARG     Hg3  39 ARG     5.00 
   12    HA  39 ARG     Hg2  39 ARG     5.00 
   13    PD  39 ARG      PB  39 ARG     4.90 
   14    PD  39 ARG      PG  39 ARG     4.90 
   15     H  39 ARG     Hg3  39 ARG     3.25 
   16     H  39 ARG     Hg3  39 ARG    -2.75 
   17    HE  39 ARG      PD  39 ARG     4.90 
   18   Hb2  39 ARG       H  40 CYS     3.25 
   19   Hb2  39 ARG       H  40 CYS    -2.75 
   20   Hb3  39 ARG       H  40 CYS     2.68 
   21   Hb3  39 ARG       H  40 CYS    -2.18 
   22    HA  39 ARG       H  40 CYS     2.55 
   23    HA  39 ARG       H  40 CYS    -2.05 
   24    HA  39 ARG     HD1  92 TYR     4.00 




     Aminoacid   40  CYS

    1    HA  40 CYS      HA  36 THR     3.00 
    2     H  40 CYS     Hb2  39 ARG     3.25 
    3     H  40 CYS     Hb2  39 ARG    -2.75 
    4     H  40 CYS     Hb3  39 ARG     2.68 
    5     H  40 CYS     Hb3  39 ARG    -2.18 
    6     H  40 CYS      HA  39 ARG     2.55 
    7     H  40 CYS      HA  39 ARG    -2.05 
    8     H  40 CYS     Hb3  40 CYS     3.68 
    9     H  40 CYS     Hb3  40 CYS    -3.18 
   10     H  40 CYS     Hb2  40 CYS     3.16 
   11     H  40 CYS     Hb2  40 CYS    -2.66 
   12    HA  40 CYS     Hb3  40 CYS     3.00 
   13    HA  40 CYS     Hb2  40 CYS     4.00 
   14   Hb3  40 CYS       H  41 LYS     4.00 
   15    HA  40 CYS       H  41 LYS     4.00 
   16     H  40 CYS     Hb2  92 TYR     4.53 
   17     H  40 CYS     Hb2  92 TYR    -3.24 
   18   Hb3  40 CYS      HH  97 TYR     3.20 
   19   Hb3  40 CYS      HH  97 TYR    -2.70 
   20    HA  40 CYS     HD1  92 TYR     5.00 
   21     H  40 CYS     HD1  92 TYR     5.00 




     Aminoacid   41  LYS

    1     H  41 LYS      HA  36 THR     3.77 
    2     H  41 LYS      HA  36 THR    -3.27 
    3     H  41 LYS      CG  36 THR     5.00 
    4    HA  41 LYS      CG  36 THR     6.00 
    5     H  41 LYS     Hb3  40 CYS     4.00 
    6     H  41 LYS      HA  40 CYS     4.00 
    7     H  41 LYS     Hb3  41 LYS     2.69 
    8     H  41 LYS     Hb3  41 LYS    -2.19 
    9     H  41 LYS     Hb2  41 LYS     2.80 
   10     H  41 LYS     Hb2  41 LYS    -2.30 
   11     H  41 LYS     Hg2  41 LYS     3.63 
   12     H  41 LYS     Hg2  41 LYS    -2.21 
   13    HA  41 LYS     Hb2  41 LYS     4.00 
   14    HA  41 LYS     Hb3  41 LYS     3.12 
   15    HA  41 LYS     Hb3  41 LYS    -2.62 
   16    HA  41 LYS      PG  41 LYS     4.90 
   17    PE  41 LYS      PD  41 LYS     5.80 
   18    PE  41 LYS      PG  41 LYS     5.80 
   19    PD  41 LYS      PB  41 LYS     5.80 
   20   Hg3  41 LYS     Hd3  42 PRO     5.00 
   21   Hg3  41 LYS     Hd2  42 PRO     2.92 
   22   Hg3  41 LYS     Hd2  42 PRO    -2.42 
   23   Hg2  41 LYS     Hd3  42 PRO     5.00 
   24   Hg2  41 LYS     Hd2  42 PRO     3.79 
   25   Hg2  41 LYS     Hd2  42 PRO    -3.29 
   26    HA  41 LYS     Hd3  42 PRO     3.00 
   27    HA  41 LYS     Hd2  42 PRO     3.00 
   28   Hb3  41 LYS      HH  97 TYR     4.00 
   29   Hg3  41 LYS       H  43 VAL     4.00 
   30   Hg2  41 LYS       H  43 VAL     2.46 
   31   Hg2  41 LYS       H  43 VAL    -1.96 
   32     H  41 LYS      HH  97 TYR     3.15 
   33     H  41 LYS      HH  97 TYR    -2.65 
   34   Hg3  41 LYS     Hd2  42 PRO     2.92 
   35   Hg3  41 LYS     Hd2  42 PRO    -2.42 
   36   Hg2  41 LYS     Hd2  42 PRO     3.79 
   37   Hg2  41 LYS     Hd2  42 PRO    -3.29 




     Aminoacid   42  PRO

    1   Hd3  42 PRO     Hg3  41 LYS     5.00 
    2   Hd2  42 PRO     Hg3  41 LYS     2.92 
    3   Hd2  42 PRO     Hg3  41 LYS    -2.42 
    4   Hd3  42 PRO     Hg2  41 LYS     5.00 
    5   Hd2  42 PRO     Hg2  41 LYS     3.79 
    6   Hd2  42 PRO     Hg2  41 LYS    -3.29 
    7   Hd3  42 PRO      HA  41 LYS     3.00 
    8   Hd2  42 PRO      HA  41 LYS     3.00 
    9   Hd2  42 PRO     Hg3  41 LYS     2.92 
   10   Hd2  42 PRO     Hg3  41 LYS    -2.42 
   11   Hd2  42 PRO     Hg2  41 LYS     3.79 
   12   Hd2  42 PRO     Hg2  41 LYS    -3.29 
   13   Hb3  42 PRO     Hd3  42 PRO     4.39 
   14   Hb3  42 PRO     Hd3  42 PRO    -3.13 
   15   Hg3  42 PRO     Hd2  42 PRO     3.78 
   16   Hg3  42 PRO     Hd2  42 PRO    -2.70 
   17   Hg2  42 PRO     Hd2  42 PRO     2.92 
   18   Hg2  42 PRO     Hd2  42 PRO    -2.30 
   19    HA  42 PRO      PG  42 PRO     3.90 
   20    HA  42 PRO     Hb3  42 PRO     3.00 
   21    HA  42 PRO     Hb2  42 PRO     3.00 
   22    HA  42 PRO      PB  86 GLU     3.90 
   23   Hb2  42 PRO      CB  43 VAL     6.20 




     Aminoacid   43  VAL

    1    HA  43 VAL       H  86 GLU     3.86 
    2    HA  43 VAL       H  86 GLU    -3.36 
    3     H  43 VAL     Hg3  41 LYS     4.00 
    4     H  43 VAL     Hg2  41 LYS     2.46 
    5     H  43 VAL     Hg2  41 LYS    -1.96 
    6    CB  43 VAL     Hb2  42 PRO     6.20 
    7     H  43 VAL      CB  43 VAL     5.20 
    8     H  43 VAL      HB  43 VAL     3.00 
    9    HA  43 VAL      CB  43 VAL     5.20 
   10    HA  43 VAL      HB  43 VAL     2.57 
   11    HA  43 VAL      HB  43 VAL    -2.07 
   12    HA  43 VAL       H  44 ASN     2.38 
   13    HA  43 VAL       H  44 ASN    -1.88 
   14    CB  43 VAL       H  44 ASN     5.20 
   15    CB  43 VAL       H  86 GLU     7.20 
   16    CB  43 VAL      HA  85 ARG     6.20 
   17    CB  43 VAL      HA  44 ASN     7.20 
   18    HB  43 VAL      HA  85 ARG     5.00 
   19    HA  43 VAL      PB  85 ARG     5.90 
   20    CB  43 VAL       H  84 CYS     7.20 
   21    CB  43 VAL      PD  85 ARG     8.10 
   22    CB  43 VAL      PG  85 ARG     7.10 
   23    HA  43 VAL      HA  85 ARG     3.00 
   24    CB  43 VAL     ND2  44 ASN     8.30 




     Aminoacid   44  ASN

    1    HA  44 ASN     HE1  12 HIS     4.00 
    2    PB  44 ASN      CE  30 MET     5.90 
    3     H  44 ASN      HA  43 VAL     2.38 
    4     H  44 ASN      HA  43 VAL    -1.88 
    5     H  44 ASN      CB  43 VAL     5.20 
    6    HA  44 ASN      CB  43 VAL     7.20 
    7   ND2  44 ASN      CB  43 VAL     8.30 
    8     H  44 ASN     Hb3  44 ASN     3.51 
    9     H  44 ASN     Hb3  44 ASN    -3.01 
   10     H  44 ASN     Hb2  44 ASN     4.00 
   11    HA  44 ASN     Hb3  44 ASN     4.00 
   12    HA  44 ASN     Hb2  44 ASN     3.00 
   13     H  44 ASN      HA  85 ARG     5.00 
   14    HA  44 ASN       H  45 THR     4.00 
   15     H  44 ASN     Hb3  84 CYS     4.02 
   16     H  44 ASN     Hb3  84 CYS    -3.52 
   17     H  44 ASN     Hb2  84 CYS     3.80 
   18     H  44 ASN     Hb2  84 CYS    -3.30 
   19     H  44 ASN      PB  85 ARG     5.90 
   20     H  44 ASN       H  84 CYS     5.00 
   21  HD21  44 ASN     Hb3  44 ASN     3.00 




     Aminoacid   45  THR

    1     H  45 THR     HD1  12 HIS     4.00 
    2     H  45 THR     HE1  12 HIS     3.00 
    3     H  45 THR     HE1  12 HIS    -2.50 
    4    HB  45 THR     HD1  12 HIS     5.00 
    5     H  45 THR      HA  44 ASN     4.00 
    6     H  45 THR      HB  45 THR     3.00 
    7    CG  45 THR       H  45 THR     4.78 
    8    CG  45 THR       H  45 THR    -3.70 
    9    HA  45 THR      HB  45 THR     3.14 
   10    HA  45 THR      HB  45 THR    -2.64 
   11    CG  45 THR      HA  45 THR     3.74 
   12    CG  45 THR      HA  45 THR    -3.04 
   13    HA  45 THR       H  46 PHE     3.00 
   14    CG  45 THR       H  46 PHE     3.66 
   15    CG  45 THR       H  46 PHE    -3.06 
   16    CG  45 THR       H  47 VAL     6.00 
   17    HA  45 THR      PB  83 ASP     4.90 
   18    CG  45 THR       H  82 THR     4.42 
   19    CG  45 THR       H  82 THR    -3.77 
   20    CG  45 THR      HA  81 ILE     4.64 
   21    CG  45 THR      HA  81 ILE    -3.53 
   22    CG  45 THR      HB  81 ILE     3.35 
   23    CG  45 THR      HB  81 ILE    -2.65 
   24    CG  45 THR      HZ 120 PHE     4.00 
   25    HB  45 THR     HE1 120 PHE     5.00 
   26    HA  45 THR      CG  46 PHE     7.10 
   27    HB  45 THR     HD1 120 PHE     3.97 
   28    HB  45 THR     HD1 120 PHE    -3.47 
   29    CG  45 THR     HD1 120 PHE     4.00 
   30    HB  45 THR      HZ 120 PHE     5.00 




     Aminoacid   46  PHE

    1   HE1  46 PHE      HA  11 GLN     4.00 
    2   HD1  46 PHE      HA  12 HIS     3.00 
    3    HA  46 PHE      HA  13 MET     5.00 
    4   HD1  46 PHE      HA  13 MET     5.00 
    5    PB  46 PHE       H  14 ASP     5.90 
    6   HD1  46 PHE      PB  14 ASP     4.90 
    7   HD2  46 PHE     HE2  25 TYR     2.93 
    8   HD2  46 PHE     HE2  25 TYR    -2.43 
    9   Hb3  46 PHE     HE2  25 TYR     5.00 
   10   Hb2  46 PHE     HE2  25 TYR     4.00 
   11    CG  46 PHE      PG  29 MET     8.10 
   12    CZ  46 PHE      PG  29 MET     8.10 
   13   HE2  46 PHE      PB  29 MET     4.90 
   14    HZ  46 PHE      HA  30 MET     3.00 
   15   HE2  46 PHE      HA  30 MET     2.66 
   16   HE2  46 PHE      HA  30 MET    -2.16 
   17   HE2  46 PHE      PG  30 MET     5.90 
   18    HZ  46 PHE     Hb2  33 ARG     4.00 
   19   HE1  46 PHE      PB  33 ARG     7.10 
   20    CG  46 PHE      PG  33 ARG     7.00 
   21    CZ  46 PHE      CG  35 LEU     7.30 
   22    HZ  46 PHE      CG  35 LEU     5.20 
   23     H  46 PHE      HA  45 THR     3.00 
   24     H  46 PHE      CG  45 THR     3.66 
   25     H  46 PHE      CG  45 THR    -3.06 
   26    CG  46 PHE      HA  45 THR     7.10 
   27     H  46 PHE     Hb3  46 PHE     4.00 
   28   Hb2  46 PHE       H  46 PHE     3.22 
   29   Hb2  46 PHE       H  46 PHE    -2.72 
   30   HD2  46 PHE       H  46 PHE     4.00 
   31    HA  46 PHE     Hb3  46 PHE     3.00 
   32    HA  46 PHE     Hb2  46 PHE     4.00 
   33    HA  46 PHE       H  47 VAL     3.00 
   34   Hb3  46 PHE       H  47 VAL     3.00 
   35   Hb2  46 PHE       H  47 VAL     3.00 
   36     H  46 PHE       H  82 THR     3.71 
   37     H  46 PHE       H  82 THR    -3.21 
   38   Hb3  46 PHE       H  82 THR     5.00 
   39   Hb2  46 PHE     HE1  48 HIS     5.00 
   40   Hb3  46 PHE      HB  82 THR     4.29 
   41   Hb3  46 PHE      HB  82 THR    -3.76 
   42   Hb2  46 PHE      HB  82 THR     3.03 
   43   Hb2  46 PHE      HB  82 THR    -2.53 
   44     H  46 PHE      HB  82 THR     3.98 
   45     H  46 PHE      HB  82 THR    -3.48 
   46   HD2  46 PHE      HB  82 THR     3.36 
   47   HD2  46 PHE      HB  82 THR    -2.25 
   48   HD1  46 PHE      HA  46 PHE     3.00 
   49    PB  46 PHE      CG  82 THR     6.90 




     Aminoacid   47  VAL

    1     H  47 VAL      HA  12 HIS     5.00 
    2   CG1  47 VAL      HA  12 HIS     6.00 
    3    HB  47 VAL      HA  13 MET     2.97 
    4    HB  47 VAL      HA  13 MET    -2.47 
    5     H  47 VAL      HA  13 MET     3.18 
    6     H  47 VAL      HA  13 MET    -2.68 
    7     H  47 VAL      CE  13 MET     7.00 
    8     H  47 VAL       H  14 ASP     4.60 
    9     H  47 VAL       H  14 ASP    -4.10 
   10     H  47 VAL      CG  45 THR     6.00 
   11     H  47 VAL      HA  46 PHE     3.00 
   12     H  47 VAL     Hb3  46 PHE     3.00 
   13     H  47 VAL     Hb2  46 PHE     3.00 
   14    HA  47 VAL       H  48 HIS     2.65 
   15    HA  47 VAL       H  48 HIS    -2.15 
   16     H  47 VAL      HB  47 VAL     2.59 
   17     H  47 VAL      HB  47 VAL    -2.09 
   18     H  47 VAL     CG2  47 VAL     4.00 
   19   CG2  47 VAL      HA  47 VAL     4.09 
   20   CG2  47 VAL      HA  47 VAL    -3.32 
   21   CG1  47 VAL      HA  47 VAL     3.68 
   22   CG1  47 VAL      HA  47 VAL    -3.00 
   23    HB  47 VAL      HA  47 VAL     4.00 
   24   CG1  47 VAL       H  48 HIS     4.03 
   25   CG1  47 VAL       H  48 HIS    -3.32 
   26    HA  47 VAL     CG2  81 ILE     4.04 
   27    HA  47 VAL     CG2  81 ILE    -3.26 
   28    HA  47 VAL      HA  81 ILE     2.72 
   29    HA  47 VAL      HA  81 ILE    -2.22 
   30   CG1  47 VAL      HA  81 ILE     5.59 
   31   CG1  47 VAL      HA  81 ILE    -4.77 
   32    HA  47 VAL       H  81 ILE     5.00 
   33   CG2  47 VAL       H  82 THR     6.00 
   34    HA  47 VAL       H  82 THR     4.84 
   35   CG1  47 VAL      PG  49 GLU     6.90 
   36   CG1  47 VAL     Hb2  49 GLU     5.00 
   37    HA  47 VAL     HD2  48 HIS     4.00 
   38   CG2  47 VAL     HD2 120 PHE     4.63 
   39   CG2  47 VAL     HD2 120 PHE    -3.89 
   40   CG2  47 VAL     HE2 120 PHE     3.50 
   41   CG2  47 VAL     HE2 120 PHE    -2.80 
   42   CG2  47 VAL      HZ 120 PHE     5.00 




     Aminoacid   48  HIS

    1   HE1  48 HIS      PB  14 ASP     3.90 
    2    HA  48 HIS      HA  15 SER     3.51 
    3    HA  48 HIS      HA  15 SER    -3.01 
    4   HE1  48 HIS      HB  17 THR     5.00 
    5   HE1  48 HIS      CG  17 THR     5.00 
    6    PB  48 HIS      HA  18 SER     3.90 
    7   HD2  48 HIS      HA  19 ALA     3.35 
    8   HD2  48 HIS      HA  19 ALA    -2.85 
    9   HE1  48 HIS      HA  19 ALA     4.87 
   10   HE1  48 HIS      HA  19 ALA    -4.10 
   11   HE1  48 HIS      CB  20 ALA     4.87 
   12   HE1  48 HIS      CB  20 ALA    -4.01 
   13   HE1  48 HIS      HA  20 ALA     3.57 
   14   HE1  48 HIS      HA  20 ALA    -3.07 
   15   HD2  48 HIS      CB  20 ALA     7.00 
   16   HE1  48 HIS     HE1  25 TYR     3.93 
   17   HE1  48 HIS     HE1  25 TYR    -3.43 
   18   HE1  48 HIS     Hb2  46 PHE     5.00 
   19     H  48 HIS      HA  47 VAL     2.65 
   20     H  48 HIS      HA  47 VAL    -2.15 
   21     H  48 HIS     CG1  47 VAL     4.03 
   22     H  48 HIS     CG1  47 VAL    -3.32 
   23   HD2  48 HIS      HA  47 VAL     4.00 
   24     H  48 HIS     Hb3  48 HIS     5.00 
   25     H  48 HIS     Hb2  48 HIS     3.32 
   26     H  48 HIS     Hb2  48 HIS    -2.82 
   27    HA  48 HIS     Hb3  48 HIS     2.90 
   28    HA  48 HIS     Hb3  48 HIS    -2.40 
   29    HA  48 HIS     Hb2  48 HIS     5.42 
   30    HA  48 HIS     Hb2  48 HIS    -3.41 
   31   HD2  48 HIS       H  48 HIS     3.34 
   32   HD2  48 HIS       H  48 HIS    -2.84 
   33    HA  48 HIS       H  49 GLU     2.81 
   34    HA  48 HIS       H  49 GLU    -2.31 
   35     H  48 HIS       H  49 GLU     3.82 
   36     H  48 HIS       H  49 GLU    -3.32 
   37     H  48 HIS     CG2  81 ILE     4.82 
   38     H  48 HIS     CG2  81 ILE    -3.90 
   39   Hb3  48 HIS      PB  80 SER     5.90 
   40   Hb2  48 HIS      PB  80 SER     3.90 
   41     H  48 HIS      HA  81 ILE     3.68 
   42     H  48 HIS      HA  81 ILE    -3.18 
   43     H  48 HIS      PB  80 SER     5.90 
   44   HD2  48 HIS     Hb3  48 HIS     5.09 
   45   HD2  48 HIS     Hb3  48 HIS    -3.60 
   46   HD2  48 HIS     Hb2  48 HIS     3.25 
   47   HD2  48 HIS     Hb2  48 HIS    -2.75 
   48   HD2  48 HIS      HA  81 ILE     2.98 
   49   HD2  48 HIS      HA  81 ILE    -2.48 
   50   HD2  48 HIS      CG  82 THR     4.70 
   51   HD2  48 HIS      CG  82 THR    -3.99 
   52   HD2  48 HIS       H  82 THR     3.69 
   53   HD2  48 HIS       H  82 THR    -3.19 
   54   HD2  48 HIS      PB  80 SER     4.90 
   55   HD2  48 HIS      HB  82 THR     5.00 
   56   HE1  48 HIS      HB  82 THR     5.00 




     Aminoacid   49  GLU

    1    PG  49 GLU     CG1  47 VAL     6.90 
    2   Hb2  49 GLU     CG1  47 VAL     5.00 
    3     H  49 GLU      HA  48 HIS     2.81 
    4     H  49 GLU      HA  48 HIS    -2.31 
    5     H  49 GLU       H  48 HIS     3.82 
    6     H  49 GLU       H  48 HIS    -3.32 
    7     H  49 GLU     Hb3  49 GLU     3.27 
    8     H  49 GLU     Hb3  49 GLU    -2.77 
    9     H  49 GLU     Hb2  49 GLU     3.00 
   10     H  49 GLU      PG  49 GLU     3.90 
   11    HA  49 GLU       H  49 GLU     3.65 
   12    HA  49 GLU       H  49 GLU    -3.15 
   13   Hb3  49 GLU      PG  49 GLU     4.90 
   14   Hb2  49 GLU      PG  49 GLU     3.90 
   15    HA  49 GLU     Hb3  49 GLU     5.00 
   16    HA  49 GLU     Hb2  49 GLU     5.00 
   17    HA  49 GLU      PG  49 GLU     3.90 
   18   Hb3  49 GLU       H  50 SER     4.00 
   19    HA  49 GLU       H  50 SER     3.00 
   20    PG  49 GLU       H  50 SER     5.90 
   21    PG  49 GLU     Hb3  79 MET     5.90 
   22   Hb3  49 GLU      PB  53 ASP     4.90 
   23    PB  49 GLU      HG  50 SER     3.90 




     Aminoacid   50  SER

    1    HA  50 SER      PB  15 SER     4.90 
    2     H  50 SER     Hb3  49 GLU     4.00 
    3     H  50 SER      HA  49 GLU     3.00 
    4     H  50 SER      PG  49 GLU     5.90 
    5     H  50 SER      PB  50 SER     4.90 
    6    HA  50 SER      PB  50 SER     4.90 
    7    HA  50 SER       H  51 LEU     2.69 
    8    HA  50 SER       H  51 LEU    -2.19 
    9     H  50 SER       H  53 ASP     5.00 
   10     H  50 SER      PB  53 ASP     4.90 
   11    HG  50 SER      PB  53 ASP     4.90 
   12    HG  50 SER      PB  49 GLU     3.90 




     Aminoacid   51  LEU

    1    CG  51 LEU     HE2   8 PHE     7.20 
    2    CG  51 LEU     HD2   8 PHE     5.20 
    3    CG  51 LEU      PG  13 MET     7.10 
    4    CG  51 LEU      PB  13 MET     7.10 
    5    HA  51 LEU      CE  13 MET     3.47 
    6    HA  51 LEU      CE  13 MET    -2.76 
    7     H  51 LEU      HA  50 SER     2.69 
    8     H  51 LEU      HA  50 SER    -2.19 
    9    HA  51 LEU      CG  51 LEU     5.20 
   10     H  51 LEU     Hb3  51 LEU     2.74 
   11     H  51 LEU     Hb3  51 LEU    -2.24 
   12     H  51 LEU     Hb2  51 LEU     2.79 
   13     H  51 LEU     Hb2  51 LEU    -2.29 
   14     H  51 LEU      HG  51 LEU     3.59 
   15     H  51 LEU      HG  51 LEU    -3.09 
   16    CG  51 LEU      PG  55 GLN     7.10 
   17    HA  51 LEU      HG  51 LEU     5.00 
   18    HA  51 LEU     Hb3  51 LEU     5.00 
   19   Hb2  51 LEU      HA  51 LEU     2.56 
   20   Hb2  51 LEU      HA  51 LEU    -2.06 
   21   Hb3  51 LEU       H  52 ALA     3.00 
   22   Hb2  51 LEU       H  52 ALA     3.47 
   23   Hb2  51 LEU       H  52 ALA    -2.97 
   24     H  51 LEU       H  52 ALA     3.08 
   25     H  51 LEU       H  52 ALA    -2.58 
   26    HA  51 LEU       H  54 VAL     3.23 
   27    HA  51 LEU       H  54 VAL    -2.73 
   28    HG  51 LEU       H  55 GLN     4.00 
   29    HG  51 LEU       H  54 VAL     5.00 
   30    HG  51 LEU      PG  55 GLN     4.90 
   31    CG  51 LEU     Hb3  55 GLN     7.20 
   32    CG  51 LEU     Hb2  55 GLN     7.20 
   33    HA  51 LEU      HB  54 VAL     4.00 
   34    CG  51 LEU     NE2  55 GLN     8.30 
   35    HG  51 LEU     NE2  55 GLN     6.10 




     Aminoacid   52  ALA

    1     H  52 ALA     Hb3  51 LEU     3.00 
    2     H  52 ALA     Hb2  51 LEU     3.47 
    3     H  52 ALA     Hb2  51 LEU    -2.97 
    4     H  52 ALA       H  51 LEU     3.08 
    5     H  52 ALA       H  51 LEU    -2.58 
    6    CB  52 ALA       H  52 ALA     3.14 
    7    CB  52 ALA       H  52 ALA    -2.46 
    8    HA  52 ALA       H  53 ASP     5.00 
    9    CB  52 ALA       H  53 ASP     4.00 
   10    CB  52 ALA       H  53 ASP    -3.23 
   11     H  52 ALA       H  53 ASP     3.05 
   12     H  52 ALA       H  53 ASP    -2.55 
   13    HA  52 ALA       H  55 GLN     4.00 
   14    HA  52 ALA      PG  55 GLN     5.90 
   15    HA  52 ALA       H  56 ALA     5.00 
   16    HA  52 ALA     Hb2  55 GLN     4.00 




     Aminoacid   53  ASP

    1    PB  53 ASP     Hb3  49 GLU     4.90 
    2     H  53 ASP       H  50 SER     5.00 
    3    PB  53 ASP       H  50 SER     4.90 
    4    PB  53 ASP      HG  50 SER     4.90 
    5     H  53 ASP      HA  52 ALA     5.00 
    6     H  53 ASP      CB  52 ALA     4.00 
    7     H  53 ASP      CB  52 ALA    -3.23 
    8     H  53 ASP       H  52 ALA     3.05 
    9     H  53 ASP       H  52 ALA    -2.55 
   10     H  53 ASP      PB  53 ASP     3.90 
   11    HA  53 ASP      PB  53 ASP     3.90 
   12    PB  53 ASP       H  54 VAL     4.90 
   13    PB  53 ASP       H  56 ALA     5.90 
   14    HA  53 ASP       H  56 ALA     3.60 
   15    HA  53 ASP       H  56 ALA    -3.10 
   16    HA  53 ASP      CB  56 ALA     4.19 
   17    HA  53 ASP      CB  56 ALA    -3.51 
   18     H  53 ASP       H  55 GLN     5.00 




     Aminoacid   54  VAL

    1   CG1  54 VAL     HE2   8 PHE     4.00 
    2   CG2  54 VAL     HE2   8 PHE     5.00 
    3   CG1  54 VAL      HZ   8 PHE     6.00 
    4   CG2  54 VAL      HZ   8 PHE     6.00 
    5   CG1  54 VAL      CE  13 MET     5.00 
    6     H  54 VAL      HA  51 LEU     3.23 
    7     H  54 VAL      HA  51 LEU    -2.73 
    8     H  54 VAL      HG  51 LEU     5.00 
    9    HB  54 VAL      HA  51 LEU     4.00 
   10     H  54 VAL      PB  53 ASP     4.90 
   11    HA  54 VAL       H  55 GLN     3.66 
   12    HA  54 VAL       H  55 GLN    -3.16 
   13     H  54 VAL      HB  54 VAL     2.47 
   14     H  54 VAL      HB  54 VAL    -1.97 
   15     H  54 VAL     CG2  54 VAL     3.32 
   16     H  54 VAL     CG2  54 VAL    -2.68 
   17     H  54 VAL     CG1  54 VAL     5.00 
   18   CG2  54 VAL      HA  54 VAL     4.00 
   19   CG1  54 VAL      HA  54 VAL     4.00 
   20   CG1  54 VAL       H  55 GLN     5.00 
   21   CG2  54 VAL       H  55 GLN     6.00 
   22     H  54 VAL       H  55 GLN     2.62 
   23     H  54 VAL       H  55 GLN    -2.12 
   24    HB  54 VAL       H  55 GLN     3.00 
   25    HA  54 VAL       H  57 VAL     3.34 
   26    HA  54 VAL       H  57 VAL    -2.84 
   27    HA  54 VAL       H  56 ALA     5.00 
   28   CG1  54 VAL       H  56 ALA     6.00 
   29    HB  54 VAL       H  56 ALA     5.00 
   30    HA  54 VAL      CE  79 MET     3.71 
   31    HA  54 VAL      CE  79 MET    -3.01 




     Aminoacid   55  GLN

    1    PG  55 GLN      CG  51 LEU     7.10 
    2     H  55 GLN      HG  51 LEU     4.00 
    3    PG  55 GLN      HG  51 LEU     4.90 
    4   Hb3  55 GLN      CG  51 LEU     7.20 
    5   Hb2  55 GLN      CG  51 LEU     7.20 
    6   NE2  55 GLN      CG  51 LEU     8.30 
    7   NE2  55 GLN      HG  51 LEU     6.10 
    8     H  55 GLN      HA  52 ALA     4.00 
    9    PG  55 GLN      HA  52 ALA     5.90 
   10   Hb2  55 GLN      HA  52 ALA     4.00 
   11     H  55 GLN       H  53 ASP     5.00 
   12     H  55 GLN      HA  54 VAL     3.66 
   13     H  55 GLN      HA  54 VAL    -3.16 
   14     H  55 GLN     CG1  54 VAL     5.00 
   15     H  55 GLN     CG2  54 VAL     6.00 
   16     H  55 GLN       H  54 VAL     2.62 
   17     H  55 GLN       H  54 VAL    -2.12 
   18     H  55 GLN      HB  54 VAL     3.00 
   19     H  55 GLN     Hb3  55 GLN     5.00 
   20     H  55 GLN     Hb2  55 GLN     3.00 
   21     H  55 GLN      PG  55 GLN     3.90 
   22    PG  55 GLN     Hb2  55 GLN     4.00 
   23    HA  55 GLN      PG  55 GLN     3.90 
   24   Hb3  55 GLN      HA  55 GLN     2.59 
   25   Hb3  55 GLN      HA  55 GLN    -2.09 
   26    HA  55 GLN     Hb2  55 GLN     4.00 
   27    HA  55 GLN       H  56 ALA     3.30 
   28    HA  55 GLN       H  56 ALA    -2.80 
   29   Hb3  55 GLN       H  56 ALA     4.00 
   30   Hb2  55 GLN       H  56 ALA     2.95 
   31   Hb2  55 GLN       H  56 ALA    -2.45 
   32    HA  55 GLN       H  56 ALA     3.30 
   33    HA  55 GLN       H  56 ALA    -2.80 
   34     H  55 GLN       H  56 ALA     2.75 
   35     H  55 GLN       H  56 ALA    -2.25 
   36   Hb3  55 GLN       H  57 VAL     5.00 
   37    HA  55 GLN       H  57 VAL     3.46 
   38    HA  55 GLN       H  57 VAL    -2.96 
   39     H  55 GLN       H  57 VAL     4.48 
   40     H  55 GLN       H  57 VAL    -3.89 
   41    HA  55 GLN       H  58 CYS     5.00 
   42    PB  55 GLN      PG 117 PRO     5.80 
   43  HE22  55 GLN     CG1 116 VAL     5.00 
   44  HE21  55 GLN     CG1 116 VAL     5.00 
   45   NE2  55 GLN     Hb2  55 GLN     4.00 




     Aminoacid   56  ALA

    1     H  56 ALA      HA  52 ALA     5.00 
    2     H  56 ALA      PB  53 ASP     5.90 
    3     H  56 ALA      HA  53 ASP     3.60 
    4     H  56 ALA      HA  53 ASP    -3.10 
    5    CB  56 ALA      HA  53 ASP     4.19 
    6    CB  56 ALA      HA  53 ASP    -3.51 
    7     H  56 ALA      HA  54 VAL     5.00 
    8     H  56 ALA     CG1  54 VAL     6.00 
    9     H  56 ALA      HB  54 VAL     5.00 
   10     H  56 ALA      HA  55 GLN     3.30 
   11     H  56 ALA      HA  55 GLN    -2.80 
   12     H  56 ALA     Hb3  55 GLN     4.00 
   13     H  56 ALA     Hb2  55 GLN     2.95 
   14     H  56 ALA     Hb2  55 GLN    -2.45 
   15     H  56 ALA      HA  55 GLN     3.30 
   16     H  56 ALA      HA  55 GLN    -2.80 
   17     H  56 ALA       H  55 GLN     2.75 
   18     H  56 ALA       H  55 GLN    -2.25 
   19     H  56 ALA      CB  56 ALA     3.19 
   20     H  56 ALA      CB  56 ALA    -2.58 
   21    CB  56 ALA       H  57 VAL     4.05 
   22    CB  56 ALA       H  57 VAL    -3.42 
   23    CB  56 ALA     CG2  57 VAL     6.00 
   24    HA  56 ALA       H  57 VAL     4.00 
   25    CB  56 ALA      HA  57 VAL     6.00 
   26    HA  56 ALA       H  59 SER     4.14 
   27    HA  56 ALA       H  59 SER    -3.64 
   28    CB  56 ALA     NE2  60 GLN     6.10 




     Aminoacid   57  VAL

    1     H  57 VAL      HA  54 VAL     3.34 
    2     H  57 VAL      HA  54 VAL    -2.84 
    3     H  57 VAL     Hb3  55 GLN     5.00 
    4     H  57 VAL      HA  55 GLN     3.46 
    5     H  57 VAL      HA  55 GLN    -2.96 
    6     H  57 VAL       H  55 GLN     4.48 
    7     H  57 VAL       H  55 GLN    -3.89 
    8     H  57 VAL      CB  56 ALA     4.05 
    9     H  57 VAL      CB  56 ALA    -3.42 
   10   CG2  57 VAL      CB  56 ALA     6.00 
   11     H  57 VAL      HA  56 ALA     4.00 
   12    HA  57 VAL      CB  56 ALA     6.00 
   13    HA  57 VAL       H  58 CYS     3.97 
   14    HA  57 VAL       H  58 CYS    -3.47 
   15     H  57 VAL     CG2  57 VAL     4.00 
   16     H  57 VAL     CG1  57 VAL     5.00 
   17     H  57 VAL      HB  57 VAL     3.00 
   18    HA  57 VAL     CG2  57 VAL     4.00 
   19   CG1  57 VAL      HA  57 VAL     3.56 
   20   CG1  57 VAL      HA  57 VAL    -2.89 
   21   CG1  57 VAL       H  58 CYS     6.00 
   22    HB  57 VAL       H  58 CYS     4.00 
   23    HA  57 VAL       H  59 SER     3.63 
   24    HA  57 VAL       H  59 SER    -3.13 
   25   CG2  57 VAL      CE  79 MET     5.00 
   26    HB  57 VAL     CG2 108 VAL     3.67 
   27    HB  57 VAL     CG2 108 VAL    -2.98 
   28   CG2  57 VAL      PB  75 SER     4.90 
   29   CG1  57 VAL      PB  75 SER     5.90 
   30   CG2  57 VAL      HA  75 SER     5.00 
   31   CG1  57 VAL      HA  75 SER     6.00 
   32   CG1  57 VAL      HA  74 GLN     5.00 
   33    HA  57 VAL       H  60 GLN     5.00 
   34   CG2  57 VAL       H  60 GLN     6.00 
   35   CG1  57 VAL       H  60 GLN     6.00 
   36    HA  57 VAL      CE  79 MET     6.00 
   37    HA  57 VAL      PB  60 GLN     5.90 
   38     H  57 VAL     CG2 108 VAL     6.00 
   39     H  57 VAL     CG1 108 VAL     6.00 
   40    HA  57 VAL    HE21  60 GLN     5.00 
   41    HA  57 VAL    HE22  60 GLN     3.68 
   42    HA  57 VAL    HE22  60 GLN    -3.18 
   43   CG2  57 VAL     NE2  60 GLN     7.10 
   44   CG2  57 VAL       H 106 ILE     6.00 




     Aminoacid   58  CYS

    1     H  58 CYS      HA  55 GLN     5.00 
    2     H  58 CYS      HA  57 VAL     3.97 
    3     H  58 CYS      HA  57 VAL    -3.47 
    4     H  58 CYS     CG1  57 VAL     6.00 
    5     H  58 CYS      HB  57 VAL     4.00 
    6     H  58 CYS     Hb3  58 CYS     3.14 
    7     H  58 CYS     Hb3  58 CYS    -2.64 
    8     H  58 CYS     Hb2  58 CYS     2.83 
    9     H  58 CYS     Hb2  58 CYS    -2.33 
   10   Hb3  58 CYS      HA  58 CYS     2.74 
   11   Hb3  58 CYS      HA  58 CYS    -2.24 
   12   Hb2  58 CYS      HA  58 CYS     2.78 
   13   Hb2  58 CYS      HA  58 CYS    -2.28 
   14    HA  58 CYS       H  59 SER     4.00 
   15   Hb3  58 CYS       H  59 SER     5.00 
   16   Hb2  58 CYS       H  59 SER     5.00 
   17    HA  58 CYS       H  60 GLN     5.00 
   18    HA  58 CYS     Hb3  73 TYR     3.81 
   19    HA  58 CYS     Hb3  73 TYR    -2.86 
   20    HA  58 CYS     Hb2  73 TYR     2.79 
   21    HA  58 CYS     Hb2  73 TYR    -2.29 
   22    HA  58 CYS     CG2 108 VAL     6.00 
   23    HA  58 CYS     HD2  73 TYR     3.38 
   24    HA  58 CYS     HD2  73 TYR    -2.71 
   25    HA  58 CYS     HE2  73 TYR     4.87 
   26    HA  58 CYS     HE2  73 TYR    -3.53 
   27   Hb3  58 CYS     HD2 115 TYR     2.85 
   28   Hb3  58 CYS     HD2 115 TYR    -2.35 
   29   Hb2  58 CYS     HE2 115 TYR     4.00 




     Aminoacid   59  SER

    1     H  59 SER      HA  56 ALA     4.14 
    2     H  59 SER      HA  56 ALA    -3.64 
    3     H  59 SER      HA  57 VAL     3.63 
    4     H  59 SER      HA  57 VAL    -3.13 
    5     H  59 SER      HA  58 CYS     4.00 
    6     H  59 SER     Hb3  58 CYS     5.00 
    7     H  59 SER     Hb2  58 CYS     5.00 
    8     H  59 SER      PB  59 SER     5.90 
    9     H  59 SER      HA  59 SER     3.00 
   10    PB  59 SER      HA  59 SER     3.90 
   11     H  59 SER      PG  60 GLN     5.90 
   12    HA  59 SER       H  60 GLN     4.00 
   13     H  59 SER       H  60 GLN     3.00 




     Aminoacid   60  GLN

    1   NE2  60 GLN      CB  56 ALA     6.10 
    2     H  60 GLN      HA  57 VAL     5.00 
    3     H  60 GLN     CG2  57 VAL     6.00 
    4     H  60 GLN     CG1  57 VAL     6.00 
    5    PB  60 GLN      HA  57 VAL     5.90 
    6  HE21  60 GLN      HA  57 VAL     5.00 
    7  HE22  60 GLN      HA  57 VAL     3.68 
    8  HE22  60 GLN      HA  57 VAL    -3.18 
    9   NE2  60 GLN     CG2  57 VAL     7.10 
   10     H  60 GLN      HA  58 CYS     5.00 
   11    PG  60 GLN       H  59 SER     5.90 
   12     H  60 GLN      HA  59 SER     4.00 
   13     H  60 GLN       H  59 SER     3.00 
   14     H  60 GLN     Hb3  60 GLN     5.00 
   15     H  60 GLN     Hb2  60 GLN     3.02 
   16     H  60 GLN     Hb2  60 GLN    -2.52 
   17    PG  60 GLN      PB  60 GLN     5.80 
   18     H  60 GLN      PG  60 GLN     4.90 
   19    HA  60 GLN     Hb3  60 GLN     3.00 
   20    HA  60 GLN     Hb2  60 GLN     4.00 
   21    HA  60 GLN      PG  60 GLN     4.90 
   22   Hb3  60 GLN       H  61 LYS     3.00 
   23   Hb2  60 GLN       H  61 LYS     3.00 
   24     H  60 GLN       H  61 LYS     5.00 
   25    HA  60 GLN       H  61 LYS     5.00 
   26     H  60 GLN     HD1  73 TYR     5.00 
   27   Hb2  60 GLN     HD2  76 TYR     5.00 
   28    PG  60 GLN     HE2  76 TYR     5.00 
   29   NE2  60 GLN      PG  60 GLN     5.00 
   30    HA  60 GLN     HE2  76 TYR     3.06 
   31    HA  60 GLN     HE2  76 TYR    -2.56 
   32     H  60 GLN      CG  73 TYR     7.20 
   33    HA  60 GLN     HD2  76 TYR     5.00 




     Aminoacid   61  LYS

    1     H  61 LYS     Hb3  60 GLN     3.00 
    2     H  61 LYS     Hb2  60 GLN     3.00 
    3     H  61 LYS       H  60 GLN     5.00 
    4     H  61 LYS      HA  60 GLN     5.00 
    5     H  61 LYS      PB  61 LYS     3.90 
    6    PB  61 LYS      PG  61 LYS     5.80 
    7    PE  61 LYS      PD  61 LYS     5.80 
    8    HA  61 LYS      PB  61 LYS     3.90 
    9    HA  61 LYS      PD  61 LYS     5.90 
   10    PB  61 LYS       H  62 ASN     4.90 
   11    HA  61 LYS       H  62 ASN     3.00 
   12     H  61 LYS       H  62 ASN     5.00 
   13     H  61 LYS       H  74 GLN     3.60 
   14     H  61 LYS       H  74 GLN    -3.10 
   15    PB  61 LYS     HD1  76 TYR     4.90 
   16    PB  61 LYS     HE1  76 TYR     4.90 
   17    PG  61 LYS     HD1  76 TYR     5.90 




     Aminoacid   62  ASN

    1     H  62 ASN      PB  61 LYS     4.90 
    2     H  62 ASN      HA  61 LYS     3.00 
    3     H  62 ASN       H  61 LYS     5.00 
    4   ND2  62 ASN     Hb2  62 ASN     5.10 
    5   Hb3  62 ASN      HA  62 ASN     2.74 
    6   Hb3  62 ASN      HA  62 ASN    -2.24 
    7    HA  62 ASN     Hb2  62 ASN     2.71 
    8    HA  62 ASN     Hb2  62 ASN    -2.21 
    9     H  62 ASN     Hb3  62 ASN     2.69 
   10     H  62 ASN     Hb3  62 ASN    -2.19 
   11     H  62 ASN     Hb2  62 ASN     3.00 
   12  HD21  62 ASN      HA  62 ASN     2.47 
   13  HD21  62 ASN      HA  62 ASN    -1.97 
   14  HD22  62 ASN      HA  62 ASN     4.00 
   15   Hb3  62 ASN       H  63 VAL     5.00 
   16   Hb2  62 ASN       H  63 VAL     3.70 
   17   Hb2  62 ASN       H  63 VAL    -3.20 
   18    HA  62 ASN       H  63 VAL     2.47 
   19    HA  62 ASN       H  63 VAL    -1.98 
   20    HA  62 ASN     CG2  63 VAL     5.00 
   21    HA  62 ASN     CG1  63 VAL     6.00 
   22   Hb2  62 ASN       H  72 CYS     5.00 
   23    HA  62 ASN      HA  73 TYR     2.85 
   24    HA  62 ASN      HA  73 TYR    -2.35 
   25     H  62 ASN       H  74 GLN     5.00 
   26    HA  62 ASN       H  74 GLN     3.58 
   27    HA  62 ASN       H  74 GLN    -3.08 
   28  HD21  62 ASN       H  63 VAL     3.00 
   29  HD22  62 ASN       H  63 VAL     3.07 
   30  HD22  62 ASN       H  63 VAL    -2.57 
   31   Hb3  62 ASN     HD1  73 TYR     3.81 
   32   Hb3  62 ASN     HD1  73 TYR    -3.31 
   33   Hb2  62 ASN     HD1  73 TYR     3.00 
   34   Hb3  62 ASN     HE1  73 TYR     5.00 
   35   Hb2  62 ASN     HE1  73 TYR     4.00 
   36   ND2  62 ASN      HA  71 ASN     5.10 
   37   ND2  62 ASN       H  72 CYS     5.10 
   38     H  62 ASN     HE1  73 TYR     5.00 
   39   ND2  62 ASN       H  62 ASN     6.10 




     Aminoacid   63  VAL

    1     H  63 VAL     Hb3  62 ASN     5.00 
    2     H  63 VAL     Hb2  62 ASN     3.70 
    3     H  63 VAL     Hb2  62 ASN    -3.20 
    4     H  63 VAL      HA  62 ASN     2.47 
    5     H  63 VAL      HA  62 ASN    -1.98 
    6   CG2  63 VAL      HA  62 ASN     5.00 
    7   CG1  63 VAL      HA  62 ASN     6.00 
    8     H  63 VAL    HD21  62 ASN     3.00 
    9     H  63 VAL    HD22  62 ASN     3.07 
   10     H  63 VAL    HD22  62 ASN    -2.57 
   11     H  63 VAL     CG2  63 VAL     3.35 
   12     H  63 VAL     CG2  63 VAL    -2.60 
   13     H  63 VAL     CG1  63 VAL     5.28 
   14     H  63 VAL     CG1  63 VAL    -3.36 
   15    HA  63 VAL     CG2  63 VAL     5.00 
   16   CG1  63 VAL      HA  63 VAL     4.24 
   17   CG1  63 VAL      HA  63 VAL    -3.29 
   18   CG2  63 VAL       H  64 ALA     5.00 
   19   CG1  63 VAL       H  64 ALA     6.00 
   20    HB  63 VAL       H  64 ALA     2.37 
   21    HB  63 VAL       H  64 ALA    -1.87 
   22   CG2  63 VAL     Hb3  72 CYS     3.62 
   23   CG2  63 VAL     Hb3  72 CYS    -2.95 
   24   CG2  63 VAL     Hb2  72 CYS     3.82 
   25   CG2  63 VAL     Hb2  72 CYS    -3.18 
   26   CG2  63 VAL      PB  74 GLN     5.90 
   27   CG1  63 VAL      PB  74 GLN     4.90 
   28   CG2  63 VAL      CD 107 ILE     7.00 
   29   CG2  63 VAL       H  74 GLN     4.07 
   30   CG2  63 VAL       H  74 GLN    -3.28 
   31   CG1  63 VAL       H  74 GLN     4.47 
   32   CG1  63 VAL       H  74 GLN    -3.46 
   33   CG2  63 VAL       H  73 TYR     5.26 
   34   CG2  63 VAL       H  73 TYR    -3.22 
   35   CG1  63 VAL       H  73 TYR     5.18 
   36   CG1  63 VAL       H  73 TYR    -4.18 
   37   CG1  63 VAL       H  72 CYS     6.00 
   38     H  63 VAL      HA  73 TYR     3.00 
   39     H  63 VAL      HA  73 TYR    -2.50 
   40   CG2  63 VAL      HA  72 CYS     5.13 
   41   CG2  63 VAL      HA  72 CYS    -4.38 
   42   CG1  63 VAL      HA  74 GLN     5.00 
   43   CG2  63 VAL      HA  73 TYR     4.05 
   44   CG2  63 VAL      HA  73 TYR    -3.39 
   45   CG1  63 VAL      HA  73 TYR     5.00 
   46     H  63 VAL       H  74 GLN     5.00 
   47     H  63 VAL       H  72 CYS     4.00 
   48   CG1  63 VAL     Hb3  73 TYR     5.00 
   49   CG1  63 VAL     HD1  73 TYR     6.00 
   50   CG2  63 VAL     HD1  73 TYR     6.00 




     Aminoacid   64  ALA

    1     H  64 ALA     CG2  63 VAL     5.00 
    2     H  64 ALA     CG1  63 VAL     6.00 
    3     H  64 ALA      HB  63 VAL     2.37 
    4     H  64 ALA      HB  63 VAL    -1.87 
    5     H  64 ALA      CB  64 ALA     3.29 
    6     H  64 ALA      CB  64 ALA    -2.67 
    7    HA  64 ALA       H  72 CYS     5.00 
    8    CB  64 ALA      HA  64 ALA     3.42 
    9    CB  64 ALA      HA  64 ALA    -2.54 
   10    CB  64 ALA       H  65 CYS     4.07 
   11    CB  64 ALA       H  65 CYS    -3.39 
   12    HA  64 ALA       H  65 CYS     3.00 
   13    CB  64 ALA      HA  65 CYS     6.00 
   14    CB  64 ALA       H  68 GLY     4.86 
   15    CB  64 ALA       H  68 GLY    -3.86 
   16    HA  64 ALA      CG  70 THR     6.62 
   17    HA  64 ALA      CG  70 THR    -5.64 
   18    CB  64 ALA      HA  70 THR     6.00 
   19    HA  64 ALA      HA  70 THR     3.00 
   20    CB  64 ALA      PA  68 GLY     6.90 
   21    HA  64 ALA      HB  70 THR     5.00 




     Aminoacid   65  CYS

    1     H  65 CYS      CB  64 ALA     4.07 
    2     H  65 CYS      CB  64 ALA    -3.39 
    3     H  65 CYS      HA  64 ALA     3.00 
    4    HA  65 CYS      CB  64 ALA     6.00 
    5     H  65 CYS     Hb3  65 CYS     4.00 
    6     H  65 CYS     Hb2  65 CYS     3.43 
    7     H  65 CYS     Hb2  65 CYS    -2.64 
    8     H  65 CYS       H  69 GLN     5.00 
    9    HA  65 CYS     Hb3  65 CYS     4.00 
   10    HA  65 CYS     Hb2  65 CYS     4.00 
   11    HA  65 CYS       H  66 LYS     2.62 
   12    HA  65 CYS       H  66 LYS    -2.12 
   13     H  65 CYS       H  68 GLY     3.97 
   14     H  65 CYS       H  68 GLY    -3.47 
   15   Hb3  65 CYS       H  69 GLN     3.62 
   16   Hb3  65 CYS       H  69 GLN    -2.85 
   17   Hb2  65 CYS       H  69 GLN     2.92 
   18   Hb2  65 CYS       H  69 GLN    -2.42 
   19   Hb3  65 CYS       H  66 LYS     3.00 
   20   Hb2  65 CYS       H  66 LYS     5.00 
   21    PB  65 CYS       H  67 ASN     3.90 




     Aminoacid   66  LYS

    1     H  66 LYS      HA  65 CYS     2.62 
    2     H  66 LYS      HA  65 CYS    -2.12 
    3     H  66 LYS     Hb3  65 CYS     3.00 
    4     H  66 LYS     Hb2  65 CYS     5.00 
    5    HA  66 LYS      PB  66 LYS     3.90 
    6    HA  66 LYS      PG  66 LYS     3.90 
    7     H  66 LYS      PB  66 LYS     3.90 
    8     H  66 LYS      PG  66 LYS     3.90 
    9    PB  66 LYS       H  67 ASN     4.90 
   10    PG  66 LYS       H  67 ASN     5.90 
   11     H  66 LYS       H  67 ASN     3.33 
   12     H  66 LYS       H  67 ASN    -2.83 




     Aminoacid   67  ASN

    1     H  67 ASN      PB  65 CYS     3.90 
    2     H  67 ASN      PB  66 LYS     4.90 
    3     H  67 ASN      PG  66 LYS     5.90 
    4     H  67 ASN       H  66 LYS     3.33 
    5     H  67 ASN       H  66 LYS    -2.83 
    6     H  67 ASN     Hb3  67 ASN     2.73 
    7     H  67 ASN     Hb3  67 ASN    -2.23 
    8     H  67 ASN     Hb2  67 ASN     4.00 
    9    HA  67 ASN     Hb3  67 ASN     3.00 
   10    HA  67 ASN     Hb2  67 ASN     3.00 
   11   Hb3  67 ASN       H  68 GLY     5.00 
   12   Hb2  67 ASN       H  68 GLY     4.00 
   13  HD21  67 ASN     Hb3  67 ASN     3.00 
   14  HD21  67 ASN     Hb2  67 ASN     2.83 
   15  HD21  67 ASN     Hb2  67 ASN    -2.33 
   16  HD22  67 ASN     Hb3  67 ASN     3.00 
   17  HD22  67 ASN     Hb2  67 ASN     4.00 
   18   ND2  67 ASN      PB  69 GLN     6.00 




     Aminoacid   68  GLY

    1     H  68 GLY      CB  64 ALA     4.86 
    2     H  68 GLY      CB  64 ALA    -3.86 
    3    PA  68 GLY      CB  64 ALA     6.90 
    4     H  68 GLY       H  65 CYS     3.97 
    5     H  68 GLY       H  65 CYS    -3.47 
    6     H  68 GLY     Hb3  67 ASN     5.00 
    7     H  68 GLY     Hb2  67 ASN     4.00 
    8     H  68 GLY       H  69 GLN     4.00 




     Aminoacid   69  GLN

    1     H  69 GLN       H  65 CYS     5.00 
    2     H  69 GLN     Hb3  65 CYS     3.62 
    3     H  69 GLN     Hb3  65 CYS    -2.85 
    4     H  69 GLN     Hb2  65 CYS     2.92 
    5     H  69 GLN     Hb2  65 CYS    -2.42 
    6    PB  69 GLN     ND2  67 ASN     6.00 
    7     H  69 GLN       H  68 GLY     4.00 
    8     H  69 GLN      PB  69 GLN     3.90 
    9     H  69 GLN      PG  69 GLN     3.90 
   10    HA  69 GLN      PB  69 GLN     3.90 
   11    PB  69 GLN       H  70 THR     3.90 
   12    PG  69 GLN       H  70 THR     3.90 
   13    HA  69 GLN       H  70 THR     2.71 
   14    HA  69 GLN       H  70 THR    -2.21 
   15    HA  69 GLN      CG  70 THR     5.00 
   16     H  69 GLN       H  70 THR     5.00 
   17    PB  69 GLN       H  71 ASN     4.90 
   18   NE2  69 GLN      PG  69 GLN     6.00 




     Aminoacid   70  THR

    1    CG  70 THR      HA  64 ALA     6.62 
    2    CG  70 THR      HA  64 ALA    -5.64 
    3    HA  70 THR      CB  64 ALA     6.00 
    4    HA  70 THR      HA  64 ALA     3.00 
    5    HB  70 THR      HA  64 ALA     5.00 
    6     H  70 THR      PB  69 GLN     3.90 
    7     H  70 THR      PG  69 GLN     3.90 
    8     H  70 THR      HA  69 GLN     2.71 
    9     H  70 THR      HA  69 GLN    -2.21 
   10    CG  70 THR      HA  69 GLN     5.00 
   11     H  70 THR       H  69 GLN     5.00 
   12     H  70 THR      CG  70 THR     4.02 
   13     H  70 THR      CG  70 THR    -3.34 
   14    CG  70 THR      HA  70 THR     4.00 
   15    HA  70 THR      HB  70 THR     3.00 
   16    HA  70 THR       H  72 CYS     4.00 
   17     H  70 THR       H  71 ASN     3.09 
   18     H  70 THR       H  71 ASN    -2.59 




     Aminoacid   71  ASN

    1    HA  71 ASN     ND2  62 ASN     5.10 
    2     H  71 ASN      PB  69 GLN     4.90 
    3     H  71 ASN       H  70 THR     3.09 
    4     H  71 ASN       H  70 THR    -2.59 
    5     H  71 ASN     Hb3  71 ASN     2.99 
    6     H  71 ASN     Hb3  71 ASN    -2.49 
    7     H  71 ASN     Hb2  71 ASN     5.00 
    8    HA  71 ASN     Hb3  71 ASN     3.00 
    9    HA  71 ASN     Hb2  71 ASN     3.00 
   10    HA  71 ASN       H  72 CYS     3.12 
   11    HA  71 ASN       H  72 CYS    -2.62 
   12     H  71 ASN       H  72 CYS     3.24 
   13     H  71 ASN       H  72 CYS    -2.74 
   14   Hb2  71 ASN       H 110 CYS     5.00 
   15  HD21  71 ASN      PB  71 ASN     3.90 
   16  HD22  71 ASN      PB  71 ASN     3.90 
   17   ND2  71 ASN      CB 109 ALA     6.00 
   18   Hb2  71 ASN     HE2  73 TYR     5.00 
   19  HD21  71 ASN       H 110 CYS     4.08 
   20  HD21  71 ASN       H 110 CYS    -3.58 
   21  HD22  71 ASN       H 110 CYS     3.75 
   22  HD22  71 ASN       H 110 CYS    -3.25 
   23    HA  71 ASN      CG  73 TYR     6.10 




     Aminoacid   72  CYS

    1     H  72 CYS     Hb2  62 ASN     5.00 
    2     H  72 CYS     ND2  62 ASN     5.10 
    3   Hb3  72 CYS     CG2  63 VAL     3.62 
    4   Hb3  72 CYS     CG2  63 VAL    -2.95 
    5   Hb2  72 CYS     CG2  63 VAL     3.82 
    6   Hb2  72 CYS     CG2  63 VAL    -3.18 
    7     H  72 CYS     CG1  63 VAL     6.00 
    8    HA  72 CYS     CG2  63 VAL     5.13 
    9    HA  72 CYS     CG2  63 VAL    -4.38 
   10     H  72 CYS       H  63 VAL     4.00 
   11     H  72 CYS      HA  64 ALA     5.00 
   12     H  72 CYS      HA  70 THR     4.00 
   13     H  72 CYS      HA  71 ASN     3.12 
   14     H  72 CYS      HA  71 ASN    -2.62 
   15     H  72 CYS       H  71 ASN     3.24 
   16     H  72 CYS       H  71 ASN    -2.74 
   17     H  72 CYS     Hb3  72 CYS     3.34 
   18     H  72 CYS     Hb3  72 CYS    -2.29 
   19     H  72 CYS     Hb2  72 CYS     3.00 
   20    HA  72 CYS     Hb3  72 CYS     2.76 
   21    HA  72 CYS     Hb3  72 CYS    -2.26 
   22    HA  72 CYS     Hb2  72 CYS     5.00 
   23    HA  72 CYS       H  73 TYR     2.46 
   24    HA  72 CYS       H  73 TYR    -1.96 
   25   Hb3  72 CYS       H  73 TYR     3.00 
   26   Hb2  72 CYS       H  73 TYR     5.00 
   27    HA  72 CYS       H 110 CYS     3.42 
   28    HA  72 CYS       H 110 CYS    -2.84 
   29     H  72 CYS     CG2 107 ILE     6.00 
   30     H  72 CYS      HA 109 ALA     5.00 
   31    HA  72 CYS      CB 109 ALA     4.47 
   32    HA  72 CYS      CB 109 ALA    -3.58 
   33    HA  72 CYS      HA 109 ALA     2.49 
   34    HA  72 CYS      HA 109 ALA    -1.99 
   35   Hb3  72 CYS     CG2 107 ILE     2.63 
   36   Hb3  72 CYS     CG2 107 ILE    -1.98 
   37   Hb2  72 CYS     CG2 107 ILE     5.00 
   38    HA  72 CYS     HD2  73 TYR     4.00 




     Aminoacid   73  TYR

    1   Hb3  73 TYR      HA  58 CYS     3.81 
    2   Hb3  73 TYR      HA  58 CYS    -2.86 
    3   Hb2  73 TYR      HA  58 CYS     2.79 
    4   Hb2  73 TYR      HA  58 CYS    -2.29 
    5   HD2  73 TYR      HA  58 CYS     3.38 
    6   HD2  73 TYR      HA  58 CYS    -2.71 
    7   HE2  73 TYR      HA  58 CYS     4.87 
    8   HE2  73 TYR      HA  58 CYS    -3.53 
    9   HD1  73 TYR       H  60 GLN     5.00 
   10    CG  73 TYR       H  60 GLN     7.20 
   11    HA  73 TYR      HA  62 ASN     2.85 
   12    HA  73 TYR      HA  62 ASN    -2.35 
   13   HD1  73 TYR     Hb3  62 ASN     3.81 
   14   HD1  73 TYR     Hb3  62 ASN    -3.31 
   15   HD1  73 TYR     Hb2  62 ASN     3.00 
   16   HE1  73 TYR     Hb3  62 ASN     5.00 
   17   HE1  73 TYR     Hb2  62 ASN     4.00 
   18   HE1  73 TYR       H  62 ASN     5.00 
   19     H  73 TYR     CG2  63 VAL     5.26 
   20     H  73 TYR     CG2  63 VAL    -3.22 
   21     H  73 TYR     CG1  63 VAL     5.18 
   22     H  73 TYR     CG1  63 VAL    -4.18 
   23    HA  73 TYR       H  63 VAL     3.00 
   24    HA  73 TYR       H  63 VAL    -2.50 
   25    HA  73 TYR     CG2  63 VAL     4.05 
   26    HA  73 TYR     CG2  63 VAL    -3.39 
   27    HA  73 TYR     CG1  63 VAL     5.00 
   28   Hb3  73 TYR     CG1  63 VAL     5.00 
   29   HD1  73 TYR     CG1  63 VAL     6.00 
   30   HD1  73 TYR     CG2  63 VAL     6.00 
   31   HE2  73 TYR     Hb2  71 ASN     5.00 
   32    CG  73 TYR      HA  71 ASN     6.10 
   33     H  73 TYR      HA  72 CYS     2.46 
   34     H  73 TYR      HA  72 CYS    -1.96 
   35     H  73 TYR     Hb3  72 CYS     3.00 
   36     H  73 TYR     Hb2  72 CYS     5.00 
   37   HD2  73 TYR      HA  72 CYS     4.00 
   38     H  73 TYR     Hb3  73 TYR     4.00 
   39   Hb2  73 TYR       H  73 TYR     3.29 
   40   Hb2  73 TYR       H  73 TYR    -2.76 
   41    HA  73 TYR     Hb3  73 TYR     2.87 
   42    HA  73 TYR     Hb3  73 TYR    -2.37 
   43    HA  73 TYR     Hb2  73 TYR     3.32 
   44    HA  73 TYR     Hb2  73 TYR    -2.82 
   45   Hb3  73 TYR       H  74 GLN     3.24 
   46   Hb3  73 TYR       H  74 GLN    -2.74 
   47     H  73 TYR     CG2 107 ILE     5.00 
   48     H  73 TYR      CB 109 ALA     6.00 
   49    HA  73 TYR       H  74 GLN     2.42 
   50    HA  73 TYR       H  74 GLN    -1.92 
   51    PB  73 TYR     CG2 108 VAL     6.90 
   52    CG  73 TYR      PB  73 TYR     6.00 
   53    HA  73 TYR     HD1  73 TYR     3.53 
   54    HA  73 TYR     HD1  73 TYR    -2.08 
   55   HD2  73 TYR     CG2 108 VAL     6.00 
   56   HD2  73 TYR      HA 109 ALA     5.00 
   57   HD2  73 TYR       H 110 CYS     3.98 
   58   HD2  73 TYR       H 110 CYS    -3.26 
   59     H  73 TYR     HD2  73 TYR     3.06 
   60     H  73 TYR     HD2  73 TYR    -2.56 
   61   HD2  73 TYR     Hb3 110 CYS     3.44 
   62   HD2  73 TYR     Hb3 110 CYS    -2.67 
   63   HE2  73 TYR     Hb3 110 CYS     4.00 




     Aminoacid   74  GLN

    1    HA  74 GLN     CG1  57 VAL     5.00 
    2     H  74 GLN       H  61 LYS     3.60 
    3     H  74 GLN       H  61 LYS    -3.10 
    4     H  74 GLN       H  62 ASN     5.00 
    5     H  74 GLN      HA  62 ASN     3.58 
    6     H  74 GLN      HA  62 ASN    -3.08 
    7    PB  74 GLN     CG2  63 VAL     5.90 
    8    PB  74 GLN     CG1  63 VAL     4.90 
    9     H  74 GLN     CG2  63 VAL     4.07 
   10     H  74 GLN     CG2  63 VAL    -3.28 
   11     H  74 GLN     CG1  63 VAL     4.47 
   12     H  74 GLN     CG1  63 VAL    -3.46 
   13    HA  74 GLN     CG1  63 VAL     5.00 
   14     H  74 GLN       H  63 VAL     5.00 
   15     H  74 GLN     Hb3  73 TYR     3.24 
   16     H  74 GLN     Hb3  73 TYR    -2.74 
   17     H  74 GLN      HA  73 TYR     2.42 
   18     H  74 GLN      HA  73 TYR    -1.92 
   19     H  74 GLN      PB  74 GLN     3.90 
   20     H  74 GLN      PG  74 GLN     5.90 
   21    HA  74 GLN      PG  74 GLN     5.90 
   22    PG  74 GLN      PB  74 GLN     5.80 
   23    HA  74 GLN      PB  74 GLN     5.90 
   24    PG  74 GLN       H  75 SER     4.90 
   25    PB  74 GLN       H  75 SER     4.90 
   26     H  74 GLN       H  75 SER     5.00 
   27    HA  74 GLN       H  75 SER     2.60 
   28    HA  74 GLN       H  75 SER    -2.10 
   29    PG  74 GLN      HG  75 SER     5.90 
   30    HA  74 GLN      CD 107 ILE     5.00 
   31    HA  74 GLN       H 108 VAL     4.00 
   32    HA  74 GLN     PG1 107 ILE     4.90 
   33    PB  74 GLN      PB 105 HIS     6.80 
   34    PG  74 GLN      PB 105 HIS     6.80 
   35    PG  74 GLN       H 106 ILE     5.90 
   36   NE2  74 GLN      PG  74 GLN     6.00 
   37    PG  74 GLN     HD2 105 HIS     5.90    (Second set)  
   38   NE2  74 GLN      PB  74 GLN     7.00 
   39  HE21  74 GLN      CB 124 VAL     6.20 
   40  HE22  74 GLN      CB 124 VAL     6.20 




     Aminoacid   75  SER

    1    PB  75 SER     CG2  57 VAL     4.90 
    2    PB  75 SER     CG1  57 VAL     5.90 
    3    HA  75 SER     CG2  57 VAL     5.00 
    4    HA  75 SER     CG1  57 VAL     6.00 
    5     H  75 SER      PG  74 GLN     4.90 
    6     H  75 SER      PB  74 GLN     4.90 
    7     H  75 SER       H  74 GLN     5.00 
    8     H  75 SER      HA  74 GLN     2.60 
    9     H  75 SER      HA  74 GLN    -2.10 
   10    HG  75 SER      PG  74 GLN     5.90 
   11     H  75 SER      PB  75 SER     5.90 
   12    HA  75 SER      HG  75 SER     5.00 
   13    PB  75 SER      HG  75 SER     5.90 
   14    HA  75 SER      PB  75 SER     3.90 
   15    HG  75 SER      HA 105 HIS     3.97 
   16    HG  75 SER      HA 105 HIS    -3.47 
   17    HG  75 SER     HD2 105 HIS     5.00   (Second set)  
   18    HG  75 SER      PG  79 MET     5.90 
   19    HG  75 SER      PB 105 HIS     5.90 
   20    HG  75 SER      PB  79 MET     5.90 
   21    HG  75 SER     PG1 106 ILE     5.90 
   22     H  75 SER      PB 105 HIS     5.90 
   23     H  75 SER     PG1 106 ILE     5.90 
   24     H  75 SER       H 106 ILE     3.44 
   25     H  75 SER       H 106 ILE    -2.94 
   26    HG  75 SER       H 106 ILE     3.20 
   27    HG  75 SER       H 106 ILE    -2.70 
   28    PB  75 SER       H 106 ILE     5.90 
   29    PB  75 SER     PG1 106 ILE     6.80 




     Aminoacid   76  TYR

    1   HD2  76 TYR     Hb2  60 GLN     5.00 
    2   HE2  76 TYR      PG  60 GLN     5.00 
    3   HE2  76 TYR      HA  60 GLN     3.06 
    4   HE2  76 TYR      HA  60 GLN    -2.56 
    5   HD2  76 TYR      HA  60 GLN     5.00 
    6   HD1  76 TYR      PB  61 LYS     4.90 
    7   HE1  76 TYR      PB  61 LYS     4.90 
    8   HD1  76 TYR      PG  61 LYS     5.90 
    9     H  76 TYR     Hb3  76 TYR     3.70 
   10     H  76 TYR     Hb3  76 TYR    -3.20 
   11     H  76 TYR     Hb2  76 TYR     3.19 
   12     H  76 TYR     Hb2  76 TYR    -2.69 
   13   Hb3  76 TYR       H  77 SER     3.96 
   14   Hb3  76 TYR       H  77 SER    -3.23 
   15   Hb2  76 TYR       H  77 SER     3.28 
   16   Hb2  76 TYR       H  77 SER    -2.78 
   17     H  76 TYR       H  77 SER     4.00 
   18    CG  76 TYR      PB  76 TYR     6.00 
   19   HD1  76 TYR      HA  76 TYR     3.00 
   20    CG  76 TYR       H  76 TYR     7.10 
   21    CG  76 TYR       H  77 SER     7.10 
   22    CZ  76 TYR       H  76 TYR     7.10 




     Aminoacid   77  SER

    1     H  77 SER     Hb3  76 TYR     3.96 
    2     H  77 SER     Hb3  76 TYR    -3.23 
    3     H  77 SER     Hb2  76 TYR     3.28 
    4     H  77 SER     Hb2  76 TYR    -2.78 
    5     H  77 SER       H  76 TYR     4.00 
    6     H  77 SER      CG  76 TYR     7.10 
    7     H  77 SER      PB  77 SER     3.90 
    8    HA  77 SER      PB  77 SER     3.90 
    9    HA  77 SER       H  78 THR     2.76 
   10    HA  77 SER       H  78 THR    -2.26 
   11    PB  77 SER       H  78 THR     4.90 
   12     H  77 SER       H  78 THR     5.00 
   13     H  77 SER     HE1 105 HIS     5.00 
   14    HA  77 SER     HD2 105 HIS     3.00    (Second set)  
   15    HA  77 SER     HE1 105 HIS     4.00 
   16    PB  77 SER     HE1 105 HIS     5.90 




     Aminoacid   78  THR

    1     H  78 THR      HA  77 SER     2.76 
    2     H  78 THR      HA  77 SER    -2.26 
    3     H  78 THR      PB  77 SER     4.90 
    4     H  78 THR       H  77 SER     5.00 
    5     H  78 THR      HB  78 THR     5.00 
    6    CG  78 THR       H  79 MET     6.00 
    7    HB  78 THR       H  79 MET     3.01 
    8    HB  78 THR       H  79 MET    -2.51 
    9    HA  78 THR       H  79 MET     2.45 
   10    HA  78 THR       H  79 MET    -1.95 
   11    HB  78 THR       H 104 LYS     3.25 
   12    HB  78 THR       H 104 LYS    -2.75 
   13    HA  78 THR       H 104 LYS     4.21 
   14    HA  78 THR       H 104 LYS    -3.71 
   15    CG  78 THR       H 104 LYS     4.91 
   16    CG  78 THR       H 104 LYS    -4.11 
   17    CG  78 THR      HA 103 ASN     5.97 
   18    CG  78 THR      HA 103 ASN    -4.28 
   19    HA  78 THR      HA 105 HIS     3.00 
   20    HA  78 THR       H 106 ILE     5.00 
   21    CG  78 THR      PB 103 ASN     6.90 
   22    CG  78 THR      HA 104 LYS     4.85 
   23    CG  78 THR      HA 104 LYS    -4.16 
   24    HB  78 THR      HA 104 LYS     3.00 
   25    HB  78 THR      HA 103 ASN     5.00 
   26    HB  78 THR      PB 103 ASN     4.90 
   27    CG  78 THR       H 105 HIS     4.61 
   28    CG  78 THR       H 105 HIS    -3.97 
   29     H  78 THR      CG  78 THR     3.68 
   30     H  78 THR      CG  78 THR    -3.04 
   31    CG  78 THR      HA  78 THR     3.49 
   32    CG  78 THR      HA  78 THR    -2.88 
   33    CG  78 THR     HD2 105 HIS     4.27 
   34    CG  78 THR     HD2 105 HIS    -3.56 
   35    HA  78 THR     HD2 105 HIS     4.03 
   36    HA  78 THR     HD2 105 HIS    -3.53 




     Aminoacid   79  MET

    1   Hb3  79 MET      PG  49 GLU     5.90 
    2    CE  79 MET      HA  54 VAL     3.71 
    3    CE  79 MET      HA  54 VAL    -3.01 
    4    CE  79 MET     CG2  57 VAL     5.00 
    5    CE  79 MET      HA  57 VAL     6.00 
    6    PG  79 MET      HG  75 SER     5.90 
    7    PB  79 MET      HG  75 SER     5.90 
    8     H  79 MET      CG  78 THR     6.00 
    9     H  79 MET      HB  78 THR     3.01 
   10     H  79 MET      HB  78 THR    -2.51 
   11     H  79 MET      HA  78 THR     2.45 
   12     H  79 MET      HA  78 THR    -1.95 
   13     H  79 MET     Hb3  79 MET     4.00 
   14     H  79 MET     Hb2  79 MET     4.00 
   15     H  79 MET      PG  79 MET     5.90 
   16    PG  79 MET      CE  79 MET     5.90 
   17    HA  79 MET     Hb3  79 MET     4.00 
   18    HA  79 MET     Hb2  79 MET     5.00 
   19    HA  79 MET      PG  79 MET     3.90 
   20     H  79 MET      HA 103 ASN     3.81 
   21     H  79 MET      HA 103 ASN    -3.23 
   22     H  79 MET       H 104 LYS     4.00 
   23     H  79 MET      HA 105 HIS     5.00 




     Aminoacid   80  SER

    1    PB  80 SER     Hb3  48 HIS     5.90 
    2    PB  80 SER     Hb2  48 HIS     3.90 
    3    PB  80 SER       H  48 HIS     5.90 
    4    PB  80 SER     HD2  48 HIS     4.90 
    5    HA  80 SER      PB  80 SER     3.90 
    6    HA  80 SER       H  81 ILE     3.15 
    7    HA  80 SER       H  81 ILE    -2.65 
    8    PB  80 SER       H  81 ILE     5.90 
    9    HA  80 SER      HA 103 ASN     3.18 
   10    HA  80 SER      HA 103 ASN    -2.68 
   11    HA  80 SER       H 102 ALA     5.00 




     Aminoacid   81  ILE

    1    HA  81 ILE      CG  45 THR     4.64 
    2    HA  81 ILE      CG  45 THR    -3.53 
    3    HB  81 ILE      CG  45 THR     3.35 
    4    HB  81 ILE      CG  45 THR    -2.65 
    5   CG2  81 ILE      HA  47 VAL     4.04 
    6   CG2  81 ILE      HA  47 VAL    -3.26 
    7    HA  81 ILE      HA  47 VAL     2.72 
    8    HA  81 ILE      HA  47 VAL    -2.22 
    9    HA  81 ILE     CG1  47 VAL     5.59 
   10    HA  81 ILE     CG1  47 VAL    -4.77 
   11     H  81 ILE      HA  47 VAL     5.00 
   12   CG2  81 ILE       H  48 HIS     4.82 
   13   CG2  81 ILE       H  48 HIS    -3.90 
   14    HA  81 ILE       H  48 HIS     3.68 
   15    HA  81 ILE       H  48 HIS    -3.18 
   16    HA  81 ILE     HD2  48 HIS     2.98 
   17    HA  81 ILE     HD2  48 HIS    -2.48 
   18     H  81 ILE      HA  80 SER     3.15 
   19     H  81 ILE      HA  80 SER    -2.65 
   20     H  81 ILE      PB  80 SER     5.90 
   21     H  81 ILE     PG1  81 ILE     4.90 
   22     H  81 ILE      HB  81 ILE     3.14 
   23     H  81 ILE      HB  81 ILE    -2.64 
   24     H  81 ILE     CG2  81 ILE     4.65 
   25     H  81 ILE     CG2  81 ILE    -3.67 
   26    HA  81 ILE     PG1  81 ILE     5.90 
   27    HA  81 ILE     CG2  81 ILE     3.40 
   28    HA  81 ILE     CG2  81 ILE    -2.78 
   29    HA  81 ILE      HB  81 ILE     2.59 
   30    HA  81 ILE      HB  81 ILE    -2.09 
   31    CD  81 ILE      HB  81 ILE     3.65 
   32    CD  81 ILE      HB  81 ILE    -3.01 
   33    HB  81 ILE       H  82 THR     2.68 
   34    HB  81 ILE       H  82 THR    -2.18 
   35   CG2  81 ILE       H  82 THR     5.00 
   36    HA  81 ILE       H  82 THR     2.50 
   37    HA  81 ILE       H  82 THR    -2.00 
   38     H  81 ILE      HA 103 ASN     3.24 
   39     H  81 ILE      HA 103 ASN    -2.74 
   40    CD  81 ILE      HA 103 ASN     6.00 
   41   PG1  81 ILE       H 102 ALA     5.90 
   42   CG2  81 ILE      HA 103 ASN     6.00 
   43   CG2  81 ILE       H 102 ALA     6.00 
   44   CG2  81 ILE       H 104 LYS     6.00 
   45     H  81 ILE       H 102 ALA     5.00 
   46     H  81 ILE     NE2 101 GLN     6.10 
   47    CD  81 ILE      CZ 120 PHE     8.10 




     Aminoacid   82  THR

    1    CG  82 THR      HA  20 ALA     6.00 
    2    HA  82 THR      CB  20 ALA     6.00 
    3    CG  82 THR     HD2  25 TYR     3.38 
    4    CG  82 THR     HD2  25 TYR    -2.74 
    5    CG  82 THR     HE2  25 TYR     3.82 
    6    CG  82 THR     HE2  25 TYR    -2.99 
    7    HB  82 THR     HE2  25 TYR     2.86 
    8    HB  82 THR     HE2  25 TYR    -2.36 
    9     H  82 THR      CG  45 THR     4.42 
   10     H  82 THR      CG  45 THR    -3.77 
   11     H  82 THR       H  46 PHE     3.71 
   12     H  82 THR       H  46 PHE    -3.21 
   13     H  82 THR     Hb3  46 PHE     5.00 
   14    HB  82 THR     Hb3  46 PHE     4.29 
   15    HB  82 THR     Hb3  46 PHE    -3.76 
   16    HB  82 THR     Hb2  46 PHE     3.03 
   17    HB  82 THR     Hb2  46 PHE    -2.53 
   18    HB  82 THR       H  46 PHE     3.98 
   19    HB  82 THR       H  46 PHE    -3.48 
   20    HB  82 THR     HD2  46 PHE     3.36 
   21    HB  82 THR     HD2  46 PHE    -2.25 
   22    CG  82 THR      PB  46 PHE     6.90 
   23     H  82 THR     CG2  47 VAL     6.00 
   24     H  82 THR      HA  47 VAL     4.84 
   25    CG  82 THR     HD2  48 HIS     4.70 
   26    CG  82 THR     HD2  48 HIS    -3.99 
   27     H  82 THR     HD2  48 HIS     3.69 
   28     H  82 THR     HD2  48 HIS    -3.19 
   29    HB  82 THR     HD2  48 HIS     5.00 
   30    HB  82 THR     HE1  48 HIS     5.00 
   31     H  82 THR      HB  81 ILE     2.68 
   32     H  82 THR      HB  81 ILE    -2.18 
   33     H  82 THR     CG2  81 ILE     5.00 
   34     H  82 THR      HA  81 ILE     2.50 
   35     H  82 THR      HA  81 ILE    -2.00 
   36     H  82 THR      CG  82 THR     4.57 
   37     H  82 THR      CG  82 THR    -3.69 
   38     H  82 THR      HB  82 THR     3.03 
   39     H  82 THR      HB  82 THR    -2.53 
   40    HA  82 THR      CG  82 THR     3.47 
   41    HA  82 THR      CG  82 THR    -2.85 
   42    HB  82 THR      HA  82 THR     2.92 
   43    HB  82 THR      HA  82 THR    -2.42 
   44    CG  82 THR       H 100 THR     4.00 
   45    CG  82 THR       H  83 ASP     3.96 
   46    CG  82 THR       H  83 ASP    -3.27 
   47    HA  82 THR       H 102 ALA     5.00 
   48    HA  82 THR       H  83 ASP     3.00 
   49    CG  82 THR      HA 101 GLN     4.19 
   50    CG  82 THR      HA 101 GLN    -3.34 
   51    HA  82 THR      HA 101 GLN     2.95 
   52    HA  82 THR      HA 101 GLN    -2.45 
   53    HA  82 THR      PB 101 GLN     5.90 




     Aminoacid   83  ASP

    1    PB  83 ASP      HA  45 THR     4.90 
    2     H  83 ASP      CG  82 THR     3.96 
    3     H  83 ASP      CG  82 THR    -3.27 
    4     H  83 ASP      HA  82 THR     3.00 
    5     H  83 ASP      PB  83 ASP     3.90 
    6    HA  83 ASP      PB  83 ASP     3.90 
    7    HA  83 ASP       H  84 CYS     2.47 
    8    HA  83 ASP       H  84 CYS    -1.97 
    9    PB  83 ASP       H  84 CYS     4.90 
   10     H  83 ASP       H 100 THR     3.61 
   11     H  83 ASP       H 100 THR    -3.11 
   12    PB  83 ASP      HA  99 THR     5.90 
   13    PB  83 ASP      CG 100 THR     6.90 
   14    PB  83 ASP      HB 100 THR     3.90 
   15     H  83 ASP      HB 100 THR     5.00 
   16    PB  83 ASP       H 100 THR     5.90 




     Aminoacid   84  CYS

    1     H  84 CYS      CB  43 VAL     7.20 
    2   Hb3  84 CYS       H  44 ASN     4.02 
    3   Hb3  84 CYS       H  44 ASN    -3.52 
    4   Hb2  84 CYS       H  44 ASN     3.80 
    5   Hb2  84 CYS       H  44 ASN    -3.30 
    6     H  84 CYS       H  44 ASN     5.00 
    7     H  84 CYS      HA  83 ASP     2.47 
    8     H  84 CYS      HA  83 ASP    -1.97 
    9     H  84 CYS      PB  83 ASP     4.90 
   10    HA  84 CYS     Hb3  84 CYS     2.73 
   11    HA  84 CYS     Hb3  84 CYS    -2.23 
   12    HA  84 CYS     Hb2  84 CYS     3.40 
   13    HA  84 CYS     Hb2  84 CYS    -2.90 
   14     H  84 CYS     Hb3  84 CYS     3.00 
   15     H  84 CYS     Hb2  84 CYS     3.46 
   16     H  84 CYS     Hb2  84 CYS    -2.93 
   17    HA  84 CYS       H  85 ARG     3.46 
   18    HA  84 CYS       H  85 ARG    -2.96 
   19   Hb3  84 CYS       H  85 ARG     4.00 
   20   Hb2  84 CYS       H  85 ARG     5.00 
   21    HA  84 CYS       H  98 LYS     4.75 
   22    HA  84 CYS       H  98 LYS    -4.25 
   23    HA  84 CYS      HA  99 THR     3.19 
   24    HA  84 CYS      HA  99 THR    -2.69 
   25    HA  84 CYS       H 100 THR     3.99 
   26    HA  84 CYS       H 100 THR    -3.49 




     Aminoacid   85  ARG

    1    HA  85 ARG      CB  43 VAL     6.20 
    2    HA  85 ARG      HB  43 VAL     5.00 
    3    PB  85 ARG      HA  43 VAL     5.90 
    4    PD  85 ARG      CB  43 VAL     8.10 
    5    PG  85 ARG      CB  43 VAL     7.10 
    6    HA  85 ARG      HA  43 VAL     3.00 
    7    HA  85 ARG       H  44 ASN     5.00 
    8    PB  85 ARG       H  44 ASN     5.90 
    9     H  85 ARG      HA  84 CYS     3.46 
   10     H  85 ARG      HA  84 CYS    -2.96 
   11     H  85 ARG     Hb3  84 CYS     4.00 
   12     H  85 ARG     Hb2  84 CYS     5.00 
   13    HA  85 ARG      PB  85 ARG     3.90 
   14    PD  85 ARG      PG  85 ARG     4.80 
   15     H  85 ARG      PG  85 ARG     5.90 
   16     H  85 ARG      PB  85 ARG     3.90 
   17    HA  85 ARG       H  86 GLU     2.32 
   18    HA  85 ARG       H  86 GLU    -1.82 
   19     H  85 ARG       H  98 LYS     3.03 
   20     H  85 ARG       H  98 LYS    -2.53 
   21     H  85 ARG      HA  99 THR     3.83 
   22     H  85 ARG      HA  99 THR    -3.33 
   23     H  85 ARG      HA  97 TYR     5.00 
   24     H  85 ARG     Hb3  97 TYR     3.67 
   25     H  85 ARG     Hb3  97 TYR    -3.17 




     Aminoacid   86  GLU

    1     H  86 GLU      HA  43 VAL     3.86 
    2     H  86 GLU      HA  43 VAL    -3.36 
    3    PB  86 GLU      HA  42 PRO     3.90 
    4     H  86 GLU      CB  43 VAL     7.20 
    5     H  86 GLU      HA  85 ARG     2.32 
    6     H  86 GLU      HA  85 ARG    -1.82 
    7     H  86 GLU      PB  86 GLU     4.90 
    8    HA  86 GLU     HD1  97 TYR     5.00 
    9    PG  86 GLU      HA  86 GLU     3.90 
   10    HA  86 GLU       H  87 THR     2.50 
   11    HA  86 GLU       H  87 THR    -2.00 
   12    PB  86 GLU       H  87 THR     5.90 
   13    PG  86 GLU       H  87 THR     4.90 
   14    HA  86 GLU       H  98 LYS     3.35 
   15    HA  86 GLU       H  98 LYS    -2.85 
   16    HA  86 GLU      HA  97 TYR     2.86 
   17    HA  86 GLU      HA  97 TYR    -2.36 
   18    HA  86 GLU      CG  97 TYR     7.10 




     Aminoacid   87  THR

    1     H  87 THR      HA  86 GLU     2.50 
    2     H  87 THR      HA  86 GLU    -2.00 
    3     H  87 THR      PB  86 GLU     5.90 
    4     H  87 THR      PG  86 GLU     4.90 
    5     H  87 THR      CG  87 THR     3.66 
    6     H  87 THR      CG  87 THR    -3.01 
    7    HA  87 THR      CG  87 THR     4.00 
    8     H  87 THR       H  88 GLY    -5.00 
    9    CG  87 THR       H  88 GLY     5.00 
   10    HA  87 THR       H  88 GLY     3.00 
   11    CG  87 THR       H  98 LYS     4.23 
   12    CG  87 THR       H  98 LYS    -3.49 
   13    HA  87 THR       H  98 LYS     5.00 
   14     H  87 THR      HA  97 TYR     5.00 
   15     H  87 THR      CB  96 ALA     6.09 
   16     H  87 THR      CB  96 ALA    -4.73 
   17    CG  87 THR      HA  97 TYR     5.00 
   18    CG  87 THR      HA  96 ALA     6.00 
   19     H  87 THR      PB  90 SER     5.90 
   20     H  87 THR       H  90 SER     5.00 




     Aminoacid   88  GLY

    1     H  88 GLY       H  87 THR    -5.00 
    2     H  88 GLY      CG  87 THR     5.00 
    3     H  88 GLY      HA  87 THR     3.00 
    4     H  88 GLY       H  89 SER     2.71 
    5     H  88 GLY       H  89 SER    -2.21 
    6    PA  88 GLY       H  89 SER     4.90 




     Aminoacid   89  SER

    1     H  89 SER       H  88 GLY     2.71 
    2     H  89 SER       H  88 GLY    -2.21 
    3     H  89 SER      PA  88 GLY     4.90 
    4     H  89 SER      PB  89 SER     4.90 
    5    PB  89 SER       H  90 SER     6.90 
    6    HA  89 SER      PB  89 SER     3.90 
    7    PB  89 SER      CB  96 ALA     6.90 
    8     H  89 SER       H  90 SER     5.00 
    9     H  89 SER      CB  96 ALA     6.00 




     Aminoacid   90  SER

    1    PB  90 SER       H  87 THR     5.90 
    2     H  90 SER       H  87 THR     5.00 
    3     H  90 SER      PB  89 SER     6.90 
    4     H  90 SER       H  89 SER     5.00 
    5     H  90 SER      PB  90 SER     3.90 
    6    HA  90 SER       H  91 LYS     3.00 
    7    HA  90 SER      CB  96 ALA     3.77 
    8    HA  90 SER      CB  96 ALA    -3.16 
    9     H  90 SER      CB  96 ALA     6.00 
   10    HA  90 SER      HA  95 CYS     5.00 




     Aminoacid   91  LYS

    1     H  91 LYS      HA  90 SER     3.00 
    2    HA  91 LYS      PB  91 LYS     3.90 
    3     H  91 LYS      PB  91 LYS     3.90 
    4    HA  91 LYS       H  92 TYR     2.66 
    5    HA  91 LYS       H  92 TYR    -2.16 
    6    PB  91 LYS       H  92 TYR     4.90 
    7     H  91 LYS      PG  91 LYS     5.90 
    8     H  91 LYS       H  92 TYR     5.00 
    9     H  91 LYS      CB  96 ALA     6.00 
   10    PD  91 LYS     ND2  94 ASN     7.00 




     Aminoacid   92  TYR

    1   HD1  92 TYR      HA  37 LYS     5.00 
    2   HD1  92 TYR      HA  38 ASP     5.00 
    3   HD1  92 TYR       H  38 ASP     5.00 
    4   HD1  92 TYR      HA  39 ARG     4.00 
    5   Hb2  92 TYR       H  40 CYS     4.53 
    6   Hb2  92 TYR       H  40 CYS    -3.24 
    7   HD1  92 TYR      HA  40 CYS     5.00 
    8   HD1  92 TYR       H  40 CYS     5.00 
    9     H  92 TYR      HA  91 LYS     2.66 
   10     H  92 TYR      HA  91 LYS    -2.16 
   11     H  92 TYR      PB  91 LYS     4.90 
   12     H  92 TYR       H  91 LYS     5.00 
   13    HA  92 TYR     Hb3  92 TYR     4.00 
   14   Hb2  92 TYR      HA  92 TYR     2.73 
   15   Hb2  92 TYR      HA  92 TYR    -2.23 
   16     H  92 TYR     Hb3  92 TYR     2.68 
   17     H  92 TYR     Hb3  92 TYR    -2.18 
   18     H  92 TYR     Hb2  92 TYR     2.69 
   19     H  92 TYR     Hb2  92 TYR    -2.19 
   20    HA  92 TYR      HA  93 PRO     2.31 
   21    HA  92 TYR      HA  93 PRO    -1.81 
   22    HA  92 TYR      PB  93 PRO     5.90 
   23    HA  92 TYR       H  94 ASN     2.79 
   24    HA  92 TYR       H  94 ASN    -2.29 
   25   HD1  92 TYR      HA  92 TYR     2.94 
   26   HD1  92 TYR      HA  92 TYR    -2.44 
   27   HD1  92 TYR      HA  93 PRO     4.00 
   28    CG  92 TYR      PB  92 TYR     7.50 
   29   HD1  92 TYR      PB  93 PRO     5.00 
   30    CG  92 TYR       H  92 TYR     7.60 




     Aminoacid   93  PRO

    1    HA  93 PRO      HA  92 TYR     2.31 
    2    HA  93 PRO      HA  92 TYR    -1.81 
    3    PB  93 PRO      HA  92 TYR     5.90 
    4    HA  93 PRO     HD1  92 TYR     4.00 
    5    PB  93 PRO     HD1  92 TYR     5.00 
    6    HA  93 PRO      PB  93 PRO     3.90 
    7    PD  93 PRO      PB  93 PRO     6.80 
    8    PD  93 PRO       H  94 ASN     3.90 
    9    PG  93 PRO      PD  93 PRO     4.80 
   10    HA  93 PRO       H  94 ASN     5.00 




     Aminoacid   94  ASN

    1   ND2  94 ASN      PD  91 LYS     7.00 
    2     H  94 ASN      HA  92 TYR     2.79 
    3     H  94 ASN      HA  92 TYR    -2.29 
    4     H  94 ASN      PD  93 PRO     3.90 
    5     H  94 ASN      PB  94 ASN     3.90 
    6    HA  94 ASN      PB  94 ASN     3.90 
    7     H  94 ASN      HA  93 PRO     5.00 
    8    PB  94 ASN       H  95 CYS     5.90 
    9    HA  94 ASN       H  95 CYS     2.72 
   10    HA  94 ASN       H  95 CYS    -2.22 
   11   ND2  94 ASN      PB  94 ASN     6.00 




     Aminoacid   95  CYS

    1   Hb3  95 CYS      CG  36 THR     5.00 
    2   Hb2  95 CYS      CG  36 THR     3.81 
    3   Hb2  95 CYS      CG  36 THR    -3.01 
    4   Hb2  95 CYS      HB  36 THR     5.00 
    5    HA  95 CYS      HA  90 SER     5.00 
    6     H  95 CYS      PB  94 ASN     5.90 
    7     H  95 CYS      HA  94 ASN     2.72 
    8     H  95 CYS      HA  94 ASN    -2.22 
    9     H  95 CYS     Hb3  95 CYS     3.00 
   10     H  95 CYS     Hb2  95 CYS     3.00 
   11    HA  95 CYS     Hb3  95 CYS     3.00 
   12    HA  95 CYS     Hb2  95 CYS     4.00 
   13   Hb3  95 CYS       H  96 ALA     5.00 
   14    HA  95 CYS       H  96 ALA     3.00 
   15   Hb3  95 CYS     HE2  97 TYR     3.00 
   16   Hb3  95 CYS     HE2  97 TYR     4.00 




     Aminoacid   96  ALA

    1    CB  96 ALA       H  87 THR     6.09 
    2    CB  96 ALA       H  87 THR    -4.73 
    3    HA  96 ALA      CG  87 THR     6.00 
    4    CB  96 ALA      PB  89 SER     6.90 
    5    CB  96 ALA       H  89 SER     6.00 
    6    CB  96 ALA      HA  90 SER     3.77 
    7    CB  96 ALA      HA  90 SER    -3.16 
    8    CB  96 ALA       H  90 SER     6.00 
    9    CB  96 ALA       H  91 LYS     6.00 
   10     H  96 ALA     Hb3  95 CYS     5.00 
   11     H  96 ALA      HA  95 CYS     3.00 
   12     H  96 ALA      CB  96 ALA     4.11 
   13     H  96 ALA      CB  96 ALA    -3.17 
   14    CB  96 ALA       H  97 TYR     4.51 
   15    CB  96 ALA       H  97 TYR    -3.36 
   16    HA  96 ALA       H  97 TYR     3.00 
   17    HA  96 ALA      CZ  97 TYR     7.10 




     Aminoacid   97  TYR

    1   Hb3  97 TYR     Hb2  26 CYS     2.91 
    2   Hb3  97 TYR     Hb2  26 CYS    -2.41 
    3   Hb2  97 TYR     Hb2  26 CYS     3.42 
    4   Hb2  97 TYR     Hb2  26 CYS    -2.92 
    5    CZ  97 TYR      HA  27 ASN     7.10 
    6    HH  97 TYR      CG  36 THR     4.70 
    7    HH  97 TYR      CG  36 THR    -3.92 
    8   HE2  97 TYR      CG  36 THR     4.82 
    9   HE2  97 TYR      CG  36 THR    -4.03 
   10   HD2  97 TYR      CG  36 THR     6.00 
   11    HH  97 TYR     Hb3  40 CYS     3.20 
   12    HH  97 TYR     Hb3  40 CYS    -2.70 
   13    HH  97 TYR     Hb3  41 LYS     4.00 
   14    HH  97 TYR       H  41 LYS     3.15 
   15    HH  97 TYR       H  41 LYS    -2.65 
   16    HA  97 TYR       H  85 ARG     5.00 
   17   Hb3  97 TYR       H  85 ARG     3.67 
   18   Hb3  97 TYR       H  85 ARG    -3.17 
   19   HD1  97 TYR      HA  86 GLU     5.00 
   20    HA  97 TYR      HA  86 GLU     2.86 
   21    HA  97 TYR      HA  86 GLU    -2.36 
   22    CG  97 TYR      HA  86 GLU     7.10 
   23    HA  97 TYR       H  87 THR     5.00 
   24    HA  97 TYR      CG  87 THR     5.00 
   25   HE2  97 TYR     Hb3  95 CYS     3.00 
   26   HE2  97 TYR     Hb3  95 CYS     4.00 
   27     H  97 TYR      CB  96 ALA     4.51 
   28     H  97 TYR      CB  96 ALA    -3.36 
   29     H  97 TYR      HA  96 ALA     3.00 
   30    CZ  97 TYR      HA  96 ALA     7.10 
   31    HA  97 TYR     Hb3  97 TYR     3.00 
   32    HA  97 TYR     Hb2  97 TYR     4.00 
   33     H  97 TYR     Hb3  97 TYR     4.23 
   34     H  97 TYR     Hb3  97 TYR    -3.55 
   35     H  97 TYR     Hb2  97 TYR     3.09 
   36     H  97 TYR     Hb2  97 TYR    -2.59 
   37   Hb3  97 TYR       H  98 LYS     3.36 
   38   Hb3  97 TYR       H  98 LYS    -2.86 
   39   Hb2  97 TYR       H  98 LYS     4.00 
   40    HA  97 TYR       H  98 LYS     3.00 
   41    CG  97 TYR       H  97 TYR     6.10 
   42    CZ  97 TYR      PB  97 TYR     8.00 
   43    CG  97 TYR      PB  97 TYR     8.00 




     Aminoacid   98  LYS

    1     H  98 LYS      HA  84 CYS     4.75 
    2     H  98 LYS      HA  84 CYS    -4.25 
    3     H  98 LYS       H  85 ARG     3.03 
    4     H  98 LYS       H  85 ARG    -2.53 
    5     H  98 LYS      HA  86 GLU     3.35 
    6     H  98 LYS      HA  86 GLU    -2.85 
    7     H  98 LYS      CG  87 THR     4.23 
    8     H  98 LYS      CG  87 THR    -3.49 
    9     H  98 LYS      HA  87 THR     5.00 
   10     H  98 LYS     Hb3  97 TYR     3.36 
   11     H  98 LYS     Hb3  97 TYR    -2.86 
   12     H  98 LYS     Hb2  97 TYR     4.00 
   13     H  98 LYS      HA  97 TYR     3.00 
   14     H  98 LYS      PB  98 LYS     3.90 
   15     H  98 LYS      PG  98 LYS     5.90 
   16    HA  98 LYS      PB  98 LYS     3.90 
   17    HA  98 LYS      PG  98 LYS     4.90 
   18    HA  98 LYS      HB  99 THR     5.00 
   19    HA  98 LYS       H  99 THR     3.00 




     Aminoacid   99  THR

    1    CG  99 THR      CB  20 ALA     5.00 
    2    HB  99 THR      HA  23 SER     3.00 
    3    CG  99 THR      HA  23 SER     4.96 
    4    CG  99 THR      HA  23 SER    -3.99 
    5    CG  99 THR       H  25 TYR     4.95 
    6    CG  99 THR       H  25 TYR    -2.87 
    7    CG  99 THR     Hb3  25 TYR     4.00 
    8    CG  99 THR     Hb2  25 TYR     5.00 
    9    CG  99 THR     HD2  25 TYR     4.00 
   10    CG  99 THR     HE2  25 TYR     6.00 
   11    HA  99 THR     Hb2  26 CYS     3.89 
   12    HA  99 THR     Hb2  26 CYS    -3.39 
   13    CG  99 THR       H  26 CYS     4.00 
   14    HA  99 THR      PB  83 ASP     5.90 
   15    HA  99 THR      HA  84 CYS     3.19 
   16    HA  99 THR      HA  84 CYS    -2.69 
   17    HA  99 THR       H  85 ARG     3.83 
   18    HA  99 THR       H  85 ARG    -3.33 
   19    HB  99 THR      HA  98 LYS     5.00 
   20     H  99 THR      HA  98 LYS     3.00 
   21     H  99 THR      HB  99 THR     3.10 
   22     H  99 THR      HB  99 THR    -2.60 
   23     H  99 THR      CG  99 THR     5.00 
   24    HA  99 THR      CG  99 THR     3.43 
   25    HA  99 THR      CG  99 THR    -2.61 
   26    HA  99 THR      HB  99 THR     3.55 
   27    HA  99 THR      HB  99 THR    -3.05 
   28    CG  99 THR       H 100 THR     3.60 
   29    CG  99 THR       H 100 THR    -2.98 
   30    HA  99 THR      HB 100 THR     5.00 
   31    HA  99 THR       H 100 THR     2.48 
   32    HA  99 THR       H 100 THR    -1.98 




     Aminoacid  100  THR

    1     H 100 THR      CG  82 THR     4.00 
    2     H 100 THR       H  83 ASP     3.61 
    3     H 100 THR       H  83 ASP    -3.11 
    4    CG 100 THR      PB  83 ASP     6.90 
    5    HB 100 THR      PB  83 ASP     3.90 
    6    HB 100 THR       H  83 ASP     5.00 
    7     H 100 THR      PB  83 ASP     5.90 
    8     H 100 THR      HA  84 CYS     3.99 
    9     H 100 THR      HA  84 CYS    -3.49 
   10     H 100 THR      CG  99 THR     3.60 
   11     H 100 THR      CG  99 THR    -2.98 
   12    HB 100 THR      HA  99 THR     5.00 
   13     H 100 THR      HA  99 THR     2.48 
   14     H 100 THR      HA  99 THR    -1.98 
   15     H 100 THR      CG 100 THR     5.00 
   16     H 100 THR      HB 100 THR     4.00 
   17    HA 100 THR      CG 100 THR     4.00 
   18    HA 100 THR       H 101 GLN     4.00 
   19    CG 100 THR      HA 101 GLN     4.99 
   20    CG 100 THR      HA 101 GLN    -4.30 
   21    CG 100 THR       H 101 GLN     4.36 
   22    CG 100 THR       H 101 GLN    -3.64 
   23    CG 100 THR     NE2 101 GLN     7.00 




     Aminoacid  101  GLN

    1   NE2 101 GLN      CB  19 ALA     7.10 
    2    PG 101 GLN      CB  19 ALA     5.90 
    3   NE2 101 GLN      HA  19 ALA     5.10 
    4    HA 101 GLN      CB  20 ALA     7.00 
    5    PB 101 GLN      CB  20 ALA     5.90 
    6   NE2 101 GLN       H  81 ILE     6.10 
    7    HA 101 GLN      CG  82 THR     4.19 
    8    HA 101 GLN      CG  82 THR    -3.34 
    9    HA 101 GLN      HA  82 THR     2.95 
   10    HA 101 GLN      HA  82 THR    -2.45 
   11    PB 101 GLN      HA  82 THR     5.90 
   12     H 101 GLN      HA 100 THR     4.00 
   13    HA 101 GLN      CG 100 THR     4.99 
   14    HA 101 GLN      CG 100 THR    -4.30 
   15     H 101 GLN      CG 100 THR     4.36 
   16     H 101 GLN      CG 100 THR    -3.64 
   17   NE2 101 GLN      CG 100 THR     7.00 
   18     H 101 GLN      PB 101 GLN     3.90 
   19     H 101 GLN      PG 101 GLN     5.90 
   20    HA 101 GLN      PB 101 GLN     3.90 
   21    HA 101 GLN      PG 101 GLN     5.90 
   22    HA 101 GLN       H 102 ALA     2.62 
   23    HA 101 GLN       H 102 ALA    -2.12 
   24    PB 101 GLN       H 102 ALA     4.90 
   25    PG 101 GLN       H 102 ALA     5.90 
   26    PB 101 GLN      HA 102 ALA     5.90 
   27    PG 101 GLN    HE21 101 GLN     4.90 
   28    PG 101 GLN    HE22 101 GLN     4.90 




     Aminoacid  102  ALA

    1     H 102 ALA      HA  80 SER     5.00 
    2     H 102 ALA     PG1  81 ILE     5.90 
    3     H 102 ALA     CG2  81 ILE     6.00 
    4     H 102 ALA       H  81 ILE     5.00 
    5     H 102 ALA      HA  82 THR     5.00 
    6     H 102 ALA      HA 101 GLN     2.62 
    7     H 102 ALA      HA 101 GLN    -2.12 
    8     H 102 ALA      PB 101 GLN     4.90 
    9     H 102 ALA      PG 101 GLN     5.90 
   10    HA 102 ALA      PB 101 GLN     5.90 
   11     H 102 ALA      CB 102 ALA     4.00 
   12    CB 102 ALA      HA 103 ASN     6.39 
   13    CB 102 ALA       H 103 ASN     3.73 
   14    CB 102 ALA       H 103 ASN    -2.95 
   15    CB 102 ALA      PE 104 LYS     6.90 




     Aminoacid  103  ASN

    1    HA 103 ASN      CG  78 THR     5.97 
    2    HA 103 ASN      CG  78 THR    -4.28 
    3    PB 103 ASN      CG  78 THR     6.90 
    4    HA 103 ASN      HB  78 THR     5.00 
    5    PB 103 ASN      HB  78 THR     4.90 
    6    HA 103 ASN       H  79 MET     3.81 
    7    HA 103 ASN       H  79 MET    -3.23 
    8    HA 103 ASN      HA  80 SER     3.18 
    9    HA 103 ASN      HA  80 SER    -2.68 
   10    HA 103 ASN       H  81 ILE     3.24 
   11    HA 103 ASN       H  81 ILE    -2.74 
   12    HA 103 ASN      CD  81 ILE     6.00 
   13    HA 103 ASN     CG2  81 ILE     6.00 
   14    HA 103 ASN      CB 102 ALA     6.39 
   15     H 103 ASN      CB 102 ALA     3.73 
   16     H 103 ASN      CB 102 ALA    -2.95 
   17     H 103 ASN      PB 103 ASN     4.90 
   18    HA 103 ASN      PB 103 ASN     3.90 
   19    PB 103 ASN       H 104 LYS     5.90 
   20    HA 103 ASN       H 104 LYS     2.34 
   21    HA 103 ASN       H 104 LYS    -1.84 
   22    HA 103 ASN      PB 104 LYS     5.90 
   23    PB 103 ASN     ND2 103 ASN     7.00 




     Aminoacid  104  LYS

    1     H 104 LYS      HB  78 THR     3.25 
    2     H 104 LYS      HB  78 THR    -2.75 
    3     H 104 LYS      HA  78 THR     4.21 
    4     H 104 LYS      HA  78 THR    -3.71 
    5     H 104 LYS      CG  78 THR     4.91 
    6     H 104 LYS      CG  78 THR    -4.11 
    7    HA 104 LYS      CG  78 THR     4.85 
    8    HA 104 LYS      CG  78 THR    -4.16 
    9    HA 104 LYS      HB  78 THR     3.00 
   10     H 104 LYS       H  79 MET     4.00 
   11     H 104 LYS     CG2  81 ILE     6.00 
   12    PE 104 LYS      CB 102 ALA     6.90 
   13     H 104 LYS      PB 103 ASN     5.90 
   14     H 104 LYS      HA 103 ASN     2.34 
   15     H 104 LYS      HA 103 ASN    -1.84 
   16    PB 104 LYS      HA 103 ASN     5.90 
   17     H 104 LYS     Hb3 104 LYS     5.35 
   18     H 104 LYS     Hb3 104 LYS    -2.46 
   19   Hb2 104 LYS       H 104 LYS     3.00 
   20   Hb3 104 LYS      HA 104 LYS     4.00 
   21   Hb2 104 LYS      HA 104 LYS     4.00 
   22    PE 104 LYS      PG 104 LYS     5.80 
   23    PE 104 LYS      PD 104 LYS     5.80 
   24   Hb3 104 LYS       H 105 HIS     2.60 
   25   Hb3 104 LYS       H 105 HIS    -2.10 
   26   Hb2 104 LYS       H 105 HIS     3.22 
   27   Hb2 104 LYS       H 105 HIS    -2.20 
   28   Hb3 104 LYS      PB 123 SER     3.90 
   29   Hb2 104 LYS      PB 123 SER     4.90 
   30   Hb3 104 LYS      HA 123 SER     5.00 
   31    HA 104 LYS       H 105 HIS     3.00 




     Aminoacid  105  HIS

    1    PB 105 HIS      PB  74 GLN     6.80 
    2    PB 105 HIS      PG  74 GLN     6.80 
    3   HD2 105 HIS      PG  74 GLN     5.90    (Second set) 
    4    HA 105 HIS      HG  75 SER     3.97 
    5    HA 105 HIS      HG  75 SER    -3.47 
    6   HD2 105 HIS      HG  75 SER     5.00    (Second set)
    7    PB 105 HIS      HG  75 SER     5.90 
    8    PB 105 HIS       H  75 SER     5.90 
    9   HE1 105 HIS       H  77 SER     5.00 
   10   HD2 105 HIS      HA  77 SER     3.00    (Second set)  
   11   HE1 105 HIS      HA  77 SER     4.00 
   12   HE1 105 HIS      PB  77 SER     5.90 
   13    HA 105 HIS      HA  78 THR     3.00 
   14     H 105 HIS      CG  78 THR     4.61 
   15     H 105 HIS      CG  78 THR    -3.97 
   16   HD2 105 HIS      CG  78 THR     4.27 
   17   HD2 105 HIS      CG  78 THR    -3.56 
   18   HD2 105 HIS      HA  78 THR     4.03 
   19   HD2 105 HIS      HA  78 THR    -3.53 
   20    HA 105 HIS       H  79 MET     5.00 
   21     H 105 HIS     Hb3 104 LYS     2.60 
   22     H 105 HIS     Hb3 104 LYS    -2.10 
   23     H 105 HIS     Hb2 104 LYS     3.22 
   24     H 105 HIS     Hb2 104 LYS    -2.20 
   25     H 105 HIS      HA 104 LYS     3.00 
   26     H 105 HIS     Hb3 105 HIS     3.63 
   27     H 105 HIS     Hb3 105 HIS    -3.03 
   28     H 105 HIS     Hb2 105 HIS     2.95 
   29     H 105 HIS     Hb2 105 HIS    -2.45 
   30    HA 105 HIS     Hb3 105 HIS     4.00 
   31    HA 105 HIS     Hb2 105 HIS     3.00 
   32   Hb3 105 HIS       H 106 ILE     4.00 
   33   Hb2 105 HIS       H 106 ILE     3.32 
   34   Hb2 105 HIS       H 106 ILE    -2.82 
   35    HA 105 HIS       H 106 ILE     3.08 
   36    HA 105 HIS       H 106 ILE    -2.58 
   37     H 105 HIS       H 124 VAL     3.25 
   38     H 105 HIS       H 124 VAL    -2.75 
   39   Hb3 105 HIS      CB 124 VAL     6.20 
   40   Hb2 105 HIS      CB 124 VAL     5.20 
   41   HD2 105 HIS      PB 105 HIS     3.90 
   42   HD2 105 HIS      CB 124 VAL     5.20    (First set)  
   43   HD2 105 HIS       H 105 HIS     3.55 
   44   HD2 105 HIS       H 105 HIS    -2.85 




     Aminoacid  106  ILE

    1     H 106 ILE     CG2  57 VAL     6.00 
    2     H 106 ILE      PG  74 GLN     5.90 
    3   PG1 106 ILE      HG  75 SER     5.90 
    4   PG1 106 ILE       H  75 SER     5.90 
    5     H 106 ILE       H  75 SER     3.44 
    6     H 106 ILE       H  75 SER    -2.94 
    7     H 106 ILE      HG  75 SER     3.20 
    8     H 106 ILE      HG  75 SER    -2.70 
    9     H 106 ILE      PB  75 SER     5.90 
   10   PG1 106 ILE      PB  75 SER     6.80 
   11     H 106 ILE      HA  78 THR     5.00 
   12     H 106 ILE     Hb3 105 HIS     4.00 
   13     H 106 ILE     Hb2 105 HIS     3.32 
   14     H 106 ILE     Hb2 105 HIS    -2.82 
   15     H 106 ILE      HA 105 HIS     3.08 
   16     H 106 ILE      HA 105 HIS    -2.58 
   17     H 106 ILE     CG2 106 ILE     5.00 
   18     H 106 ILE     PG1 106 ILE     3.90 
   19   CG2 106 ILE      HA 106 ILE     4.00 
   20    HA 106 ILE       H 107 ILE     3.00 
   21    HB 106 ILE       H 107 ILE     2.70 
   22    HB 106 ILE       H 107 ILE    -2.20 
   23   CG2 106 ILE       H 107 ILE     5.00 
   24    HA 106 ILE     PG1 107 ILE     5.90 
   25    HA 106 ILE     CG2 107 ILE     6.00 
   26    HA 106 ILE     PG1 106 ILE     5.90 
   27   CG2 106 ILE      PB 123 SER     6.90 
   28    HB 106 ILE      HA 123 SER     5.00 
   29   CG2 106 ILE      HA 123 SER     5.00 
   30    HA 106 ILE      HA 123 SER     2.92 
   31    HA 106 ILE      HA 123 SER    -2.42 
   32     H 106 ILE      CB 124 VAL     7.20 
   33    HB 106 ILE     PG1 106 ILE     3.90 
   34   CG2 106 ILE      CZ 120 PHE     6.10 
   35   CG2 106 ILE      HZ 120 PHE     4.00 
   36    HB 106 ILE     HE2 120 PHE     4.00 
   37    HA 106 ILE      HZ 120 PHE     5.00 
   38    HA 106 ILE      PB 123 SER     4.90 
   39    HA 106 ILE     HE2 120 PHE     4.00 
   40   CG2 106 ILE     HD2 120 PHE     5.00 
   41    HB 106 ILE      HZ 120 PHE     3.00 




     Aminoacid  107  ILE

    1    CD 107 ILE     CG2  63 VAL     7.00 
    2   CG2 107 ILE       H  72 CYS     6.00 
    3   CG2 107 ILE     Hb3  72 CYS     2.63 
    4   CG2 107 ILE     Hb3  72 CYS    -1.98 
    5   CG2 107 ILE     Hb2  72 CYS     5.00 
    6   CG2 107 ILE       H  73 TYR     5.00 
    7    CD 107 ILE      HA  74 GLN     5.00 
    8   PG1 107 ILE      HA  74 GLN     4.90 
    9     H 107 ILE      HA 106 ILE     3.00 
   10     H 107 ILE      HB 106 ILE     2.70 
   11     H 107 ILE      HB 106 ILE    -2.20 
   12     H 107 ILE     CG2 106 ILE     5.00 
   13   PG1 107 ILE      HA 106 ILE     5.90 
   14   CG2 107 ILE      HA 106 ILE     6.00 
   15     H 107 ILE     CG2 107 ILE     6.00 
   16     H 107 ILE      HA 123 SER     4.00 
   17     H 107 ILE      CD 107 ILE     6.00 
   18     H 107 ILE     PG1 107 ILE     3.90 
   19    HA 107 ILE     CG2 107 ILE     4.00 
   20    HA 107 ILE      CD 107 ILE     4.00 
   21    HA 107 ILE     PG1 107 ILE     4.90 
   22    CD 107 ILE      HB 107 ILE     4.00 
   23    HA 107 ILE       H 108 VAL     3.00 
   24    HB 107 ILE       H 108 VAL     5.00 
   25   CG2 107 ILE       H 108 VAL     5.00 
   26   CG2 107 ILE       H 122 ALA     4.94 
   27   CG2 107 ILE       H 122 ALA    -2.77 
   28    CD 107 ILE       H 122 ALA     5.00 
   29    HB 107 ILE       H 122 ALA     2.75 
   30    HB 107 ILE       H 122 ALA    -2.25 
   31   CG2 107 ILE     Hb3 121 ASP     3.34 
   32   CG2 107 ILE     Hb3 121 ASP    -2.58 
   33   CG2 107 ILE     Hb2 121 ASP     5.00 
   34     H 107 ILE       H 122 ALA     4.00 
   35     H 107 ILE      CZ 120 PHE     7.10 




     Aminoacid  108  VAL

    1   CG1 108 VAL     HD1   8 PHE     4.00 
    2   CG1 108 VAL     HE1   8 PHE     3.94 
    3   CG1 108 VAL     HE1   8 PHE    -3.04 
    4   CG2 108 VAL     HE1   8 PHE     6.00 
    5   CG1 108 VAL      HZ   8 PHE     6.00 
    6   CG2 108 VAL      HZ   8 PHE     6.00 
    7   CG2 108 VAL      HB  57 VAL     3.67 
    8   CG2 108 VAL      HB  57 VAL    -2.98 
    9   CG2 108 VAL       H  57 VAL     6.00 
   10   CG1 108 VAL       H  57 VAL     6.00 
   11   CG2 108 VAL      HA  58 CYS     6.00 
   12   CG2 108 VAL      PB  73 TYR     6.90 
   13   CG2 108 VAL     HD2  73 TYR     6.00 
   14     H 108 VAL      HA  74 GLN     4.00 
   15     H 108 VAL      HA 107 ILE     3.00 
   16     H 108 VAL      HB 107 ILE     5.00 
   17     H 108 VAL     CG2 107 ILE     5.00 
   18     H 108 VAL     CG2 108 VAL     4.00 
   19     H 108 VAL     CG1 108 VAL     5.00 
   20     H 108 VAL      HB 108 VAL     5.00 
   21    HA 108 VAL      HB 108 VAL     2.72 
   22    HA 108 VAL      HB 108 VAL    -2.22 
   23    HA 108 VAL     CG2 108 VAL     6.00 
   24    HA 108 VAL     CG1 108 VAL     5.00 
   25   CG2 108 VAL       H 109 ALA     4.72 
   26   CG2 108 VAL       H 109 ALA    -4.00 
   27   CG1 108 VAL       H 109 ALA     4.91 
   28    HA 108 VAL       H 109 ALA     3.00 
   29    HB 108 VAL       H 109 ALA     2.82 
   30    HB 108 VAL       H 109 ALA    -2.32 
   31    HA 108 VAL      HA 120 PHE     3.37 
   32    HA 108 VAL      HA 120 PHE    -2.85 
   33   CG2 108 VAL      HA 117 PRO     6.00 
   34   CG1 108 VAL      HA 120 PHE     5.00 
   35   CG1 108 VAL     HD2 120 PHE     7.10 




     Aminoacid  109  ALA

    1    CB 109 ALA     ND2  71 ASN     6.00 
    2    HA 109 ALA       H  72 CYS     5.00 
    3    CB 109 ALA      HA  72 CYS     4.47 
    4    CB 109 ALA      HA  72 CYS    -3.58 
    5    HA 109 ALA      HA  72 CYS     2.49 
    6    HA 109 ALA      HA  72 CYS    -1.99 
    7    CB 109 ALA       H  73 TYR     6.00 
    8    HA 109 ALA     HD2  73 TYR     5.00 
    9     H 109 ALA     CG2 108 VAL     4.72 
   10     H 109 ALA     CG2 108 VAL    -4.00 
   11     H 109 ALA     CG1 108 VAL     4.91 
   12     H 109 ALA      HA 108 VAL     3.00 
   13     H 109 ALA      HB 108 VAL     2.82 
   14     H 109 ALA      HB 108 VAL    -2.32 
   15     H 109 ALA      CB 109 ALA     3.64 
   16     H 109 ALA      CB 109 ALA    -3.00 
   17    HA 109 ALA       H 110 CYS     2.55 
   18    HA 109 ALA       H 110 CYS    -2.05 
   19    CB 109 ALA       H 110 CYS     4.45 
   20    CB 109 ALA       H 110 CYS    -3.42 
   21    CB 109 ALA       H 118 VAL     6.00 
   22    CB 109 ALA       H 119 HIS     5.00 
   23    CB 109 ALA      HA 119 HIS     5.45 
   24    CB 109 ALA      HA 119 HIS    -4.64 
   25    HA 109 ALA      PB 119 HIS     5.90 
   26     H 109 ALA      PB 119 HIS     5.90 
   27     H 109 ALA     CG2 118 VAL     6.00 
   28     H 109 ALA      PB 117 PRO     5.90 
   29    CB 109 ALA     CG2 118 VAL     5.36 
   30    CB 109 ALA     CG2 118 VAL    -3.84 
   31     H 109 ALA       H 119 HIS     3.20 
   32     H 109 ALA       H 119 HIS    -2.70 
   33    CB 109 ALA     HD2 119 HIS     3.46 
   34    CB 109 ALA     HD2 119 HIS    -2.78 
   35     H 109 ALA     HD2 119 HIS     3.00    (Second set)  
   36    CB 109 ALA      PB 119 HIS     5.90 




     Aminoacid  110  CYS

    1     H 110 CYS     Hb2  71 ASN     5.00 
    2     H 110 CYS    HD21  71 ASN     4.08 
    3     H 110 CYS    HD21  71 ASN    -3.58 
    4     H 110 CYS    HD22  71 ASN     3.75 
    5     H 110 CYS    HD22  71 ASN    -3.25 
    6     H 110 CYS      HA  72 CYS     3.42 
    7     H 110 CYS      HA  72 CYS    -2.84 
    8     H 110 CYS     HD2  73 TYR     3.98 
    9     H 110 CYS     HD2  73 TYR    -3.26 
   10   Hb3 110 CYS     HD2  73 TYR     3.44 
   11   Hb3 110 CYS     HD2  73 TYR    -2.67 
   12   Hb3 110 CYS     HE2  73 TYR     4.00 
   13     H 110 CYS      HA 109 ALA     2.55 
   14     H 110 CYS      HA 109 ALA    -2.05 
   15     H 110 CYS      CB 109 ALA     4.45 
   16     H 110 CYS      CB 109 ALA    -3.42 
   17    HA 110 CYS     Hb3 110 CYS     2.66 
   18    HA 110 CYS     Hb3 110 CYS    -2.16 
   19    HA 110 CYS     Hb2 110 CYS     3.01 
   20    HA 110 CYS     Hb2 110 CYS    -2.51 
   21     H 110 CYS     Hb3 110 CYS     4.03 
   22     H 110 CYS     Hb3 110 CYS    -3.34 
   23     H 110 CYS     Hb2 110 CYS     3.14 
   24     H 110 CYS     Hb2 110 CYS    -2.64 
   25    HA 110 CYS       H 111 GLU     2.64 
   26    HA 110 CYS       H 111 GLU    -2.14 
   27   Hb3 110 CYS       H 111 GLU     3.36 
   28   Hb3 110 CYS       H 111 GLU    -2.86 
   29   Hb2 110 CYS       H 111 GLU     3.37 
   30   Hb2 110 CYS       H 111 GLU    -2.78 
   31    HA 110 CYS     CG2 118 VAL     4.00 
   32    HA 110 CYS     CG1 118 VAL     5.00 
   33    HA 110 CYS       H 118 VAL     4.00 
   34    HA 110 CYS       H 119 HIS     5.00 
   35    HA 110 CYS       H 116 VAL     8.40 
   36    HA 110 CYS       H 116 VAL    -4.79 
   37    HA 110 CYS      HA 117 PRO     3.35 
   38    HA 110 CYS      HA 117 PRO    -2.85 
   39   Hb2 110 CYS     HD2 115 TYR     4.00 
   40   Hb3 110 CYS     HE2 115 TYR     4.00 
   41   Hb2 110 CYS     HE2 115 TYR     3.00 




     Aminoacid  111  GLU

    1     H 111 GLU      HA 110 CYS     2.64 
    2     H 111 GLU      HA 110 CYS    -2.14 
    3     H 111 GLU     Hb3 110 CYS     3.36 
    4     H 111 GLU     Hb3 110 CYS    -2.86 
    5     H 111 GLU     Hb2 110 CYS     3.37 
    6     H 111 GLU     Hb2 110 CYS    -2.78 
    7     H 111 GLU      PB 111 GLU     4.90 
    8     H 111 GLU      PG 111 GLU     5.90 
    9    PB 111 GLU     CG1 118 VAL     5.90 
   10    PG 111 GLU     CG2 118 VAL     6.90 
   11    HA 111 GLU      PB 111 GLU     4.90 
   12    HA 111 GLU      PG 111 GLU     4.90 
   13    PB 111 GLU       H 112 GLY     4.90 
   14    HA 111 GLU       H 112 GLY     3.00 
   15     H 111 GLU     CG2 118 VAL     4.31 
   16     H 111 GLU     CG2 118 VAL    -3.64 
   17     H 111 GLU     CG1 118 VAL     4.00 
   18     H 111 GLU      HA 117 PRO     4.00 
   19     H 111 GLU      HA 115 TYR     5.47 
   20     H 111 GLU      HA 115 TYR    -4.14 
   21    PB 111 GLU      CB 118 VAL     5.90 
   22    PG 111 GLU     CG2 118 VAL     6.90 
   23     H 111 GLU       H 116 VAL     2.74 
   24     H 111 GLU       H 116 VAL    -2.24 
   25     H 111 GLU      CZ 115 TYR     7.10 
   26    HA 111 GLU     HD1 115 TYR     4.00 
   27    HA 111 GLU     HE1 115 TYR     5.00 




     Aminoacid  112  GLY

    1     H 112 GLY      PB 111 GLU     4.90 
    2     H 112 GLY      HA 111 GLU     3.00 
    3    PA 112 GLY       H 113 ASN     4.90 
    4     H 112 GLY     HD1 115 TYR     3.96 
    5     H 112 GLY     HD1 115 TYR    -3.46 
    6     H 112 GLY     HE1 115 TYR     5.00 




     Aminoacid  113  ASN

    1     H 113 ASN      PA 112 GLY     4.90 
    2     H 113 ASN     Hb3 113 ASN     2.88 
    3     H 113 ASN     Hb3 113 ASN    -2.38 
    4     H 113 ASN     Hb2 113 ASN     3.93 
    5     H 113 ASN     Hb2 113 ASN    -3.43 
    6    HA 113 ASN     Hb3 113 ASN     4.00 
    7    HA 113 ASN     Hb2 113 ASN     3.00 
    8   Hb3 113 ASN     ND2 113 ASN     4.10 




     Aminoacid  114  PRO

    1    PD 114 PRO      PG 114 PRO     4.80 
    2    PB 114 PRO       H 115 TYR     4.90 
    3    PG 114 PRO     CG1 116 VAL     6.90 




     Aminoacid  115  TYR

    1   HD2 115 TYR     Hb3  58 CYS     2.85 
    2   HD2 115 TYR     Hb3  58 CYS    -2.35 
    3   HE2 115 TYR     Hb2  58 CYS     4.00 
    4   HD2 115 TYR     Hb2 110 CYS     4.00 
    5   HE2 115 TYR     Hb3 110 CYS     4.00 
    6   HE2 115 TYR     Hb2 110 CYS     3.00 
    7    HA 115 TYR       H 111 GLU     5.47 
    8    HA 115 TYR       H 111 GLU    -4.14 
    9    CZ 115 TYR       H 111 GLU     7.10 
   10   HD1 115 TYR      HA 111 GLU     4.00 
   11   HE1 115 TYR      HA 111 GLU     5.00 
   12   HD1 115 TYR       H 112 GLY     3.96 
   13   HD1 115 TYR       H 112 GLY    -3.46 
   14   HE1 115 TYR       H 112 GLY     5.00 
   15     H 115 TYR      PB 114 PRO     4.90 
   16     H 115 TYR     Hb3 115 TYR     3.00 
   17   Hb2 115 TYR       H 115 TYR     2.85 
   18   Hb3 115 TYR      HA 115 TYR     3.08 
   19   Hb2 115 TYR      HA 115 TYR     2.85 
   20    HA 115 TYR       H 116 VAL     2.06 
   21   Hb3 115 TYR       H 116 VAL     5.00 
   22   Hb2 115 TYR       H 116 VAL     3.47 
   23    CG 115 TYR      PB 115 TYR     6.00 
   24    CG 115 TYR      HA 115 TYR     5.10 
   25    CG 115 TYR     CG1 116 VAL     8.10 
   26    CG 115 TYR       H 116 VAL     6.20 
   27    CZ 115 TYR      PB 115 TYR     8.00 
   28    CZ 115 TYR      HA 115 TYR     7.10 




     Aminoacid  116  VAL

    1   CG2 116 VAL      CB   5 ALA     4.20 
    2   CG1 116 VAL    HE22  55 GLN     5.00 
    3   CG1 116 VAL    HE21  55 GLN     5.00 
    4     H 116 VAL      HA 110 CYS     8.40 
    5     H 116 VAL      HA 110 CYS    -4.79 
    6     H 116 VAL       H 111 GLU     2.74 
    7     H 116 VAL       H 111 GLU    -2.24 
    8   CG1 116 VAL      PG 114 PRO     6.90 
    9     H 116 VAL      HA 115 TYR     2.06 
   10     H 116 VAL     Hb3 115 TYR     5.00 
   11     H 116 VAL     Hb2 115 TYR     3.47 
   12   CG1 116 VAL      CG 115 TYR     8.10 
   13     H 116 VAL      CG 115 TYR     6.20 
   14     H 116 VAL     CG2 116 VAL     3.32 
   15     H 116 VAL     CG1 116 VAL     4.00 
   16    HA 116 VAL     CG2 116 VAL     4.00 
   17    HA 116 VAL     CG1 116 VAL     5.00 
   18    HB 116 VAL      PD 117 PRO     3.90 
   19   CG2 116 VAL      PD 117 PRO     6.90 
   20   CG1 116 VAL      PD 117 PRO     6.90 




     Aminoacid  117  PRO

    1    PB 117 PRO     HD1   8 PHE     4.90 
    2    PB 117 PRO      CZ   8 PHE     8.00 
    3    PB 117 PRO      HZ   8 PHE     5.90 
    4    PG 117 PRO      PB  55 GLN     5.80 
    5    HA 117 PRO     CG2 108 VAL     6.00 
    6    PB 117 PRO       H 109 ALA     5.90 
    7    HA 117 PRO      HA 110 CYS     3.35 
    8    HA 117 PRO      HA 110 CYS    -2.85 
    9    HA 117 PRO       H 111 GLU     4.00 
   10    PD 117 PRO      HB 116 VAL     3.90 
   11    PD 117 PRO     CG2 116 VAL     6.90 
   12    PD 117 PRO     CG1 116 VAL     6.90 
   13    PD 117 PRO      PB 117 PRO     6.80 
   14    PD 117 PRO      PG 117 PRO     4.80 
   15    PG 117 PRO      PB 117 PRO     4.80 
   16    HA 117 PRO      PB 117 PRO     3.90 
   17    HA 117 PRO       H 118 VAL     3.00 
   18    HA 117 PRO     CG2 118 VAL     6.00 
   19    HA 117 PRO     CG1 118 VAL     5.00 
   20    PB 117 PRO       H 118 VAL     5.90 
   21    PG 117 PRO       H 118 VAL     5.90 
   22    PB 117 PRO       H 119 HIS     5.90 
   23    HA 117 PRO       H 119 HIS     4.00 




     Aminoacid  118  VAL

    1   CG1 118 VAL      CB   4 ALA     7.00 
    2   CG2 118 VAL      CB   4 ALA     5.00 
    3    HA 118 VAL      CB   4 ALA     6.00 
    4   CG1 118 VAL      HA   5 ALA     4.10 
    5     H 118 VAL      CB 109 ALA     6.00 
    6   CG2 118 VAL       H 109 ALA     6.00 
    7   CG2 118 VAL      CB 109 ALA     5.36 
    8   CG2 118 VAL      CB 109 ALA    -3.84 
    9   CG2 118 VAL      HA 110 CYS     4.00 
   10   CG1 118 VAL      HA 110 CYS     5.00 
   11     H 118 VAL      HA 110 CYS     4.00 
   12   CG1 118 VAL      PB 111 GLU     5.90 
   13   CG2 118 VAL      PG 111 GLU     6.90 
   14   CG2 118 VAL       H 111 GLU     4.31 
   15   CG2 118 VAL       H 111 GLU    -3.64 
   16   CG1 118 VAL       H 111 GLU     4.00 
   17    CB 118 VAL      PB 111 GLU     5.90 
   18   CG2 118 VAL      PG 111 GLU     6.90 
   19     H 118 VAL      HA 117 PRO     3.00 
   20   CG2 118 VAL      HA 117 PRO     6.00 
   21   CG1 118 VAL      HA 117 PRO     5.00 
   22     H 118 VAL      PB 117 PRO     5.90 
   23     H 118 VAL      PG 117 PRO     5.90 
   24     H 118 VAL      HB 118 VAL     4.00 
   25     H 118 VAL     CG2 118 VAL     3.40 
   26     H 118 VAL     CG1 118 VAL     4.16 
   27    HA 118 VAL     CG2 118 VAL     4.49 
   28    HA 118 VAL     CG1 118 VAL     4.00 
   29    HB 118 VAL       H 119 HIS     5.00 
   30    HA 118 VAL       H 119 HIS     4.00 
   31     H 118 VAL       H 119 HIS     2.50 
   32   CG2 118 VAL       H 119 HIS     3.91 
   33   CG2 118 VAL      HA 119 HIS     5.26 
   34   CG2 118 VAL      PB 119 HIS     6.90 
   35   CG2 118 VAL     HD2 119 HIS     4.00    (First set) 
   36   CG1 118 VAL     HD2 119 HIS     6.00    (First set) 




     Aminoacid  119  HIS

    1    HA 119 HIS     HD1   8 PHE     3.11 
    2    HA 119 HIS     HD1   8 PHE    -2.61 
    3     H 119 HIS     HD1   8 PHE     3.62 
    4     H 119 HIS     HD1   8 PHE    -3.12 
    5    HA 119 HIS     HD2  12 HIS     5.00 
    6     H 119 HIS      CB 109 ALA     5.00 
    7    HA 119 HIS      CB 109 ALA     5.45 
    8    HA 119 HIS      CB 109 ALA    -4.64 
    9    PB 119 HIS      HA 109 ALA     5.90 
   10    PB 119 HIS       H 109 ALA     5.90 
   11     H 119 HIS       H 109 ALA     3.20 
   12     H 119 HIS       H 109 ALA    -2.70 
   13   HD2 119 HIS      CB 109 ALA     3.46 
   14   HD2 119 HIS      CB 109 ALA    -2.78 
   15   HD2 119 HIS       H 109 ALA     3.00    (Second set)  
   16    PB 119 HIS      CB 109 ALA     5.90 
   17     H 119 HIS      HA 110 CYS     5.00 
   18     H 119 HIS      PB 117 PRO     5.90 
   19     H 119 HIS      HA 117 PRO     4.00 
   20     H 119 HIS      HB 118 VAL     5.00 
   21     H 119 HIS      HA 118 VAL     4.00 
   22     H 119 HIS       H 118 VAL     2.50 
   23     H 119 HIS     CG2 118 VAL     3.91 
   24    HA 119 HIS     CG2 118 VAL     5.26 
   25    PB 119 HIS     CG2 118 VAL     6.90 
   26   HD2 119 HIS     CG2 118 VAL     4.00    (First set) 
   27   HD2 119 HIS     CG1 118 VAL     6.00    (First set) 
   28    HA 119 HIS      PB 119 HIS     3.90 
   29     H 119 HIS      PB 119 HIS     3.90 
   30    PB 119 HIS       H 120 PHE     5.90 
   31   HD2 119 HIS      PB 121 ASP     3.90    (Second set) 
   32   HE1 119 HIS      HA 121 ASP     4.00    (Second set) 
   33   HE1 119 HIS      PB 121 ASP     5.90    (Second set) 
   34   HD2 119 HIS      PB 119 HIS     3.00 
   35   HD2 119 HIS      HA 119 HIS     5.00 
   36    HA 119 HIS       H 120 PHE     2.47 




     Aminoacid  120  PHE

    1   Hb3 120 PHE     HD1   8 PHE     4.00 
    2   Hb2 120 PHE     HD1   8 PHE     2.64 
    3   Hb2 120 PHE     HD1   8 PHE    -2.14 
    4    HA 120 PHE     HD1   8 PHE     4.00 
    5   Hb2 120 PHE     HE1   8 PHE     4.00 
    6    HA 120 PHE     HE1   8 PHE     5.00 
    7     H 120 PHE     HD1   8 PHE     3.43 
    8     H 120 PHE     HD1   8 PHE    -2.93 
    9   Hb3 120 PHE     HE1  12 HIS     4.00 
   10   Hb2 120 PHE     HE1  12 HIS     4.00 
   11   HD2 120 PHE     Hb2  12 HIS     5.00 
   12   Hb3 120 PHE     HD2  12 HIS     5.00 
   13   Hb2 120 PHE     HD2  12 HIS     5.00 
   14   Hb2 120 PHE     HD1  12 HIS     5.00 
   15    HZ 120 PHE      CG  45 THR     4.00 
   16   HE1 120 PHE      HB  45 THR     5.00 
   17   HD1 120 PHE      HB  45 THR     3.97 
   18   HD1 120 PHE      HB  45 THR    -3.47 
   19   HD1 120 PHE      CG  45 THR     4.00 
   20    HZ 120 PHE      HB  45 THR     5.00 
   21   HD2 120 PHE     CG2  47 VAL     4.63 
   22   HD2 120 PHE     CG2  47 VAL    -3.89 
   23   HE2 120 PHE     CG2  47 VAL     3.50 
   24   HE2 120 PHE     CG2  47 VAL    -2.80 
   25    HZ 120 PHE     CG2  47 VAL     5.00 
   26    CZ 120 PHE      CD  81 ILE     8.10 
   27    CZ 120 PHE     CG2 106 ILE     6.10 
   28    HZ 120 PHE     CG2 106 ILE     4.00 
   29   HE2 120 PHE      HB 106 ILE     4.00 
   30    HZ 120 PHE      HA 106 ILE     5.00 
   31   HE2 120 PHE      HA 106 ILE     4.00 
   32   HD2 120 PHE     CG2 106 ILE     5.00 
   33    HZ 120 PHE      HB 106 ILE     3.00 
   34    CZ 120 PHE       H 107 ILE     7.10 
   35    HA 120 PHE      HA 108 VAL     3.37 
   36    HA 120 PHE      HA 108 VAL    -2.85 
   37    HA 120 PHE     CG1 108 VAL     5.00 
   38   HD2 120 PHE     CG1 108 VAL     7.10 
   39     H 120 PHE      PB 119 HIS     5.90 
   40     H 120 PHE      HA 119 HIS     2.47 
   41     H 120 PHE     Hb3 120 PHE     3.02 
   42   Hb2 120 PHE       H 120 PHE     3.88 
   43    HA 120 PHE     Hb3 120 PHE     4.00 
   44    HA 120 PHE     Hb2 120 PHE     3.37 
   45    HA 120 PHE      CG 120 PHE     5.10 
   46   HD1 120 PHE       H 121 ASP     3.43 
   47   HD1 120 PHE      HA 122 ALA     5.00 
   48   HE1 120 PHE      HA 122 ALA     4.00 
   49   HE1 120 PHE      PB 123 SER     5.90 
   50    HZ 120 PHE       H 121 ASP     5.00 
   51   HE1 120 PHE      HA 122 ALA     4.00 
   52    HZ 120 PHE      PB 123 SER     4.90 
   53   HE1 120 PHE      HA 123 SER     5.00 
   54    HZ 120 PHE       H 123 SER     4.00 
   55    HZ 120 PHE      HA 123 SER     4.08 




     Aminoacid  121  ASP

    1   Hb3 121 ASP     CG2 107 ILE     3.34 
    2   Hb3 121 ASP     CG2 107 ILE    -2.58 
    3   Hb2 121 ASP     CG2 107 ILE     5.00 
    4    PB 121 ASP     HD2 119 HIS     3.90    (Second set) 
    5    HA 121 ASP     HE1 119 HIS     4.00    (Second set)
    6    PB 121 ASP     HE1 119 HIS     5.90    (Second set) 
    7     H 121 ASP     HD1 120 PHE     3.43 
    8     H 121 ASP      HZ 120 PHE     5.00 
    9     H 121 ASP     Hb3 121 ASP     3.00 
   10     H 121 ASP     Hb2 121 ASP     4.00 
   11    HA 121 ASP     Hb3 121 ASP     4.00 
   12    HA 121 ASP     Hb2 121 ASP     3.00 
   13     H 121 ASP       H 122 ALA     2.75 
   14   Hb3 121 ASP       H 122 ALA     4.00 
   15   Hb2 121 ASP       H 122 ALA     3.15 




     Aminoacid  122  ALA

    1     H 122 ALA     CG2 107 ILE     4.94 
    2     H 122 ALA     CG2 107 ILE    -2.77 
    3     H 122 ALA      CD 107 ILE     5.00 
    4     H 122 ALA      HB 107 ILE     2.75 
    5     H 122 ALA      HB 107 ILE    -2.25 
    6     H 122 ALA       H 107 ILE     4.00 
    7    HA 122 ALA     HD1 120 PHE     5.00 
    8    HA 122 ALA     HE1 120 PHE     4.00 
    9    HA 122 ALA     HE1 120 PHE     4.00 
   10     H 122 ALA       H 121 ASP     2.75 
   11     H 122 ALA     Hb3 121 ASP     4.00 
   12     H 122 ALA     Hb2 121 ASP     3.15 
   13    CB 122 ALA       H 122 ALA     4.17 
   14    CB 122 ALA       H 123 SER     4.23 
   15    HA 122 ALA       H 123 SER     3.00 




     Aminoacid  123  SER

    1    PB 123 SER     Hb3 104 LYS     3.90 
    2    PB 123 SER     Hb2 104 LYS     4.90 
    3    HA 123 SER     Hb3 104 LYS     5.00 
    4    PB 123 SER     CG2 106 ILE     6.90 
    5    HA 123 SER      HB 106 ILE     5.00 
    6    HA 123 SER     CG2 106 ILE     5.00 
    7    HA 123 SER      HA 106 ILE     2.92 
    8    HA 123 SER      HA 106 ILE    -2.42 
    9    PB 123 SER      HA 106 ILE     4.90 
   10    HA 123 SER       H 107 ILE     4.00 
   11    PB 123 SER     HE1 120 PHE     5.90 
   12    PB 123 SER      HZ 120 PHE     4.90 
   13    HA 123 SER     HE1 120 PHE     5.00 
   14     H 123 SER      HZ 120 PHE     4.00 
   15    HA 123 SER      HZ 120 PHE     4.08 
   16     H 123 SER      CB 122 ALA     4.23 
   17     H 123 SER      HA 122 ALA     3.00 




     Aminoacid  124  VAL

    1    CB 124 VAL    HE21  74 GLN     6.20 
    2    CB 124 VAL    HE22  74 GLN     6.20 
    3     H 124 VAL       H 105 HIS     3.25 
    4     H 124 VAL       H 105 HIS    -2.75 
    5    CB 124 VAL     Hb3 105 HIS     6.20 
    6    CB 124 VAL     Hb2 105 HIS     5.20 
    7    CB 124 VAL     HD2 105 HIS     5.20    (First set) 
    8    CB 124 VAL       H 106 ILE     7.20 



  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had 259 H/Q atoms
  Start of MODEL    1
    1   1H    LYS   1           H1       LYS   1 -10.290  15.210   7.190
    2   2H    LYS   1           H2       LYS   1  -9.850  15.260   8.760
    3   3H    LYS   1           H3       LYS   1  -8.800  15.780   7.590
    4   1HZ   LYS   1           HZ3      LYS   1 -12.930  10.750  10.050
    5   2HZ   LYS   1           HZ1      LYS   1 -13.130  11.640  11.410
    6   3HZ   LYS   1           HZ2      LYS   1 -14.210  11.790  10.170
    7    H    GLU   2           H        GLU   2  -7.300  12.080   7.140
    8    H    THR   3           H        THR   3  -9.240  11.850   3.680
    9    HG1  THR   3           HG1      THR   3 -12.180  12.270   3.060
   10    H    ALA   4           H        ALA   4 -10.980   7.720   3.120
   11    H    ALA   5           H        ALA   5 -10.150   8.510  -0.870
   12    H    ALA   6           H        ALA   6  -8.070   9.830  -0.240
   13    H    LYS   7           H        LYS   7  -7.040   8.560   1.740
   14   1HZ   LYS   7           HZ1      LYS   7  -7.790   3.230   5.000
   15   2HZ   LYS   7           HZ2      LYS   7  -8.970   3.360   3.880
   16   3HZ   LYS   7           HZ3      LYS   7  -7.480   4.030   3.610
   17    H    PHE   8           H        PHE   8  -6.330   5.970   0.660
   18    H    GLU   9           H        GLU   9  -4.220   7.160  -1.220
   19    NH1  ARG  10           NH2      ARG  10  -2.140   8.820   7.910
   20    NH2  ARG  10           NH1      ARG  10  -4.240   8.080   7.570
   21    H    ARG  10           H        ARG  10  -2.430   8.260   0.970
   22    HE   ARG  10           HE       ARG  10  -3.180   6.840   5.680
   23   1HH1  ARG  10           HH2      ARG  10  -1.180   8.810   7.650
   24   2HH1  ARG  10           HH2      ARG  10  -2.460   9.250   8.750
   25   1HH2  ARG  10           HH1      ARG  10  -4.880   7.470   7.100
   26   2HH2  ARG  10           HH1      ARG  10  -4.510   8.550   8.410
   27    H    GLN  11           H        GLN  11  -1.770   5.820   2.500
   28   1HE2  GLN  11           HE2      GLN  11  -3.580   0.510   4.820
   29   2HE2  GLN  11           HE2      GLN  11  -1.920   1.020   4.690
   30    H    HIS  12           H        HIS  12  -0.480   4.490   0.390
   31    HD1  HIS  12           HD1      HIS  12   0.150   0.120   0.510
   32    HE2  HIS  12           HE2      HIS  12  -3.340   1.050   2.210
   33    H    MET  13           H        MET  13   0.820   5.470  -1.510
   34    H    ASP  14           H        ASP  14   4.110   4.440  -4.520
   35    H    SER  15           H        SER  15   5.020   6.560  -5.720
   36    HG   SER  15           HG       SER  15   6.390   7.130  -9.690
   37    H    SER  16           H        SER  16   7.680   8.020  -5.990
   38    HG   SER  16           HG       SER  16   9.550   8.930  -3.600
   39    H    THR  17           H        THR  17   9.510   6.020  -5.650
   40    HG1  THR  17           HG1      THR  17   9.760   4.800  -4.250
   41    H    SER  18           H        SER  18  11.790   3.610  -8.290
   42    HG   SER  18           HG       SER  18  10.140   3.310 -10.680
   43    H    ALA  19           H        ALA  19  11.760   1.450  -6.350
   44    H    ALA  20           H        ALA  20  11.140  -1.660  -3.600
   45    H    SER  21           H        SER  21  14.460   0.650  -2.620
   46    HG   SER  21           HG       SER  21  16.890   2.620  -1.900
   47    H    SER  22           H        SER  22  15.500  -0.990  -0.510
   48    HG   SER  22           HG       SER  22  18.210  -0.110   3.430
   49    H    SER  23           H        SER  23  17.850  -3.640   1.880
   50    HG   SER  23           HG       SER  23  19.120  -5.680   4.040
   51    H    ASN  24           H        ASN  24  16.670  -2.090   3.870
   52   1HD2  ASN  24           HD2      ASN  24  19.560  -1.420   5.590
   53   2HD2  ASN  24           HD2      ASN  24  18.510  -2.680   6.170
   54    OH   TYR  25           OH       TYR  25   9.380   3.390  -1.150
   55    H    TYR  25           H        TYR  25  14.450  -1.180   3.080
   56    HH   TYR  25           HH       TYR  25   9.870   3.950  -1.820
   57    H    CYS  26           H        CYS  26  11.700  -0.820   4.020
   58    H    ASN  27           H        ASN  27  12.160   0.390   6.550
   59   1HD2  ASN  27           HD2      ASN  27  13.870  -1.810  10.160
   60   2HD2  ASN  27           HD2      ASN  27  13.690  -0.210  10.840
   61    H    GLN  28           H        GLN  28  12.960   3.180   6.850
   62   1HE2  GLN  28           HE2      GLN  28  16.900   3.780   8.230
   63   2HE2  GLN  28           HE2      GLN  28  16.910   5.250   7.270
   64    H    MET  29           H        MET  29  11.190   4.100   5.100
   65    H    MET  30           H        MET  30   8.550   3.550   5.980
   66    H    LYS  31           H        LYS  31   8.540   5.770   7.900
   67   1HZ   LYS  31           HZ3      LYS  31  12.130   4.650  10.630
   68   2HZ   LYS  31           HZ1      LYS  31  12.050   3.850  12.050
   69   3HZ   LYS  31           HZ2      LYS  31  10.710   4.040  11.160
   70    H    SER  32           H        SER  32   8.490   8.260   6.690
   71    HG   SER  32           HG       SER  32   8.180   8.590   3.910
   72    NH1  ARG  33           NH2      ARG  33   5.960   9.350  -0.330
   73    NH2  ARG  33           NH1      ARG  33   6.720  11.180   0.770
   74    H    ARG  33           H        ARG  33   5.930   8.140   5.650
   75    HE   ARG  33           HE       ARG  33   5.340  10.310   2.670
   76   1HH1  ARG  33           HH2      ARG  33   5.440   8.500  -0.320
   77   2HH1  ARG  33           HH2      ARG  33   6.490   9.620  -1.120
   78   1HH2  ARG  33           HH1      ARG  33   6.750  11.760   1.580
   79   2HH2  ARG  33           HH1      ARG  33   7.260  11.390  -0.040
   80    H    ASN  34           H        ASN  34   4.240   9.870   7.350
   81   1HD2  ASN  34           HD2      ASN  34  -0.910  11.500  10.270
   82   2HD2  ASN  34           HD2      ASN  34  -0.780  10.040   9.300
   83    H    LEU  35           H        LEU  35   2.590   7.300   7.640
   84    H    THR  36           H        THR  36   3.930   6.620  10.190
   85    HG1  THR  36           HG1      THR  36   6.660   6.730  11.980
   86    H    LYS  37           H        LYS  37   2.630   8.120  12.000
   87   1HZ   LYS  37           HZ1      LYS  37   3.010  13.160  10.910
   88   2HZ   LYS  37           HZ2      LYS  37   4.410  13.960  10.650
   89   3HZ   LYS  37           HZ3      LYS  37   3.790  12.950   9.510
   90    H    ASP  38           H        ASP  38   1.830   7.760  14.700
   91    NH1  ARG  39           NH2      ARG  39  -1.550   7.190  14.610
   92    NH2  ARG  39           NH1      ARG  39   0.170   6.840  13.180
   93    H    ARG  39           H        ARG  39   0.890   5.840  15.970
   94    HE   ARG  39           HE       ARG  39   0.200   4.570  14.130
   95   1HH1  ARG  39           HH2      ARG  39  -2.210   6.830  15.270
   96   2HH1  ARG  39           HH2      ARG  39  -1.650   8.120  14.250
   97   1HH2  ARG  39           HH1      ARG  39   0.670   6.170  12.620
   98   2HH2  ARG  39           HH1      ARG  39   0.070   7.780  12.850
   99    H    CYS  40           H        CYS  40   3.660   2.580  16.670
  100    H    LYS  41           H        LYS  41   3.130   2.010  12.340
  101   1HZ   LYS  41           HZ3      LYS  41  -2.600   1.570   8.890
  102   2HZ   LYS  41           HZ1      LYS  41  -1.900   1.800   7.430
  103   3HZ   LYS  41           HZ2      LYS  41  -3.010   0.600   7.620
  104    H    VAL  43           H        VAL  43   0.860  -3.060  10.320
  105    H    ASN  44           H        ASN  44   2.750  -3.400   6.630
  106   1HD2  ASN  44           HD2      ASN  44   1.710   1.710   3.660
  107   2HD2  ASN  44           HD2      ASN  44   2.970   1.030   4.640
  108    H    THR  45           H        THR  45   1.050  -1.270   3.200
  109    HG1  THR  45           HG1      THR  45   1.650  -4.480   2.740
  110    H    PHE  46           H        PHE  46   4.550  -1.300   0.830
  111    H    VAL  47           H        VAL  47   3.280   1.550  -2.280
  112    H    HIS  48           H        HIS  48   4.990  -0.010  -5.720
  113    HD1  HIS  48           HD1      HIS  48   8.860   2.750  -5.040
  114    HE2  HIS  48           HE2      HIS  48   8.880  -0.430  -2.560
  115    H    GLU  49           H        GLU  49   3.530   2.740  -7.010
  116    H    SER  50           H        SER  50   3.010   5.220 -10.670
  117    HG   SER  50           HG       SER  50   1.540   5.620 -12.310
  118    H    LEU  51           H        LEU  51  -0.310   7.940  -8.750
  119    H    ALA  52           H        ALA  52  -1.910   7.920 -11.070
  120    H    ASP  53           H        ASP  53  -0.940   5.280 -12.270
  121    H    VAL  54           H        VAL  54  -2.320   3.710 -10.500
  122    H    GLN  55           H        GLN  55  -4.780   4.200 -10.300
  123   1HE2  GLN  55           HE2      GLN  55  -8.450   8.780 -11.000
  124   2HE2  GLN  55           HE2      GLN  55  -9.000   7.190 -10.500
  125    H    ALA  56           H        ALA  56  -5.080   2.880 -12.860
  126    H    VAL  57           H        VAL  57  -5.770   0.330 -11.660
  127    H    CYS  58           H        CYS  58  -8.000   0.060 -11.080
  128    H    SER  59           H        SER  59  -9.370  -0.900 -13.350
  129    HG   SER  59           HG       SER  59 -12.460   0.060 -13.530
  130    H    GLN  60           H        GLN  60  -9.490  -3.420 -13.550
  131   1HE2  GLN  60           HE2      GLN  60  -3.770  -2.760 -15.330
  132   2HE2  GLN  60           HE2      GLN  60  -5.300  -1.910 -15.450
  133    H    LYS  61           H        LYS  61  -8.940  -6.350 -13.200
  134   1HZ   LYS  61           HZ3      LYS  61 -10.750 -12.670 -13.480
  135   2HZ   LYS  61           HZ1      LYS  61 -12.110 -13.460 -13.940
  136   3HZ   LYS  61           HZ2      LYS  61 -11.120 -12.800 -15.070
  137    H    ASN  62           H        ASN  62 -12.990  -7.970 -12.760
  138   1HD2  ASN  62           HD2      ASN  62 -15.720  -6.810  -7.750
  139   2HD2  ASN  62           HD2      ASN  62 -14.530  -5.960  -8.700
  140    H    VAL  63           H        VAL  63 -12.890  -7.800  -8.200
  141    H    ALA  64           H        ALA  64 -12.640 -11.360  -5.620
  142    H    CYS  65           H        CYS  65 -13.440  -8.490  -2.350
  143    H    LYS  66           H        LYS  66  -9.700  -8.860   0.420
  144   1HZ   LYS  66           HZ3      LYS  66  -6.220  -7.550   5.560
  145   2HZ   LYS  66           HZ1      LYS  66  -5.800  -6.790   4.170
  146   3HZ   LYS  66           HZ2      LYS  66  -6.480  -5.930   5.380
  147    H    ASN  67           H        ASN  67 -11.880  -9.120   2.540
  148   1HD2  ASN  67           HD2      ASN  67 -14.760  -6.090   3.300
  149   2HD2  ASN  67           HD2      ASN  67 -14.730  -6.850   4.860
  150    H    GLY  68           H        GLY  68 -13.560 -10.570   1.210
  151    H    GLN  69           H        GLN  69 -15.060  -8.660   0.900
  152   1HE2  GLN  69           HE2      GLN  69 -18.830  -4.400  -1.970
  153   2HE2  GLN  69           HE2      GLN  69 -17.340  -4.020  -1.130
  154    H    THR  70           H        THR  70 -18.040  -7.140  -2.310
  155    HG1  THR  70           HG1      THR  70 -20.230  -6.530  -4.530
  156    H    ASN  71           H        ASN  71 -15.790  -5.440  -3.170
  157   1HD2  ASN  71           HD2      ASN  71 -14.610  -1.290  -1.600
  158   2HD2  ASN  71           HD2      ASN  71 -14.970  -0.800  -3.230
  159    H    CYS  72           H        CYS  72 -13.560  -6.010  -5.540
  160    OH   TYR  73           OH       TYR  73 -15.540  -2.360  -8.890
  161    H    TYR  73           H        TYR  73  -9.660  -4.680  -6.580
  162    HH   TYR  73           HH       TYR  73 -15.520  -1.380  -8.600
  163    H    GLN  74           H        GLN  74  -8.960  -7.040 -10.090
  164   1HE2  GLN  74           HE2      GLN  74  -4.460 -12.120 -10.810
  165   2HE2  GLN  74           HE2      GLN  74  -4.040 -10.510 -11.340
  166    H    SER  75           H        SER  75  -4.680  -6.030 -10.490
  167    HG   SER  75           HG       SER  75  -1.540  -5.900 -11.700
  168    OH   TYR  76           OH       TYR  76  -9.650  -8.900 -17.030
  169    H    TYR  76           H        TYR  76  -4.510  -6.630 -15.030
  170    HH   TYR  76           HH       TYR  76 -10.060  -7.980 -16.940
  171    H    SER  77           H        SER  77  -1.830  -6.640 -14.900
  172    HG   SER  77           HG       SER  77   2.590  -5.650 -16.060
  173    H    THR  78           H        THR  78   2.220  -8.200 -13.810
  174    HG1  THR  78           HG1      THR  78   4.470  -7.180 -12.900
  175    H    MET  79           H        MET  79   2.360  -6.280  -9.580
  176    H    SER  80           H        SER  80   4.950  -2.670  -9.450
  177    HG   SER  80           HG       SER  80   8.870  -1.510  -7.540
  178    H    ILE  81           H        ILE  81   5.930  -4.780  -5.670
  179    H    THR  82           H        THR  82   5.320  -2.450  -2.060
  180    HG1  THR  82           HG1      THR  82   8.540  -2.980  -2.590
  181    H    ASP  83           H        ASP  83   6.660  -5.360   0.300
  182    H    CYS  84           H        CYS  84   4.750  -3.830   4.100
  183    NH1  ARG  85           NH2      ARG  85   2.300  -7.570  11.560
  184    NH2  ARG  85           NH1      ARG  85   3.540  -8.750  13.040
  185    H    ARG  85           H        ARG  85   7.470  -5.300   6.840
  186    HE   ARG  85           HE       ARG  85   4.980  -9.260  11.090
  187   1HH1  ARG  85           HH2      ARG  85   2.110  -7.310  10.610
  188   2HH1  ARG  85           HH2      ARG  85   1.660  -7.330  12.290
  189   1HH2  ARG  85           HH1      ARG  85   4.270  -9.400  13.240
  190   2HH2  ARG  85           HH1      ARG  85   2.890  -8.480  13.750
  191    H    GLU  86           H        GLU  86   5.430  -5.260  10.740
  192    H    THR  87           H        THR  87   9.620  -4.800  12.440
  193    HG1  THR  87           HG1      THR  87  12.360  -8.930  11.970
  194    H    GLY  88           H        GLY  88  11.370  -8.060  15.060
  195    H    SER  89           H        SER  89   9.920  -6.220  16.750
  196    HG   SER  89           HG       SER  89  11.790  -4.550  19.320
  197    H    SER  90           H        SER  90   8.000  -3.610  16.620
  198    HG   SER  90           HG       SER  90   5.920  -1.630  16.300
  199    H    LYS  91           H        LYS  91   9.830   0.010  17.790
  200   1HZ   LYS  91           HZ2      LYS  91  12.070  -2.520  21.120
  201   2HZ   LYS  91           HZ3      LYS  91  11.850  -1.780  19.700
  202   3HZ   LYS  91           HZ1      LYS  91  13.350  -1.900  20.320
  203    OH   TYR  92           OH       TYR  92   5.280  10.550  17.840
  204    H    TYR  92           H        TYR  92   7.270   3.070  19.890
  205    HH   TYR  92           HH       TYR  92   4.800  10.570  16.950
  206    H    ASN  94           H        ASN  94  10.840   4.510  17.850
  207   1HD2  ASN  94           HD2      ASN  94  12.940   1.540  19.610
  208   2HD2  ASN  94           HD2      ASN  94  13.550   1.470  17.980
  209    H    CYS  95           H        CYS  95  10.360   3.970  14.470
  210    H    ALA  96           H        ALA  96   9.860  -0.530  14.170
  211    OH   TYR  97           OH       TYR  97   5.570   0.370  11.680
  212    H    TYR  97           H        TYR  97  11.830  -1.610  10.550
  213    HH   TYR  97           HH       TYR  97   4.750  -0.230  11.600
  214    H    LYS  98           H        LYS  98   9.750  -5.240   8.910
  215   1HZ   LYS  98           HZ3      LYS  98  15.790  -8.680   7.930
  216   2HZ   LYS  98           HZ1      LYS  98  16.180  -9.260   6.460
  217   3HZ   LYS  98           HZ2      LYS  98  15.730  -7.700   6.620
  218    H    THR  99           H        THR  99  12.400  -5.620   5.360
  219    HG1  THR  99           HG1      THR  99  12.570  -3.200   5.290
  220    H    THR 100           H        THR 100   9.190  -5.570   2.350
  221    HG1  THR 100           HG1      THR 100   9.900  -8.490   2.910
  222    H    GLN 101           H        GLN 101  11.440  -6.810  -1.010
  223   1HE2  GLN 101           HE2      GLN 101   8.660  -4.110  -6.060
  224   2HE2  GLN 101           HE2      GLN 101   9.610  -5.570  -6.100
  225    H    ALA 102           H        ALA 102   8.060  -6.250  -3.710
  226    H    ASN 103           H        ASN 103   7.730  -9.080  -7.070
  227   1HD2  ASN 103           HD2      ASN 103   8.910  -5.040 -10.290
  228   2HD2  ASN 103           HD2      ASN 103   7.580  -5.930 -11.010
  229    H    LYS 104           H        LYS 104   4.070  -7.480  -7.690
  230   1HZ   LYS 104           HZ2      LYS 104   3.380 -12.160  -1.950
  231   2HZ   LYS 104           HZ3      LYS 104   3.290 -10.690  -1.220
  232   3HZ   LYS 104           HZ1      LYS 104   2.040 -11.250  -2.120
  233    H    HIS 105           H        HIS 105   0.660 -10.120  -8.160
  234    HD1  HIS 105           HD1      HIS 105  -1.740  -9.110 -12.490
  235    HE2  HIS 105           HE2      HIS 105   0.540 -12.450 -12.540
  236    H    ILE 106           H        ILE 106  -2.240  -6.610  -8.860
  237    H    ILE 107           H        ILE 107  -4.060  -6.510  -4.860
  238    H    VAL 108           H        VAL 108  -6.940  -3.910  -6.300
  239    H    ALA 109           H        ALA 109  -8.530  -1.490  -2.870
  240    H    CYS 110           H        CYS 110 -12.340  -1.060  -5.010
  241    H    GLU 111           H        GLU 111 -12.720   3.370  -5.750
  242    H    GLY 112           H        GLY 112 -16.500   5.350  -6.450
  243    H    ASN 113           H        ASN 113 -15.200   9.560  -7.000
  244   1HD2  ASN 113           HD2      ASN 113 -17.710  12.570 -11.470
  245   2HD2  ASN 113           HD2      ASN 113 -17.640  12.640  -9.720
  246    OH   TYR 115           OH       TYR 115 -15.640   0.140  -8.480
  247    H    TYR 115           H        TYR 115 -13.670   7.110 -11.440
  248    HH   TYR 115           HH       TYR 115 -16.540   0.310  -8.070
  249    H    VAL 116           H        VAL 116 -12.110   5.570  -7.710
  250    H    VAL 118           H        VAL 118  -9.730   2.460  -3.370
  251    H    HIS 119           H        HIS 119  -9.020   1.380  -1.720
  252    HD1  HIS 119           HD1      HIS 119  -8.820   2.350   2.600
  253    HE2  HIS 119           HE2      HIS 119 -12.830   1.900   2.400
  254    H    PHE 120           H        PHE 120  -5.590   0.020   0.540
  255    H    ASP 121           H        ASP 121  -5.380  -4.010  -1.500
  256    H    ALA 122           H        ALA 122  -5.260  -6.580  -1.880
  257    H    SER 123           H        SER 123  -1.350  -8.460  -1.360
  258    HG   SER 123           HG       SER 123   0.220  -6.240  -3.470
  259    H    VAL 124           H        VAL 124  -1.160  -9.920  -5.570
   
  Start of MODEL           2
 Raw file had 259 H/Q atoms
  Start of MODEL    2
    1   1H    LYS   1           H2       LYS   1  -9.040  17.560   1.440
    2   2H    LYS   1           H3       LYS   1  -9.340  18.630   2.650
    3   3H    LYS   1           H1       LYS   1  -7.980  17.710   2.680
    4   1HZ   LYS   1           HZ2      LYS   1 -12.960  20.730   2.750
    5   2HZ   LYS   1           HZ3      LYS   1 -11.790  20.110   1.780
    6   3HZ   LYS   1           HZ1      LYS   1 -13.160  20.690   1.130
    7    H    GLU   2           H        GLU   2  -9.300  14.860   4.860
    8    H    THR   3           H        THR   3  -9.580  12.550   1.710
    9    HG1  THR   3           HG1      THR   3 -10.630  12.090  -0.990
   10    H    ALA   4           H        ALA   4 -12.030   8.710   1.640
   11    H    ALA   5           H        ALA   5 -10.500   8.210  -0.960
   12    H    ALA   6           H        ALA   6  -8.210   9.790  -0.190
   13    H    LYS   7           H        LYS   7  -7.250   8.270   1.920
   14   1HZ   LYS   7           HZ2      LYS   7 -10.500   6.630   6.660
   15   2HZ   LYS   7           HZ3      LYS   7 -10.140   7.720   7.840
   16   3HZ   LYS   7           HZ1      LYS   7 -11.180   8.120   6.640
   17    H    PHE   8           H        PHE   8  -6.410   5.750   0.660
   18    H    GLU   9           H        GLU   9  -4.310   7.060  -1.070
   19    NH1  ARG  10           NH2      ARG  10  -2.860   9.140   7.660
   20    NH2  ARG  10           NH1      ARG  10  -4.600   7.790   7.200
   21    H    ARG  10           H        ARG  10  -2.610   8.080   1.180
   22    HE   ARG  10           HE       ARG  10  -2.980   6.560   5.800
   23   1HH1  ARG  10           HH2      ARG  10  -1.880   9.320   7.610
   24   2HH1  ARG  10           HH2      ARG  10  -3.440   9.660   8.280
   25   1HH2  ARG  10           HH1      ARG  10  -4.940   6.910   6.870
   26   2HH2  ARG  10           HH1      ARG  10  -5.150   8.350   7.810
   27    H    GLN  11           H        GLN  11  -1.870   5.670   2.560
   28   1HE2  GLN  11           HE2      GLN  11  -3.770   0.610   5.150
   29   2HE2  GLN  11           HE2      GLN  11  -2.080   1.030   5.110
   30    H    HIS  12           H        HIS  12  -0.640   4.370   0.510
   31    HD1  HIS  12           HD1      HIS  12   0.110   0.030   0.660
   32    HE2  HIS  12           HE2      HIS  12  -3.370   0.930   2.390
   33    H    MET  13           H        MET  13   0.590   5.470  -1.380
   34    H    ASP  14           H        ASP  14   3.810   4.730  -4.420
   35    H    SER  15           H        SER  15   4.560   7.250  -5.370
   36    HG   SER  15           HG       SER  15   2.950   6.750  -7.530
   37    H    SER  16           H        SER  16   7.140   8.530  -5.970
   38    HG   SER  16           HG       SER  16   9.590   8.930  -4.170
   39    H    THR  17           H        THR  17   8.920   6.450  -5.860
   40    HG1  THR  17           HG1      THR  17  10.090   4.710  -3.110
   41    H    SER  18           H        SER  18  11.840   4.100  -8.100
   42    HG   SER  18           HG       SER  18  10.280   0.770 -10.230
   43    H    ALA  19           H        ALA  19  11.810   1.930  -6.430
   44    H    ALA  20           H        ALA  20  11.180  -1.270  -3.730
   45    H    SER  21           H        SER  21  14.660   0.870  -2.280
   46    HG   SER  21           HG       SER  21  17.080   2.860  -1.660
   47    H    SER  22           H        SER  22  15.720  -1.010  -0.440
   48    HG   SER  22           HG       SER  22  17.530   0.700   1.790
   49    H    SER  23           H        SER  23  17.820  -3.920   1.920
   50    HG   SER  23           HG       SER  23  18.210  -4.240   5.280
   51    H    ASN  24           H        ASN  24  16.650  -2.010   3.810
   52   1HD2  ASN  24           HD2      ASN  24  16.100  -3.480   8.690
   53   2HD2  ASN  24           HD2      ASN  24  15.060  -2.150   8.260
   54    OH   TYR  25           OH       TYR  25   9.750   3.910  -1.390
   55    H    TYR  25           H        TYR  25  14.620  -0.880   2.900
   56    HH   TYR  25           HH       TYR  25   8.800   3.580  -1.280
   57    H    CYS  26           H        CYS  26  11.770  -0.490   3.810
   58    H    ASN  27           H        ASN  27  12.380   0.690   6.440
   59   1HD2  ASN  27           HD2      ASN  27  14.460  -0.790  10.540
   60   2HD2  ASN  27           HD2      ASN  27  14.430   0.940  10.690
   61    H    GLN  28           H        GLN  28  12.890   3.670   6.570
   62   1HE2  GLN  28           HE2      GLN  28  15.980   9.150   5.010
   63   2HE2  GLN  28           HE2      GLN  28  14.970   9.560   6.380
   64    H    MET  29           H        MET  29  11.080   4.460   4.980
   65    H    MET  30           H        MET  30   8.490   3.550   6.120
   66    H    LYS  31           H        LYS  31   8.390   5.540   8.130
   67   1HZ   LYS  31           HZ3      LYS  31  10.860   7.090  13.580
   68   2HZ   LYS  31           HZ1      LYS  31   9.610   6.050  13.410
   69   3HZ   LYS  31           HZ2      LYS  31  10.910   5.620  14.300
   70    H    SER  32           H        SER  32   8.420   8.080   7.050
   71    HG   SER  32           HG       SER  32   7.910   9.000   3.790
   72    NH1  ARG  33           NH2      ARG  33   6.540  10.960   2.300
   73    NH2  ARG  33           NH1      ARG  33   7.640   9.750   0.760
   74    H    ARG  33           H        ARG  33   5.840   8.000   5.900
   75    HE   ARG  33           HE       ARG  33   5.830   8.090   1.000
   76   1HH1  ARG  33           HH2      ARG  33   5.710  11.160   2.840
   77   2HH1  ARG  33           HH2      ARG  33   7.280  11.630   2.260
   78   1HH2  ARG  33           HH1      ARG  33   7.700   8.970   0.130
   79   2HH2  ARG  33           HH1      ARG  33   8.340  10.460   0.740
   80    H    ASN  34           H        ASN  34   4.290   9.600   7.880
   81   1HD2  ASN  34           HD2      ASN  34   2.370  12.850   6.900
   82   2HD2  ASN  34           HD2      ASN  34   2.110  11.160   6.570
   83    H    LEU  35           H        LEU  35   2.780   7.020   8.130
   84    H    THR  36           H        THR  36   3.750   6.300  10.790
   85    HG1  THR  36           HG1      THR  36   6.720   6.060  12.110
   86    H    LYS  37           H        LYS  37   2.160   7.330  12.740
   87   1HZ   LYS  37           HZ1      LYS  37  -1.990  11.890  12.120
   88   2HZ   LYS  37           HZ2      LYS  37  -1.920  10.860  10.860
   89   3HZ   LYS  37           HZ3      LYS  37  -3.290  10.950  11.790
   90    H    ASP  38           H        ASP  38   1.590   6.540  15.380
   91    NH1  ARG  39           NH2      ARG  39  -2.530   3.810  19.890
   92    NH2  ARG  39           NH1      ARG  39  -0.820   4.710  21.100
   93    H    ARG  39           H        ARG  39   0.850   4.490  16.420
   94    HE   ARG  39           HE       ARG  39   0.490   2.810  20.170
   95   1HH1  ARG  39           HH2      ARG  39  -2.850   3.060  19.320
   96   2HH1  ARG  39           HH2      ARG  39  -3.150   4.520  20.210
   97   1HH2  ARG  39           HH1      ARG  39   0.140   4.720  21.380
   98   2HH2  ARG  39           HH1      ARG  39  -1.450   5.390  21.450
   99    H    CYS  40           H        CYS  40   4.080   1.570  16.720
  100    H    LYS  41           H        LYS  41   3.100   1.360  12.430
  101   1HZ   LYS  41           HZ3      LYS  41  -1.210   2.260   9.200
  102   2HZ   LYS  41           HZ1      LYS  41  -2.730   1.620   9.180
  103   3HZ   LYS  41           HZ2      LYS  41  -1.700   1.240  10.390
  104    H    VAL  43           H        VAL  43   0.990  -3.740   9.990
  105    H    ASN  44           H        ASN  44   3.060  -3.520   6.420
  106   1HD2  ASN  44           HD2      ASN  44   1.640   1.480   3.540
  107   2HD2  ASN  44           HD2      ASN  44   2.990   0.750   4.330
  108    H    THR  45           H        THR  45   1.040  -1.540   3.080
  109    HG1  THR  45           HG1      THR  45   1.550  -4.870   2.210
  110    H    PHE  46           H        PHE  46   4.540  -1.270   0.680
  111    H    VAL  47           H        VAL  47   3.190   1.670  -2.320
  112    H    HIS  48           H        HIS  48   4.950   0.200  -5.800
  113    HD1  HIS  48           HD1      HIS  48   8.670   3.250  -4.990
  114    HE2  HIS  48           HE2      HIS  48   8.980  -0.050  -2.670
  115    H    GLU  49           H        GLU  49   3.520   3.070  -7.170
  116    H    SER  50           H        SER  50   2.660   5.010 -11.000
  117    HG   SER  50           HG       SER  50   1.530   5.620 -12.570
  118    H    LEU  51           H        LEU  51  -0.300   7.930  -8.790
  119    H    ALA  52           H        ALA  52  -2.060   8.020 -11.270
  120    H    ASP  53           H        ASP  53  -1.140   5.300 -12.370
  121    H    VAL  54           H        VAL  54  -2.570   3.840 -10.590
  122    H    GLN  55           H        GLN  55  -4.980   4.260 -10.240
  123   1HE2  GLN  55           HE2      GLN  55  -8.820   8.640 -11.010
  124   2HE2  GLN  55           HE2      GLN  55  -9.300   6.990 -10.670
  125    H    ALA  56           H        ALA  56  -5.340   3.000 -12.860
  126    H    VAL  57           H        VAL  57  -5.910   0.350 -11.580
  127    H    CYS  58           H        CYS  58  -8.180   0.030 -11.030
  128    H    SER  59           H        SER  59  -9.540  -0.910 -13.310
  129    HG   SER  59           HG       SER  59 -12.410   0.360 -14.030
  130    H    GLN  60           H        GLN  60  -9.550  -3.490 -13.430
  131   1HE2  GLN  60           HE2      GLN  60  -4.020  -2.680 -15.510
  132   2HE2  GLN  60           HE2      GLN  60  -5.610  -1.950 -15.520
  133    H    LYS  61           H        LYS  61  -8.990  -6.470 -12.950
  134   1HZ   LYS  61           HZ2      LYS  61  -7.310 -13.240 -11.170
  135   2HZ   LYS  61           HZ3      LYS  61  -8.210 -14.570 -11.550
  136   3HZ   LYS  61           HZ1      LYS  61  -7.390 -13.770 -12.710
  137    H    ASN  62           H        ASN  62 -12.830  -8.390 -12.460
  138   1HD2  ASN  62           HD2      ASN  62 -15.450  -7.050  -7.390
  139   2HD2  ASN  62           HD2      ASN  62 -14.020  -6.480  -8.210
  140    H    VAL  63           H        VAL  63 -12.770  -8.120  -7.920
  141    H    ALA  64           H        ALA  64 -12.140 -11.470  -5.180
  142    H    CYS  65           H        CYS  65 -13.250  -8.620  -1.980
  143    H    LYS  66           H        LYS  66  -9.550  -8.800   0.840
  144   1HZ   LYS  66           HZ2      LYS  66  -5.920 -11.530   2.900
  145   2HZ   LYS  66           HZ3      LYS  66  -4.450 -11.640   2.170
  146   3HZ   LYS  66           HZ1      LYS  66  -4.580 -11.190   3.750
  147    H    ASN  67           H        ASN  67 -11.720  -8.740   3.050
  148   1HD2  ASN  67           HD2      ASN  67 -14.220  -5.410   3.770
  149   2HD2  ASN  67           HD2      ASN  67 -14.270  -6.210   5.300
  150    H    GLY  68           H        GLY  68 -13.440 -10.360   1.690
  151    H    GLN  69           H        GLN  69 -14.910  -8.410   1.070
  152   1HE2  GLN  69           HE2      GLN  69 -19.900  -5.510  -1.490
  153   2HE2  GLN  69           HE2      GLN  69 -19.690  -6.360   0.020
  154    H    THR  70           H        THR  70 -17.810  -6.930  -2.240
  155    HG1  THR  70           HG1      THR  70 -19.200  -6.220  -5.000
  156    H    ASN  71           H        ASN  71 -15.460  -5.660  -3.140
  157   1HD2  ASN  71           HD2      ASN  71 -14.570  -1.290  -1.540
  158   2HD2  ASN  71           HD2      ASN  71 -15.100  -0.840  -3.150
  159    H    CYS  72           H        CYS  72 -13.350  -6.280  -5.320
  160    OH   TYR  73           OH       TYR  73 -15.450  -2.510  -8.910
  161    H    TYR  73           H        TYR  73  -9.520  -4.820  -6.510
  162    HH   TYR  73           HH       TYR  73 -16.050  -3.140  -9.410
  163    H    GLN  74           H        GLN  74  -8.790  -7.260  -9.930
  164   1HE2  GLN  74           HE2      GLN  74  -4.380 -12.350 -10.690
  165   2HE2  GLN  74           HE2      GLN  74  -3.990 -10.780 -11.370
  166    H    SER  75           H        SER  75  -4.530  -6.100 -10.420
  167    HG   SER  75           HG       SER  75  -1.380  -5.790 -11.920
  168    OH   TYR  76           OH       TYR  76  -9.740  -9.160 -16.730
  169    H    TYR  76           H        TYR  76  -4.560  -6.710 -14.970
  170    HH   TYR  76           HH       TYR  76 -10.150  -8.240 -16.660
  171    H    SER  77           H        SER  77  -1.840  -6.640 -14.930
  172    HG   SER  77           HG       SER  77   2.460  -5.770 -16.560
  173    H    THR  78           H        THR  78   2.290  -8.150 -13.900
  174    HG1  THR  78           HG1      THR  78   4.640  -7.220 -13.120
  175    H    MET  79           H        MET  79   2.470  -6.180  -9.670
  176    H    SER  80           H        SER  80   4.900  -2.450  -9.650
  177    HG   SER  80           HG       SER  80   8.740  -1.020  -7.680
  178    H    ILE  81           H        ILE  81   5.980  -4.520  -5.880
  179    H    THR  82           H        THR  82   5.430  -2.230  -2.210
  180    HG1  THR  82           HG1      THR  82   8.680  -2.600  -2.740
  181    H    ASP  83           H        ASP  83   7.000  -5.180   0.100
  182    H    CYS  84           H        CYS  84   5.110  -3.640   3.810
  183    NH1  ARG  85           NH2      ARG  85   6.870 -10.520  11.100
  184    NH2  ARG  85           NH1      ARG  85   4.870 -11.600  11.150
  185    H    ARG  85           H        ARG  85   7.820  -5.170   6.730
  186    HE   ARG  85           HE       ARG  85   4.520 -10.650   8.910
  187   1HH1  ARG  85           HH2      ARG  85   7.500  -9.880  10.650
  188   2HH1  ARG  85           HH2      ARG  85   7.080 -10.870  12.010
  189   1HH2  ARG  85           HH1      ARG  85   4.010 -11.870  10.730
  190   2HH2  ARG  85           HH1      ARG  85   5.100 -11.910  12.070
  191    H    GLU  86           H        GLU  86   5.700  -5.370  10.620
  192    H    THR  87           H        THR  87   9.880  -4.720  12.310
  193    HG1  THR  87           HG1      THR  87  13.380  -8.030  11.760
  194    H    GLY  88           H        GLY  88  12.380  -7.820  14.570
  195    H    SER  89           H        SER  89  13.430  -5.380  15.740
  196    HG   SER  89           HG       SER  89  14.740  -1.700  17.260
  197    H    SER  90           H        SER  90  10.940  -3.820  17.000
  198    HG   SER  90           HG       SER  90   7.680  -1.440  15.210
  199    H    LYS  91           H        LYS  91  10.550   0.260  17.770
  200   1HZ   LYS  91           HZ2      LYS  91   8.540   3.240  23.380
  201   2HZ   LYS  91           HZ3      LYS  91   7.370   2.930  24.490
  202   3HZ   LYS  91           HZ1      LYS  91   8.960   2.810  24.900
  203    OH   TYR  92           OH       TYR  92   4.370   9.240  18.820
  204    H    TYR  92           H        TYR  92   7.120   1.730  19.400
  205    HH   TYR  92           HH       TYR  92   3.870   9.320  17.940
  206    H    ASN  94           H        ASN  94  10.920   4.180  18.430
  207   1HD2  ASN  94           HD2      ASN  94  13.680   3.290  20.170
  208   2HD2  ASN  94           HD2      ASN  94  12.980   2.270  18.930
  209    H    CYS  95           H        CYS  95  10.110   3.790  14.830
  210    H    ALA  96           H        ALA  96  10.230  -0.610  13.880
  211    OH   TYR  97           OH       TYR  97   5.600   0.070  11.510
  212    H    TYR  97           H        TYR  97  12.200  -1.290  10.080
  213    HH   TYR  97           HH       TYR  97   4.830  -0.590  11.360
  214    H    LYS  98           H        LYS  98  10.130  -4.960   8.800
  215   1HZ   LYS  98           HZ3      LYS  98  10.250 -11.080   9.280
  216   2HZ   LYS  98           HZ1      LYS  98  11.580 -11.830   8.700
  217   3HZ   LYS  98           HZ2      LYS  98  11.520 -11.390  10.270
  218    H    THR  99           H        THR  99  12.650  -5.430   5.160
  219    HG1  THR  99           HG1      THR  99  12.470  -3.010   5.270
  220    H    THR 100           H        THR 100   9.490  -5.380   2.120
  221    HG1  THR 100           HG1      THR 100  10.520  -8.270   2.400
  222    H    GLN 101           H        GLN 101  11.760  -6.400  -1.370
  223   1HE2  GLN 101           HE2      GLN 101   8.690  -3.560  -6.280
  224   2HE2  GLN 101           HE2      GLN 101   9.580  -5.040  -6.430
  225    H    ALA 102           H        ALA 102   8.290  -5.950  -3.980
  226    H    ASN 103           H        ASN 103   7.970  -8.760  -7.330
  227   1HD2  ASN 103           HD2      ASN 103   9.060  -4.920 -10.790
  228   2HD2  ASN 103           HD2      ASN 103   7.930  -6.000 -11.560
  229    H    LYS 104           H        LYS 104   4.210  -7.190  -7.870
  230   1HZ   LYS 104           HZ1      LYS 104   3.660 -13.050  -4.680
  231   2HZ   LYS 104           HZ2      LYS 104   5.260 -13.000  -5.010
  232   3HZ   LYS 104           HZ3      LYS 104   4.720 -13.630  -3.600
  233    H    HIS 105           H        HIS 105   0.810  -9.900  -8.180
  234    HD1  HIS 105           HD1      HIS 105  -1.460  -9.160 -12.590
  235    HE2  HIS 105           HE2      HIS 105   0.860 -12.470 -12.350
  236    H    ILE 106           H        ILE 106  -2.080  -6.440  -9.000
  237    H    ILE 107           H        ILE 107  -3.840  -6.420  -4.940
  238    H    VAL 108           H        VAL 108  -6.860  -3.970  -6.200
  239    H    ALA 109           H        ALA 109  -8.420  -1.600  -2.710
  240    H    CYS 110           H        CYS 110 -12.270  -1.270  -4.790
  241    H    GLU 111           H        GLU 111 -12.880   3.120  -5.620
  242    H    GLY 112           H        GLY 112 -16.730   5.010  -6.150
  243    H    ASN 113           H        ASN 113 -15.510   9.190  -7.010
  244   1HD2  ASN 113           HD2      ASN 113 -18.350  12.230 -11.220
  245   2HD2  ASN 113           HD2      ASN 113 -18.640  11.950  -9.520
  246    OH   TYR 115           OH       TYR 115 -16.170  -0.040  -8.280
  247    H    TYR 115           H        TYR 115 -13.660   6.750 -11.390
  248    HH   TYR 115           HH       TYR 115 -15.680  -0.900  -8.510
  249    H    VAL 116           H        VAL 116 -12.170   5.320  -7.620
  250    H    VAL 118           H        VAL 118  -9.730   2.340  -3.290
  251    H    HIS 119           H        HIS 119  -8.800   1.260  -1.620
  252    HD1  HIS 119           HD1      HIS 119  -8.620   2.450   2.690
  253    HE2  HIS 119           HE2      HIS 119 -12.580   1.630   2.780
  254    H    PHE 120           H        PHE 120  -5.470  -0.260   0.790
  255    H    ASP 121           H        ASP 121  -5.260  -4.130  -1.460
  256    H    ALA 122           H        ALA 122  -5.120  -6.750  -1.890
  257    H    SER 123           H        SER 123  -1.050  -8.420  -1.550
  258    HG   SER 123           HG       SER 123   1.500  -9.100  -2.120
  259    H    VAL 124           H        VAL 124  -1.080  -9.830  -5.690
   
  Start of MODEL           3
 Raw file had 259 H/Q atoms
  Start of MODEL    3
    1   1H    LYS   1           H1       LYS   1  -8.700  18.140   0.770
    2   2H    LYS   1           H2       LYS   1  -9.440  19.160   1.810
    3   3H    LYS   1           H3       LYS   1  -8.320  18.080   2.360
    4   1HZ   LYS   1           HZ3      LYS   1 -15.400  17.580   2.200
    5   2HZ   LYS   1           HZ1      LYS   1 -14.950  16.600   0.970
    6   3HZ   LYS   1           HZ2      LYS   1 -16.090  16.080   2.030
    7    H    GLU   2           H        GLU   2 -10.610  15.340   3.430
    8    H    THR   3           H        THR   3  -9.890  12.830   0.360
    9    HG1  THR   3           HG1      THR   3  -9.980  12.190  -2.520
   10    H    ALA   4           H        ALA   4 -12.600   9.170   0.070
   11    H    ALA   5           H        ALA   5 -10.610   8.260  -1.960
   12    H    ALA   6           H        ALA   6  -8.430   9.710  -0.700
   13    H    LYS   7           H        LYS   7  -7.650   8.230   1.390
   14   1HZ   LYS   7           HZ1      LYS   7 -10.680   5.550   6.480
   15   2HZ   LYS   7           HZ2      LYS   7 -10.360   4.020   6.010
   16   3HZ   LYS   7           HZ3      LYS   7 -10.110   4.480   7.580
   17    H    PHE   8           H        PHE   8  -6.780   5.610   0.500
   18    H    GLU   9           H        GLU   9  -4.610   7.000  -1.040
   19    NH1  ARG  10           NH2      ARG  10  -3.700  10.960   6.040
   20    NH2  ARG  10           NH1      ARG  10  -5.400   9.730   5.240
   21    H    ARG  10           H        ARG  10  -2.880   8.060   1.240
   22    HE   ARG  10           HE       ARG  10  -3.790   8.680   4.520
   23   1HH1  ARG  10           HH2      ARG  10  -3.100  10.860   5.240
   24   2HH1  ARG  10           HH2      ARG  10  -3.020  11.080   6.760
   25   1HH2  ARG  10           HH1      ARG  10  -5.850   8.860   5.030
   26   2HH2  ARG  10           HH1      ARG  10  -5.940  10.560   5.270
   27    H    GLN  11           H        GLN  11  -2.160   5.690   2.740
   28   1HE2  GLN  11           HE2      GLN  11  -4.110   0.770   5.650
   29   2HE2  GLN  11           HE2      GLN  11  -2.480   1.360   5.840
   30    H    HIS  12           H        HIS  12  -0.900   4.380   0.690
   31    HD1  HIS  12           HD1      HIS  12  -0.100   0.000   0.910
   32    HE2  HIS  12           HE2      HIS  12  -3.650   0.790   2.560
   33    H    MET  13           H        MET  13   0.290   5.450  -1.180
   34    H    ASP  14           H        ASP  14   3.630   4.750  -4.160
   35    H    SER  15           H        SER  15   4.430   7.160  -5.130
   36    HG   SER  15           HG       SER  15   5.730   8.100  -9.030
   37    H    SER  16           H        SER  16   6.980   8.800  -5.330
   38    HG   SER  16           HG       SER  16   9.400   8.720  -3.250
   39    H    THR  17           H        THR  17   8.880   6.720  -5.270
   40    HG1  THR  17           HG1      THR  17  10.080   4.780  -2.640
   41    H    SER  18           H        SER  18  11.680   4.470  -7.650
   42    HG   SER  18           HG       SER  18  10.240   1.120  -9.720
   43    H    ALA  19           H        ALA  19  11.640   2.190  -6.010
   44    H    ALA  20           H        ALA  20  11.080  -1.150  -3.470
   45    H    SER  21           H        SER  21  14.540   1.040  -2.300
   46    HG   SER  21           HG       SER  21  16.890   3.090  -1.940
   47    H    SER  22           H        SER  22  15.450  -0.780  -0.310
   48    HG   SER  22           HG       SER  22  18.930  -0.730   3.060
   49    H    SER  23           H        SER  23  17.510  -3.790   1.790
   50    HG   SER  23           HG       SER  23  18.360  -6.560   2.740
   51    H    ASN  24           H        ASN  24  16.590  -1.980   4.050
   52   1HD2  ASN  24           HD2      ASN  24  15.590  -3.860   8.550
   53   2HD2  ASN  24           HD2      ASN  24  14.530  -2.690   7.830
   54    OH   TYR  25           OH       TYR  25   9.680   4.020  -1.060
   55    H    TYR  25           H        TYR  25  14.380  -0.990   3.180
   56    HH   TYR  25           HH       TYR  25   8.710   3.760  -0.890
   57    H    CYS  26           H        CYS  26  11.570  -0.560   4.090
   58    H    ASN  27           H        ASN  27  12.100   0.560   6.650
   59   1HD2  ASN  27           HD2      ASN  27  14.740  -1.310   9.750
   60   2HD2  ASN  27           HD2      ASN  27  14.520   0.260  10.470
   61    H    GLN  28           H        GLN  28  12.880   3.490   6.870
   62   1HE2  GLN  28           HE2      GLN  28  13.420   8.280   9.680
   63   2HE2  GLN  28           HE2      GLN  28  12.330   8.290   8.320
   64    H    MET  29           H        MET  29  11.130   4.360   5.210
   65    H    MET  30           H        MET  30   8.500   3.740   6.050
   66    H    LYS  31           H        LYS  31   8.360   5.880   8.030
   67   1HZ   LYS  31           HZ3      LYS  31   9.620   7.260  13.240
   68   2HZ   LYS  31           HZ1      LYS  31   9.280   5.680  13.270
   69   3HZ   LYS  31           HZ2      LYS  31  10.460   6.280  14.250
   70    H    SER  32           H        SER  32   8.030   8.310   6.650
   71    HG   SER  32           HG       SER  32   6.760  11.820   4.520
   72    NH1  ARG  33           NH2      ARG  33   6.200   9.990   1.340
   73    NH2  ARG  33           NH1      ARG  33   5.420   9.110  -0.610
   74    H    ARG  33           H        ARG  33   5.300   8.370   5.630
   75    HE   ARG  33           HE       ARG  33   4.290   7.460   0.830
   76   1HH1  ARG  33           HH2      ARG  33   6.240   9.980   2.340
   77   2HH1  ARG  33           HH2      ARG  33   6.690  10.690   0.820
   78   1HH2  ARG  33           HH1      ARG  33   4.870   8.430  -1.100
   79   2HH2  ARG  33           HH1      ARG  33   5.910   9.820  -1.110
   80    H    ASN  34           H        ASN  34   4.130   9.730   8.000
   81   1HD2  ASN  34           HD2      ASN  34   2.940  13.390   8.350
   82   2HD2  ASN  34           HD2      ASN  34   2.220  12.020   7.530
   83    H    LEU  35           H        LEU  35   3.070   7.150   8.480
   84    H    THR  36           H        THR  36   4.240   6.270  10.670
   85    HG1  THR  36           HG1      THR  36   6.210   7.060  12.370
   86    H    LYS  37           H        LYS  37   2.590   5.860  14.520
   87   1HZ   LYS  37           HZ1      LYS  37   0.780  12.670  13.670
   88   2HZ   LYS  37           HZ2      LYS  37   1.350  14.010  14.400
   89   3HZ   LYS  37           HZ3      LYS  37   2.260  13.210  13.300
   90    H    ASP  38           H        ASP  38   4.010   7.580  16.850
   91    NH1  ARG  39           NH2      ARG  39  -1.780   3.630  19.900
   92    NH2  ARG  39           NH1      ARG  39  -0.590   3.730  21.830
   93    H    ARG  39           H        ARG  39   2.440   5.190  17.390
   94    HE   ARG  39           HE       ARG  39   1.130   2.490  20.470
   95   1HH1  ARG  39           HH2      ARG  39  -1.800   3.340  18.950
   96   2HH1  ARG  39           HH2      ARG  39  -2.520   4.150  20.310
   97   1HH2  ARG  39           HH1      ARG  39   0.270   3.630  22.320
   98   2HH2  ARG  39           HH1      ARG  39  -1.350   4.230  22.220
   99    H    CYS  40           H        CYS  40   4.800   1.470  16.990
  100    H    LYS  41           H        LYS  41   3.840   1.540  12.550
  101   1HZ   LYS  41           HZ3      LYS  41  -0.840   2.550   7.830
  102   2HZ   LYS  41           HZ1      LYS  41  -0.770   1.380   6.700
  103   3HZ   LYS  41           HZ2      LYS  41  -2.200   1.720   7.460
  104    H    VAL  43           H        VAL  43   0.880  -3.130  10.260
  105    H    ASN  44           H        ASN  44   2.780  -3.510   6.580
  106   1HD2  ASN  44           HD2      ASN  44   1.810   2.000   4.020
  107   2HD2  ASN  44           HD2      ASN  44   2.980   1.490   5.220
  108    H    THR  45           H        THR  45   0.870  -1.560   3.220
  109    HG1  THR  45           HG1      THR  45   1.290  -5.030   2.260
  110    H    PHE  46           H        PHE  46   4.400  -1.170   0.920
  111    H    VAL  47           H        VAL  47   2.850   1.710  -2.060
  112    H    HIS  48           H        HIS  48   4.840   0.440  -5.480
  113    HD1  HIS  48           HD1      HIS  48   8.560   3.450  -4.590
  114    HE2  HIS  48           HE2      HIS  48   8.860   0.100  -2.340
  115    H    GLU  49           H        GLU  49   3.310   3.180  -6.680
  116    H    SER  50           H        SER  50   2.730   5.640 -10.310
  117    HG   SER  50           HG       SER  50   1.090   5.830 -11.770
  118    H    LEU  51           H        LEU  51  -0.750   8.100  -8.340
  119    H    ALA  52           H        ALA  52  -2.320   8.140 -10.780
  120    H    ASP  53           H        ASP  53  -1.260   5.720 -12.200
  121    H    VAL  54           H        VAL  54  -2.730   4.050 -10.470
  122    H    GLN  55           H        GLN  55  -5.360   4.250  -9.840
  123   1HE2  GLN  55           HE2      GLN  55  -8.640   8.570 -11.770
  124   2HE2  GLN  55           HE2      GLN  55  -9.230   7.000 -11.260
  125    H    ALA  56           H        ALA  56  -5.220   2.920 -12.690
  126    H    VAL  57           H        VAL  57  -5.820   0.300 -11.540
  127    H    CYS  58           H        CYS  58  -8.030  -0.060 -11.080
  128    H    SER  59           H        SER  59  -9.210  -0.940 -13.400
  129    HG   SER  59           HG       SER  59  -9.050  -0.740 -16.430
  130    H    GLN  60           H        GLN  60  -9.230  -3.560 -13.640
  131   1HE2  GLN  60           HE2      GLN  60  -3.570  -3.150 -15.330
  132   2HE2  GLN  60           HE2      GLN  60  -5.050  -2.210 -15.290
  133    H    LYS  61           H        LYS  61  -8.760  -6.510 -13.140
  134   1HZ   LYS  61           HZ2      LYS  61  -7.950 -13.200 -11.430
  135   2HZ   LYS  61           HZ3      LYS  61  -8.940 -14.490 -11.770
  136   3HZ   LYS  61           HZ1      LYS  61  -7.820 -13.980 -12.870
  137    H    ASN  62           H        ASN  62 -12.650  -8.360 -12.770
  138   1HD2  ASN  62           HD2      ASN  62 -15.210  -7.380  -7.640
  139   2HD2  ASN  62           HD2      ASN  62 -13.980  -6.560  -8.550
  140    H    VAL  63           H        VAL  63 -12.640  -8.310  -8.230
  141    H    ALA  64           H        ALA  64 -12.230 -11.700  -5.500
  142    H    CYS  65           H        CYS  65 -13.330  -8.910  -2.220
  143    H    LYS  66           H        LYS  66  -9.480  -9.170   0.420
  144   1HZ   LYS  66           HZ2      LYS  66  -7.680 -14.130   1.570
  145   2HZ   LYS  66           HZ3      LYS  66  -8.180 -14.150   0.010
  146   3HZ   LYS  66           HZ1      LYS  66  -6.880 -15.030   0.480
  147    H    ASN  67           H        ASN  67 -11.400  -9.180   2.780
  148   1HD2  ASN  67           HD2      ASN  67 -14.270  -5.970   3.380
  149   2HD2  ASN  67           HD2      ASN  67 -13.940  -6.600   4.950
  150    H    GLY  68           H        GLY  68 -13.360 -10.650   1.360
  151    H    GLN  69           H        GLN  69 -14.940  -8.700   0.940
  152   1HE2  GLN  69           HE2      GLN  69 -15.840  -2.750   1.320
  153   2HE2  GLN  69           HE2      GLN  69 -15.830  -3.530  -0.250
  154    H    THR  70           H        THR  70 -17.890  -7.240  -2.320
  155    HG1  THR  70           HG1      THR  70 -19.420  -6.420  -5.170
  156    H    ASN  71           H        ASN  71 -15.790  -5.660  -3.280
  157   1HD2  ASN  71           HD2      ASN  71 -14.980  -1.380  -2.010
  158   2HD2  ASN  71           HD2      ASN  71 -15.090  -1.110  -3.730
  159    H    CYS  72           H        CYS  72 -13.390  -6.430  -5.530
  160    OH   TYR  73           OH       TYR  73 -15.350  -2.550  -9.670
  161    H    TYR  73           H        TYR  73  -9.500  -4.940  -6.570
  162    HH   TYR  73           HH       TYR  73 -15.830  -2.990 -10.430
  163    H    GLN  74           H        GLN  74  -8.680  -7.360 -10.010
  164   1HE2  GLN  74           HE2      GLN  74  -4.070 -12.190 -11.090
  165   2HE2  GLN  74           HE2      GLN  74  -3.760 -10.540 -11.560
  166    H    SER  75           H        SER  75  -4.350  -6.260 -10.510
  167    HG   SER  75           HG       SER  75  -1.410  -5.950 -11.780
  168    OH   TYR  76           OH       TYR  76  -9.390  -9.260 -16.940
  169    H    TYR  76           H        TYR  76  -4.290  -6.730 -15.070
  170    HH   TYR  76           HH       TYR  76  -9.800  -8.350 -16.840
  171    H    SER  77           H        SER  77  -1.670  -6.530 -15.130
  172    HG   SER  77           HG       SER  77   0.270  -4.120 -14.640
  173    H    THR  78           H        THR  78   2.500  -7.840 -13.840
  174    HG1  THR  78           HG1      THR  78   4.890  -6.860 -12.790
  175    H    MET  79           H        MET  79   2.510  -6.090  -9.540
  176    H    SER  80           H        SER  80   4.730  -2.190  -9.420
  177    HG   SER  80           HG       SER  80   8.635  -0.664  -7.918
  178    H    ILE  81           H        ILE  81   5.720  -4.350  -5.840
  179    H    THR  82           H        THR  82   5.330  -2.120  -2.050
  180    HG1  THR  82           HG1      THR  82   8.430  -2.430  -2.640
  181    H    ASP  83           H        ASP  83   6.750  -5.070   0.140
  182    H    CYS  84           H        CYS  84   4.860  -3.810   4.030
  183    NH1  ARG  85           NH2      ARG  85   5.000  -8.730  12.530
  184    NH2  ARG  85           NH1      ARG  85   3.030  -9.820  12.300
  185    H    ARG  85           H        ARG  85   7.530  -5.420   6.750
  186    HE   ARG  85           HE       ARG  85   3.520  -9.700   9.860
  187   1HH1  ARG  85           HH2      ARG  85   5.800  -8.290  12.120
  188   2HH1  ARG  85           HH2      ARG  85   4.870  -8.720  13.520
  189   1HH2  ARG  85           HH1      ARG  85   2.320 -10.230  11.740
  190   2HH2  ARG  85           HH1      ARG  85   2.930  -9.790  13.290
  191    H    GLU  86           H        GLU  86   5.400  -4.970  10.540
  192    H    THR  87           H        THR  87   9.480  -4.670  12.630
  193    HG1  THR  87           HG1      THR  87  11.310  -4.230  13.520
  194    H    GLY  88           H        GLY  88  10.250  -8.540  15.200
  195    H    SER  89           H        SER  89  11.950  -6.620  16.570
  196    HG   SER  89           HG       SER  89  14.130  -5.000  16.120
  197    H    SER  90           H        SER  90  10.100  -4.140  17.510
  198    HG   SER  90           HG       SER  90   8.340  -0.950  15.240
  199    H    LYS  91           H        LYS  91  11.280  -0.090  17.630
  200   1HZ   LYS  91           HZ3      LYS  91  15.050  -1.480  19.340
  201   2HZ   LYS  91           HZ1      LYS  91  14.410  -2.690  20.240
  202   3HZ   LYS  91           HZ2      LYS  91  13.690  -2.240  18.850
  203    OH   TYR  92           OH       TYR  92   5.880   9.450  16.460
  204    H    TYR  92           H        TYR  92   8.640   2.670  19.950
  205    HH   TYR  92           HH       TYR  92   6.150  10.290  16.940
  206    H    ASN  94           H        ASN  94  11.840   3.970  17.630
  207   1HD2  ASN  94           HD2      ASN  94  16.350   5.780  17.490
  208   2HD2  ASN  94           HD2      ASN  94  16.190   4.760  16.080
  209    H    CYS  95           H        CYS  95  11.310   3.670  14.180
  210    H    ALA  96           H        ALA  96  10.790  -0.790  13.830
  211    OH   TYR  97           OH       TYR  97   5.760   0.100  11.630
  212    H    TYR  97           H        TYR  97  12.270  -1.850   9.960
  213    HH   TYR  97           HH       TYR  97   4.960  -0.520  11.480
  214    H    LYS  98           H        LYS  98   9.790  -5.370   8.860
  215   1HZ   LYS  98           HZ3      LYS  98   8.270 -10.250  10.190
  216   2HZ   LYS  98           HZ1      LYS  98   8.650 -10.020  11.770
  217   3HZ   LYS  98           HZ2      LYS  98   8.670  -8.760  10.740
  218    H    THR  99           H        THR  99  12.300  -5.390   5.410
  219    HG1  THR  99           HG1      THR  99  12.210  -3.080   5.590
  220    H    THR 100           H        THR 100   9.290  -5.390   2.190
  221    HG1  THR 100           HG1      THR 100  10.220  -8.230   2.570
  222    H    GLN 101           H        GLN 101  11.640  -6.120  -1.250
  223   1HE2  GLN 101           HE2      GLN 101   8.520  -3.950  -6.310
  224   2HE2  GLN 101           HE2      GLN 101   9.840  -5.050  -6.430
  225    H    ALA 102           H        ALA 102   8.160  -5.850  -3.880
  226    H    ASN 103           H        ASN 103   8.230  -8.330  -7.430
  227   1HD2  ASN 103           HD2      ASN 103   8.890  -4.290 -10.530
  228   2HD2  ASN 103           HD2      ASN 103   7.760  -5.290 -11.410
  229    H    LYS 104           H        LYS 104   4.300  -7.120  -7.760
  230   1HZ   LYS 104           HZ3      LYS 104   3.260 -11.450  -2.320
  231   2HZ   LYS 104           HZ1      LYS 104   2.990 -13.010  -2.730
  232   3HZ   LYS 104           HZ2      LYS 104   4.430 -12.580  -2.080
  233    H    HIS 105           H        HIS 105   0.970  -9.860  -8.080
  234    HD1  HIS 105           HD1      HIS 105  -1.380  -9.040 -12.480
  235    HE2  HIS 105           HE2      HIS 105   1.080 -12.240 -12.310
  236    H    ILE 106           H        ILE 106  -2.000  -6.430  -8.780
  237    H    ILE 107           H        ILE 107  -3.910  -6.560  -4.820
  238    H    VAL 108           H        VAL 108  -6.770  -4.050  -6.300
  239    H    ALA 109           H        ALA 109  -8.440  -1.760  -2.810
  240    H    CYS 110           H        CYS 110 -12.240  -1.580  -5.010
  241    H    GLU 111           H        GLU 111 -12.690   2.820  -5.910
  242    H    GLY 112           H        GLY 112 -16.420   4.980  -6.140
  243    H    ASN 113           H        ASN 113 -15.530   9.190  -7.110
  244   1HD2  ASN 113           HD2      ASN 113 -18.620  12.100 -11.140
  245   2HD2  ASN 113           HD2      ASN 113 -18.550  11.960  -9.400
  246    OH   TYR 115           OH       TYR 115 -15.990  -0.100  -8.520
  247    H    TYR 115           H        TYR 115 -13.790   6.670 -11.590
  248    HH   TYR 115           HH       TYR 115 -15.530  -0.960  -8.840
  249    H    VAL 116           H        VAL 116 -12.030   4.930  -7.920
  250    H    VAL 118           H        VAL 118  -9.790   2.170  -3.550
  251    H    HIS 119           H        HIS 119  -9.060   1.140  -1.780
  252    HD1  HIS 119           HD1      HIS 119  -8.850   2.420   2.570
  253    HE2  HIS 119           HE2      HIS 119 -12.850   2.060   2.140
  254    H    PHE 120           H        PHE 120  -5.720  -0.190   0.750
  255    H    ASP 121           H        ASP 121  -5.350  -4.140  -1.410
  256    H    ALA 122           H        ALA 122  -5.160  -6.790  -1.890
  257    H    SER 123           H        SER 123  -1.100  -8.490  -1.400
  258    HG   SER 123           HG       SER 123   1.490  -6.240  -2.950
  259    H    VAL 124           H        VAL 124  -0.820  -9.830  -5.630
   
  Start of MODEL           4
 Raw file had 259 H/Q atoms
  Start of MODEL    4
    1   1H    LYS   1           H2       LYS   1 -10.410  16.810   0.540
    2   2H    LYS   1           H3       LYS   1 -10.700  18.070   1.540
    3   3H    LYS   1           H1       LYS   1  -9.190  17.420   1.430
    4   1HZ   LYS   1           HZ2      LYS   1 -16.310  16.620   1.260
    5   2HZ   LYS   1           HZ3      LYS   1 -16.690  15.460   0.130
    6   3HZ   LYS   1           HZ1      LYS   1 -16.260  15.030   1.670
    7    H    GLU   2           H        GLU   2  -9.920  14.900   4.390
    8    H    THR   3           H        THR   3 -10.180  12.080   1.650
    9    HG1  THR   3           HG1      THR   3 -11.210  11.990  -0.520
   10    H    ALA   4           H        ALA   4 -12.330   8.110   1.960
   11    H    ALA   5           H        ALA   5 -10.760   7.710  -0.690
   12    H    ALA   6           H        ALA   6  -8.550   9.400   0.100
   13    H    LYS   7           H        LYS   7  -7.480   7.990   2.200
   14   1HZ   LYS   7           HZ2      LYS   7  -9.810   4.730   6.960
   15   2HZ   LYS   7           HZ3      LYS   7  -8.600   3.990   7.790
   16   3HZ   LYS   7           HZ1      LYS   7  -9.260   5.390   8.330
   17    H    PHE   8           H        PHE   8  -6.580   5.510   0.900
   18    H    GLU   9           H        GLU   9  -4.540   6.930  -0.810
   19    NH1  ARG  10           NH2      ARG  10  -3.360  10.500   7.770
   20    NH2  ARG  10           NH1      ARG  10  -5.120   9.070   7.320
   21    H    ARG  10           H        ARG  10  -2.810   7.970   1.450
   22    HE   ARG  10           HE       ARG  10  -3.740   8.250   5.610
   23   1HH1  ARG  10           HH2      ARG  10  -2.430  10.760   7.510
   24   2HH1  ARG  10           HH2      ARG  10  -3.820  10.910   8.550
   25   1HH2  ARG  10           HH1      ARG  10  -5.490   8.320   6.780
   26   2HH2  ARG  10           HH1      ARG  10  -5.630   9.450   8.090
   27    H    GLN  11           H        GLN  11  -2.070   5.560   2.850
   28   1HE2  GLN  11           HE2      GLN  11  -3.900   0.370   5.310
   29   2HE2  GLN  11           HE2      GLN  11  -2.230   0.860   5.220
   30    H    HIS  12           H        HIS  12  -0.820   4.320   0.780
   31    HD1  HIS  12           HD1      HIS  12  -0.130  -0.070   0.830
   32    HE2  HIS  12           HE2      HIS  12  -3.670   0.730   2.510
   33    H    MET  13           H        MET  13   0.470   5.430  -0.950
   34    H    ASP  14           H        ASP  14   3.760   4.700  -3.940
   35    H    SER  15           H        SER  15   4.570   7.350  -4.660
   36    HG   SER  15           HG       SER  15   3.070   6.840  -6.900
   37    H    SER  16           H        SER  16   7.140   8.670  -5.070
   38    HG   SER  16           HG       SER  16   9.690   8.600  -3.350
   39    H    THR  17           H        THR  17   8.880   6.530  -5.230
   40    HG1  THR  17           HG1      THR  17  10.100   4.490  -2.640
   41    H    SER  18           H        SER  18  11.750   3.960  -7.320
   42    HG   SER  18           HG       SER  18  13.410   2.410  -9.350
   43    H    ALA  19           H        ALA  19  11.790   1.870  -5.930
   44    H    ALA  20           H        ALA  20  11.320  -1.520  -3.400
   45    H    SER  21           H        SER  21  14.690   0.680  -2.020
   46    HG   SER  21           HG       SER  21  17.180   2.530  -0.900
   47    H    SER  22           H        SER  22  15.690  -1.050   0.070
   48    HG   SER  22           HG       SER  22  17.360   0.480   2.660
   49    H    SER  23           H        SER  23  17.640  -4.100   2.440
   50    HG   SER  23           HG       SER  23  18.320  -4.650   5.550
   51    H    ASN  24           H        ASN  24  16.560  -2.290   4.310
   52   1HD2  ASN  24           HD2      ASN  24  15.470  -3.780   8.930
   53   2HD2  ASN  24           HD2      ASN  24  14.570  -2.390   8.420
   54    OH   TYR  25           OH       TYR  25   9.840   3.720  -1.030
   55    H    TYR  25           H        TYR  25  14.480  -1.200   3.330
   56    HH   TYR  25           HH       TYR  25   8.880   3.460  -0.840
   57    H    CYS  26           H        CYS  26  11.700  -0.720   4.130
   58    H    ASN  27           H        ASN  27  12.270   0.520   6.770
   59   1HD2  ASN  27           HD2      ASN  27  14.810  -1.150  10.240
   60   2HD2  ASN  27           HD2      ASN  27  14.810   0.560  10.570
   61    H    GLN  28           H        GLN  28  12.990   3.460   6.960
   62   1HE2  GLN  28           HE2      GLN  28  11.590   9.590   5.940
   63   2HE2  GLN  28           HE2      GLN  28  12.420   9.080   7.380
   64    H    MET  29           H        MET  29  11.080   4.170   5.230
   65    H    MET  30           H        MET  30   8.510   3.600   6.160
   66    H    LYS  31           H        LYS  31   8.420   5.710   8.210
   67   1HZ   LYS  31           HZ2      LYS  31   8.550   8.840  14.370
   68   2HZ   LYS  31           HZ3      LYS  31   7.210   7.940  14.080
   69   3HZ   LYS  31           HZ1      LYS  31   8.260   7.510  15.260
   70    H    SER  32           H        SER  32   8.420   8.080   6.770
   71    HG   SER  32           HG       SER  32  10.050   8.830   4.420
   72    NH1  ARG  33           NH2      ARG  33   6.680   9.860   0.680
   73    NH2  ARG  33           NH1      ARG  33   6.020   8.700  -1.160
   74    H    ARG  33           H        ARG  33   5.860   7.990   5.310
   75    HE   ARG  33           HE       ARG  33   4.820   7.250   0.430
   76   1HH1  ARG  33           HH2      ARG  33   6.550  10.060   1.650
   77   2HH1  ARG  33           HH2      ARG  33   7.200  10.470   0.090
   78   1HH2  ARG  33           HH1      ARG  33   5.380   8.060  -1.580
   79   2HH2  ARG  33           HH1      ARG  33   6.560   9.330  -1.720
   80    H    ASN  34           H        ASN  34   4.450   9.730   7.460
   81   1HD2  ASN  34           HD2      ASN  34   2.480  13.640   8.720
   82   2HD2  ASN  34           HD2      ASN  34   2.680  12.290   9.820
   83    H    LEU  35           H        LEU  35   2.850   7.230   8.000
   84    H    THR  36           H        THR  36   4.210   6.320  10.480
   85    HG1  THR  36           HG1      THR  36   7.220   5.770  12.190
   86    H    LYS  37           H        LYS  37   3.310   7.890  12.300
   87   1HZ   LYS  37           HZ1      LYS  37   5.610  13.870  10.790
   88   2HZ   LYS  37           HZ2      LYS  37   7.040  13.640  10.050
   89   3HZ   LYS  37           HZ3      LYS  37   5.650  13.170   9.300
   90    H    ASP  38           H        ASP  38   2.730   7.310  15.060
   91    NH1  ARG  39           NH2      ARG  39   0.090   4.930  14.220
   92    NH2  ARG  39           NH1      ARG  39  -1.840   5.860  14.990
   93    H    ARG  39           H        ARG  39   1.630   5.520  16.240
   94    HE   ARG  39           HE       ARG  39  -1.800   4.040  16.630
   95   1HH1  ARG  39           HH2      ARG  39   0.760   4.180  14.240
   96   2HH1  ARG  39           HH2      ARG  39   0.120   5.580  13.460
   97   1HH2  ARG  39           HH1      ARG  39  -2.620   5.840  15.600
   98   2HH2  ARG  39           HH1      ARG  39  -1.800   6.530  14.240
   99    H    CYS  40           H        CYS  40   4.720   2.440  16.780
  100    H    LYS  41           H        LYS  41   3.470   1.690  12.560
  101   1HZ   LYS  41           HZ1      LYS  41  -0.600   2.670  10.030
  102   2HZ   LYS  41           HZ2      LYS  41  -1.250   2.900   8.540
  103   3HZ   LYS  41           HZ3      LYS  41  -2.210   2.730   9.870
  104    H    VAL  43           H        VAL  43   0.800  -3.270  10.440
  105    H    ASN  44           H        ASN  44   2.750  -3.540   6.720
  106   1HD2  ASN  44           HD2      ASN  44   1.690   1.650   3.820
  107   2HD2  ASN  44           HD2      ASN  44   2.920   1.150   4.940
  108    H    THR  45           H        THR  45   0.910  -1.600   3.300
  109    HG1  THR  45           HG1      THR  45   1.490  -4.720   2.670
  110    H    PHE  46           H        PHE  46   4.440  -1.270   0.990
  111    H    VAL  47           H        VAL  47   2.980   1.610  -1.990
  112    H    HIS  48           H        HIS  48   4.880   0.220  -5.460
  113    HD1  HIS  48           HD1      HIS  48   8.700   3.180  -4.590
  114    HE2  HIS  48           HE2      HIS  48   9.020  -0.150  -2.320
  115    H    GLU  49           H        GLU  49   3.410   2.900  -6.770
  116    H    SER  50           H        SER  50   2.550   5.060 -10.500
  117    HG   SER  50           HG       SER  50   1.760   5.800 -12.060
  118    H    LEU  51           H        LEU  51  -0.410   8.060  -8.460
  119    H    ALA  52           H        ALA  52  -2.270   8.320 -10.710
  120    H    ASP  53           H        ASP  53  -1.180   5.830 -12.120
  121    H    VAL  54           H        VAL  54  -2.450   4.100 -10.450
  122    H    GLN  55           H        GLN  55  -4.890   4.390 -10.130
  123   1HE2  GLN  55           HE2      GLN  55  -8.920   8.670 -10.700
  124   2HE2  GLN  55           HE2      GLN  55  -9.320   7.000 -10.420
  125    H    ALA  56           H        ALA  56  -5.200   3.090 -12.750
  126    H    VAL  57           H        VAL  57  -5.880   0.460 -11.600
  127    H    CYS  58           H        CYS  58  -8.120   0.110 -10.950
  128    H    SER  59           H        SER  59  -9.310  -0.660 -13.340
  129    HG   SER  59           HG       SER  59 -12.060   0.880 -14.530
  130    H    GLN  60           H        GLN  60  -9.540  -3.210 -13.490
  131   1HE2  GLN  60           HE2      GLN  60  -3.980  -2.320 -15.470
  132   2HE2  GLN  60           HE2      GLN  60  -5.590  -1.640 -15.570
  133    H    LYS  61           H        LYS  61  -8.390  -6.730 -13.520
  134   1HZ   LYS  61           HZ2      LYS  61 -10.390 -12.120 -11.700
  135   2HZ   LYS  61           HZ3      LYS  61 -10.100 -13.730 -11.460
  136   3HZ   LYS  61           HZ1      LYS  61  -9.010 -12.610 -10.980
  137    H    ASN  62           H        ASN  62 -12.560  -8.030 -12.980
  138   1HD2  ASN  62           HD2      ASN  62 -15.400  -7.070  -7.980
  139   2HD2  ASN  62           HD2      ASN  62 -13.990  -6.390  -8.760
  140    H    VAL  63           H        VAL  63 -12.660  -8.140  -8.410
  141    H    ALA  64           H        ALA  64 -12.420 -11.680  -5.830
  142    H    CYS  65           H        CYS  65 -13.300  -8.720  -2.570
  143    H    LYS  66           H        LYS  66  -9.740  -9.120   0.390
  144   1HZ   LYS  66           HZ2      LYS  66  -6.030 -12.570   1.560
  145   2HZ   LYS  66           HZ3      LYS  66  -4.400 -12.440   1.400
  146   3HZ   LYS  66           HZ1      LYS  66  -5.090 -12.410   2.880
  147    H    ASN  67           H        ASN  67 -12.070  -9.060   2.400
  148   1HD2  ASN  67           HD2      ASN  67 -14.780  -5.730   2.900
  149   2HD2  ASN  67           HD2      ASN  67 -14.580  -6.340   4.500
  150    H    GLY  68           H        GLY  68 -13.800 -10.550   1.050
  151    H    GLN  69           H        GLN  69 -15.160  -8.560   0.560
  152   1HE2  GLN  69           HE2      GLN  69 -16.580  -2.490   0.780
  153   2HE2  GLN  69           HE2      GLN  69 -17.050  -3.510  -0.560
  154    H    THR  70           H        THR  70 -17.980  -7.420  -2.870
  155    HG1  THR  70           HG1      THR  70 -19.540  -6.840  -5.830
  156    H    ASN  71           H        ASN  71 -15.730  -5.830  -3.690
  157   1HD2  ASN  71           HD2      ASN  71 -15.000  -1.820  -1.990
  158   2HD2  ASN  71           HD2      ASN  71 -14.960  -1.380  -3.680
  159    H    CYS  72           H        CYS  72 -13.360  -6.370  -5.810
  160    OH   TYR  73           OH       TYR  73 -15.330  -2.480  -9.760
  161    H    TYR  73           H        TYR  73  -9.490  -4.900  -6.750
  162    HH   TYR  73           HH       TYR  73 -15.690  -2.740 -10.660
  163    H    GLN  74           H        GLN  74  -8.630  -7.250 -10.220
  164   1HE2  GLN  74           HE2      GLN  74  -4.200 -12.340 -10.980
  165   2HE2  GLN  74           HE2      GLN  74  -3.820 -10.800 -11.700
  166    H    SER  75           H        SER  75  -4.340  -6.100 -10.520
  167    HG   SER  75           HG       SER  75  -1.210  -5.710 -11.770
  168    OH   TYR  76           OH       TYR  76  -9.330  -8.610 -17.280
  169    H    TYR  76           H        TYR  76  -4.280  -6.300 -15.080
  170    HH   TYR  76           HH       TYR  76  -9.780  -8.110 -18.020
  171    H    SER  77           H        SER  77  -1.570  -6.170 -15.070
  172    HG   SER  77           HG       SER  77   1.170  -3.890 -15.170
  173    H    THR  78           H        THR  78   2.540  -7.670 -14.010
  174    HG1  THR  78           HG1      THR  78   5.700  -7.880 -12.540
  175    H    MET  79           H        MET  79   2.710  -6.080  -9.700
  176    H    SER  80           H        SER  80   4.910  -2.220  -9.250
  177    HG   SER  80           HG       SER  80   8.820  -1.080  -7.250
  178    H    ILE  81           H        ILE  81   5.860  -4.530  -5.610
  179    H    THR  82           H        THR  82   5.380  -2.240  -1.930
  180    HG1  THR  82           HG1      THR  82   8.720  -2.730  -2.350
  181    H    ASP  83           H        ASP  83   6.840  -5.210   0.370
  182    H    CYS  84           H        CYS  84   4.850  -3.890   4.220
  183    NH1  ARG  85           NH2      ARG  85   2.670  -9.520  10.980
  184    NH2  ARG  85           NH1      ARG  85   3.280  -7.970  12.390
  185    H    ARG  85           H        ARG  85   7.620  -5.400   6.790
  186    HE   ARG  85           HE       ARG  85   4.720  -7.130  10.430
  187   1HH1  ARG  85           HH2      ARG  85   2.850 -10.050  10.150
  188   2HH1  ARG  85           HH2      ARG  85   2.090  -9.850  11.710
  189   1HH2  ARG  85           HH1      ARG  85   3.960  -7.340  12.750
  190   2HH2  ARG  85           HH1      ARG  85   2.630  -8.440  12.990
  191    H    GLU  86           H        GLU  86   5.430  -5.450  10.550
  192    H    THR  87           H        THR  87   9.410  -4.670  12.700
  193    HG1  THR  87           HG1      THR  87  11.220  -4.010  13.580
  194    H    GLY  88           H        GLY  88  10.930  -8.160  15.450
  195    H    SER  89           H        SER  89  12.450  -6.190  16.720
  196    HG   SER  89           HG       SER  89  14.260  -4.310  15.790
  197    H    SER  90           H        SER  90  10.360  -3.850  17.560
  198    HG   SER  90           HG       SER  90   8.300  -1.220  14.330
  199    H    LYS  91           H        LYS  91  10.980   0.430  17.370
  200   1HZ   LYS  91           HZ2      LYS  91  11.750  -1.320  23.830
  201   2HZ   LYS  91           HZ3      LYS  91  11.100  -2.130  22.560
  202   3HZ   LYS  91           HZ1      LYS  91  12.290  -2.810  23.440
  203    OH   TYR  92           OH       TYR  92   5.540  10.200  18.070
  204    H    TYR  92           H        TYR  92   8.620   2.980  20.170
  205    HH   TYR  92           HH       TYR  92   4.920  10.120  17.260
  206    H    ASN  94           H        ASN  94  11.580   4.530  17.700
  207   1HD2  ASN  94           HD2      ASN  94  14.130   1.540  19.100
  208   2HD2  ASN  94           HD2      ASN  94  14.690   1.570  17.450
  209    H    CYS  95           H        CYS  95  10.720   4.030  14.290
  210    H    ALA  96           H        ALA  96  10.560  -0.440  14.080
  211    OH   TYR  97           OH       TYR  97   5.690   0.220  11.680
  212    H    TYR  97           H        TYR  97  12.050  -1.690  10.180
  213    HH   TYR  97           HH       TYR  97   4.900  -0.420  11.660
  214    H    LYS  98           H        LYS  98   9.850  -5.380   8.970
  215   1HZ   LYS  98           HZ1      LYS  98   9.120  -8.770   4.530
  216   2HZ   LYS  98           HZ2      LYS  98   8.240  -9.950   5.200
  217   3HZ   LYS  98           HZ3      LYS  98   8.680  -8.640   6.090
  218    H    THR  99           H        THR  99  12.490  -5.610   5.460
  219    HG1  THR  99           HG1      THR  99  12.500  -3.210   5.530
  220    H    THR 100           H        THR 100   9.300  -5.620   2.490
  221    HG1  THR 100           HG1      THR 100  10.230  -9.020   2.330
  222    H    GLN 101           H        GLN 101  11.640  -6.480  -0.950
  223   1HE2  GLN 101           HE2      GLN 101   8.710  -3.610  -5.930
  224   2HE2  GLN 101           HE2      GLN 101   9.500  -5.160  -5.980
  225    H    ALA 102           H        ALA 102   8.190  -5.860  -3.600
  226    H    ASN 103           H        ASN 103   8.060  -8.680  -6.960
  227   1HD2  ASN 103           HD2      ASN 103   6.410  -5.550 -11.700
  228   2HD2  ASN 103           HD2      ASN 103   6.680  -5.260 -10.010
  229    H    LYS 104           H        LYS 104   4.340  -7.350  -7.870
  230   1HZ   LYS 104           HZ3      LYS 104   3.410 -13.070  -2.890
  231   2HZ   LYS 104           HZ1      LYS 104   4.980 -13.400  -2.580
  232   3HZ   LYS 104           HZ2      LYS 104   4.360 -11.950  -2.160
  233    H    HIS 105           H        HIS 105   1.000 -10.040  -8.420
  234    HD1  HIS 105           HD1      HIS 105  -1.450  -8.910 -12.700
  235    HE2  HIS 105           HE2      HIS 105   0.980 -12.130 -12.880
  236    H    ILE 106           H        ILE 106  -1.930  -6.530  -9.030
  237    H    ILE 107           H        ILE 107  -3.780  -6.570  -5.010
  238    H    VAL 108           H        VAL 108  -6.760  -4.010  -6.370
  239    H    ALA 109           H        ALA 109  -8.370  -1.720  -2.860
  240    H    CYS 110           H        CYS 110 -12.160  -1.570  -5.000
  241    H    GLU 111           H        GLU 111 -12.760   2.840  -5.610
  242    H    GLY 112           H        GLY 112 -16.630   4.810  -5.530
  243    H    ASN 113           H        ASN 113 -15.650   8.950  -6.600
  244   1HD2  ASN 113           HD2      ASN 113 -19.130  11.040 -11.030
  245   2HD2  ASN 113           HD2      ASN 113 -19.410  10.640  -9.330
  246    OH   TYR 115           OH       TYR 115 -15.950  -0.410  -8.320
  247    H    TYR 115           H        TYR 115 -14.040   6.620 -11.060
  248    HH   TYR 115           HH       TYR 115 -15.560  -1.210  -8.820
  249    H    VAL 116           H        VAL 116 -12.270   5.200  -7.430
  250    H    VAL 118           H        VAL 118  -9.820   2.120  -3.220
  251    H    HIS 119           H        HIS 119  -8.880   1.080  -1.660
  252    HD1  HIS 119           HD1      HIS 119  -8.620   1.790   3.010
  253    HE2  HIS 119           HE2      HIS 119 -12.630   1.510   2.630
  254    H    PHE 120           H        PHE 120  -5.600  -0.450   0.760
  255    H    ASP 121           H        ASP 121  -5.170  -4.270  -1.540
  256    H    ALA 122           H        ALA 122  -5.140  -6.860  -2.080
  257    H    SER 123           H        SER 123  -1.170  -8.890  -1.700
  258    HG   SER 123           HG       SER 123   0.190  -6.620  -3.540
  259    H    VAL 124           H        VAL 124  -1.010  -9.890  -5.960
   
  Start of MODEL           5
 Raw file had 259 H/Q atoms
  Start of MODEL    5
    1   1H    LYS   1           H3       LYS   1  -9.770  18.360   0.720
    2   2H    LYS   1           H1       LYS   1  -9.810  19.480   1.920
    3   3H    LYS   1           H2       LYS   1  -8.390  18.750   1.540
    4   1HZ   LYS   1           HZ1      LYS   1 -12.400  14.010   2.750
    5   2HZ   LYS   1           HZ2      LYS   1 -13.810  14.020   3.550
    6   3HZ   LYS   1           HZ3      LYS   1 -13.800  13.830   1.910
    7    H    GLU   2           H        GLU   2  -9.200  15.640   4.090
    8    H    THR   3           H        THR   3  -9.190  13.350   0.590
    9    HG1  THR   3           HG1      THR   3  -9.450  12.550  -2.310
   10    H    ALA   4           H        ALA   4 -11.780   9.590   0.340
   11    H    ALA   5           H        ALA   5 -10.060   8.660  -1.760
   12    H    ALA   6           H        ALA   6  -7.750  10.210  -1.080
   13    H    LYS   7           H        LYS   7  -7.070   8.760   1.250
   14   1HZ   LYS   7           HZ2      LYS   7  -6.560   3.760   5.150
   15   2HZ   LYS   7           HZ3      LYS   7  -7.220   3.080   6.480
   16   3HZ   LYS   7           HZ1      LYS   7  -8.120   3.310   5.140
   17    H    PHE   8           H        PHE   8  -6.310   6.090   0.370
   18    H    GLU   9           H        GLU   9  -4.060   7.170  -1.160
   19    NH1  ARG  10           NH2      ARG  10  -2.600  11.470   6.040
   20    NH2  ARG  10           NH1      ARG  10  -4.370  10.060   5.400
   21    H    ARG  10           H        ARG  10  -2.260   8.220   1.060
   22    HE   ARG  10           HE       ARG  10  -2.990   9.000   4.520
   23   1HH1  ARG  10           HH2      ARG  10  -2.030  10.920   6.650
   24   2HH1  ARG  10           HH2      ARG  10  -1.950  12.100   5.600
   25   1HH2  ARG  10           HH1      ARG  10  -4.600   9.140   5.090
   26   2HH2  ARG  10           HH1      ARG  10  -5.070  10.710   5.680
   27    H    GLN  11           H        GLN  11  -1.690   5.890   2.510
   28   1HE2  GLN  11           HE2      GLN  11  -3.800   0.740   4.940
   29   2HE2  GLN  11           HE2      GLN  11  -2.170   1.320   5.060
   30    H    HIS  12           H        HIS  12  -0.380   4.590   0.540
   31    HD1  HIS  12           HD1      HIS  12   0.370   0.300   0.660
   32    HE2  HIS  12           HE2      HIS  12  -3.210   1.120   2.170
   33    H    MET  13           H        MET  13   0.960   5.660  -1.330
   34    H    ASP  14           H        ASP  14   4.270   4.840  -4.300
   35    H    SER  15           H        SER  15   5.460   7.750  -5.730
   36    HG   SER  15           HG       SER  15   5.210   9.830  -8.330
   37    H    SER  16           H        SER  16   7.910   8.620  -6.210
   38    HG   SER  16           HG       SER  16   9.970  10.070  -4.210
   39    H    THR  17           H        THR  17  10.330   7.370  -5.120
   40    HG1  THR  17           HG1      THR  17  11.760   6.420  -2.530
   41    H    SER  18           H        SER  18  11.690   4.620  -7.980
   42    HG   SER  18           HG       SER  18   9.550   1.510  -9.800
   43    H    ALA  19           H        ALA  19  11.430   2.370  -5.900
   44    H    ALA  20           H        ALA  20  11.260  -1.240  -3.640
   45    H    SER  21           H        SER  21  14.430   1.130  -2.180
   46    HG   SER  21           HG       SER  21  16.810   3.210  -1.380
   47    H    SER  22           H        SER  22  15.460  -0.770  -0.250
   48    HG   SER  22           HG       SER  22  18.820  -0.300   3.350
   49    H    SER  23           H        SER  23  17.830  -3.420   2.100
   50    HG   SER  23           HG       SER  23  18.210  -4.500   5.250
   51    H    ASN  24           H        ASN  24  16.630  -1.970   4.090
   52   1HD2  ASN  24           HD2      ASN  24  15.700  -4.040   8.560
   53   2HD2  ASN  24           HD2      ASN  24  14.640  -2.720   8.160
   54    OH   TYR  25           OH       TYR  25   8.730   3.340  -0.380
   55    H    TYR  25           H        TYR  25  14.450  -0.970   3.140
   56    HH   TYR  25           HH       TYR  25   9.030   3.980  -1.100
   57    H    CYS  26           H        CYS  26  11.660  -0.730   4.030
   58    H    ASN  27           H        ASN  27  12.190   0.370   6.750
   59   1HD2  ASN  27           HD2      ASN  27  14.660  -1.440  10.180
   60   2HD2  ASN  27           HD2      ASN  27  14.510   0.220  10.710
   61    H    GLN  28           H        GLN  28  12.880   3.300   7.270
   62   1HE2  GLN  28           HE2      GLN  28  14.920   6.010  10.390
   63   2HE2  GLN  28           HE2      GLN  28  13.900   7.230   9.670
   64    H    MET  29           H        MET  29  10.810   4.070   5.570
   65    H    MET  30           H        MET  30   8.350   3.330   6.450
   66    H    LYS  31           H        LYS  31   8.360   5.360   8.510
   67   1HZ   LYS  31           HZ1      LYS  31  11.780   4.110  12.300
   68   2HZ   LYS  31           HZ2      LYS  31  11.180   4.250  10.800
   69   3HZ   LYS  31           HZ3      LYS  31  12.770   4.550  11.090
   70    H    SER  32           H        SER  32   8.500   7.780   7.430
   71    HG   SER  32           HG       SER  32   7.790   8.910   4.120
   72    NH1  ARG  33           NH2      ARG  33   6.480   9.890   1.480
   73    NH2  ARG  33           NH1      ARG  33   6.660  11.470   3.110
   74    H    ARG  33           H        ARG  33   6.110   7.840   5.950
   75    HE   ARG  33           HE       ARG  33   4.640  10.440   4.060
   76   1HH1  ARG  33           HH2      ARG  33   6.020   9.090   1.100
   77   2HH1  ARG  33           HH2      ARG  33   7.280  10.280   1.030
   78   1HH2  ARG  33           HH1      ARG  33   6.360  11.850   3.990
   79   2HH2  ARG  33           HH1      ARG  33   7.440  11.860   2.630
   80    H    ASN  34           H        ASN  34   2.830   9.950   7.410
   81   1HD2  ASN  34           HD2      ASN  34   3.640  12.790   9.230
   82   2HD2  ASN  34           HD2      ASN  34   3.580  11.340  10.190
   83    H    LEU  35           H        LEU  35   2.450   6.770   8.530
   84    H    THR  36           H        THR  36   3.320   6.040  10.940
   85    HG1  THR  36           HG1      THR  36   5.510   5.520  10.830
   86    H    LYS  37           H        LYS  37   1.870   7.140  12.990
   87   1HZ   LYS  37           HZ3      LYS  37   6.150  11.940  13.740
   88   2HZ   LYS  37           HZ1      LYS  37   6.740  10.420  13.570
   89   3HZ   LYS  37           HZ2      LYS  37   7.010  11.530  12.390
   90    H    ASP  38           H        ASP  38   1.700   6.150  15.810
   91    NH1  ARG  39           NH2      ARG  39  -0.150  -2.510  19.160
   92    NH2  ARG  39           NH1      ARG  39   1.400  -2.900  17.550
   93    H    ARG  39           H        ARG  39   0.760   4.190  16.800
   94    HE   ARG  39           HE       ARG  39   1.120  -0.530  16.970
   95   1HH1  ARG  39           HH2      ARG  39  -0.790  -1.890  19.620
   96   2HH1  ARG  39           HH2      ARG  39  -0.080  -3.460  19.440
   97   1HH2  ARG  39           HH1      ARG  39   1.980  -2.600  16.800
   98   2HH2  ARG  39           HH1      ARG  39   1.420  -3.850  17.850
   99    H    CYS  40           H        CYS  40   4.290   1.640  16.900
  100    H    LYS  41           H        LYS  41   3.060   1.160  12.550
  101   1HZ   LYS  41           HZ1      LYS  41  -2.230   0.270  10.180
  102   2HZ   LYS  41           HZ2      LYS  41  -3.250   0.560   8.930
  103   3HZ   LYS  41           HZ3      LYS  41  -2.870  -0.990   9.370
  104    H    VAL  43           H        VAL  43   0.660  -3.700  10.050
  105    H    ASN  44           H        ASN  44   2.800  -3.640   6.530
  106   1HD2  ASN  44           HD2      ASN  44   1.630   1.510   3.750
  107   2HD2  ASN  44           HD2      ASN  44   2.990   0.760   4.490
  108    H    THR  45           H        THR  45   0.950  -1.570   3.200
  109    HG1  THR  45           HG1      THR  45   1.720  -4.690   2.060
  110    H    PHE  46           H        PHE  46   4.590  -1.280   0.880
  111    H    VAL  47           H        VAL  47   3.420   1.780  -2.090
  112    H    HIS  48           H        HIS  48   4.820   0.220  -5.750
  113    HD1  HIS  48           HD1      HIS  48   8.560   3.220  -4.710
  114    HE2  HIS  48           HE2      HIS  48   8.850   0.010  -2.270
  115    H    GLU  49           H        GLU  49   3.640   3.130  -6.860
  116    H    SER  50           H        SER  50   1.810   4.650 -10.360
  117    HG   SER  50           HG       SER  50   1.940   5.740 -12.150
  118    H    LEU  51           H        LEU  51  -0.540   8.070  -8.630
  119    H    ALA  52           H        ALA  52  -2.430   8.350 -10.980
  120    H    ASP  53           H        ASP  53  -1.480   5.820 -12.340
  121    H    VAL  54           H        VAL  54  -2.920   4.230 -10.740
  122    H    GLN  55           H        GLN  55  -5.440   4.470  -9.950
  123   1HE2  GLN  55           HE2      GLN  55  -8.710   8.890 -11.620
  124   2HE2  GLN  55           HE2      GLN  55  -9.310   7.380 -10.990
  125    H    ALA  56           H        ALA  56  -5.490   3.120 -12.750
  126    H    VAL  57           H        VAL  57  -6.080   0.520 -11.540
  127    H    CYS  58           H        CYS  58  -8.190   0.100 -10.800
  128    H    SER  59           H        SER  59  -9.520  -0.790 -13.210
  129    HG   SER  59           HG       SER  59 -12.410   0.490 -13.900
  130    H    GLN  60           H        GLN  60  -9.550  -3.390 -13.370
  131   1HE2  GLN  60           HE2      GLN  60  -3.950  -2.600 -15.320
  132   2HE2  GLN  60           HE2      GLN  60  -5.500  -1.810 -15.430
  133    H    LYS  61           H        LYS  61  -9.050  -6.310 -12.900
  134   1HZ   LYS  61           HZ1      LYS  61  -8.910 -11.980 -10.070
  135   2HZ   LYS  61           HZ2      LYS  61 -10.380 -11.860 -10.750
  136   3HZ   LYS  61           HZ3      LYS  61  -9.800 -13.330 -10.300
  137    H    ASN  62           H        ASN  62 -12.890  -8.170 -12.470
  138   1HD2  ASN  62           HD2      ASN  62 -15.510  -6.970  -7.410
  139   2HD2  ASN  62           HD2      ASN  62 -14.230  -6.240  -8.310
  140    H    VAL  63           H        VAL  63 -12.770  -8.010  -7.920
  141    H    ALA  64           H        ALA  64 -12.210 -11.340  -5.170
  142    H    CYS  65           H        CYS  65 -13.280  -8.450  -1.950
  143    H    LYS  66           H        LYS  66  -9.450  -9.040   0.630
  144   1HZ   LYS  66           HZ2      LYS  66  -7.780 -11.610  -2.200
  145   2HZ   LYS  66           HZ3      LYS  66  -6.370 -10.780  -2.010
  146   3HZ   LYS  66           HZ1      LYS  66  -6.340 -12.340  -2.490
  147    H    ASN  67           H        ASN  67 -11.610  -8.750   2.680
  148   1HD2  ASN  67           HD2      ASN  67 -13.850  -5.170   3.400
  149   2HD2  ASN  67           HD2      ASN  67 -13.520  -5.710   5.010
  150    H    GLY  68           H        GLY  68 -13.460 -10.200   1.750
  151    H    GLN  69           H        GLN  69 -14.980  -8.160   1.290
  152   1HE2  GLN  69           HE2      GLN  69 -19.810  -5.500  -1.690
  153   2HE2  GLN  69           HE2      GLN  69 -19.630  -6.320  -0.160
  154    H    THR  70           H        THR  70 -17.870  -6.830  -2.100
  155    HG1  THR  70           HG1      THR  70 -18.940  -5.720  -4.860
  156    H    ASN  71           H        ASN  71 -15.760  -5.270  -2.900
  157   1HD2  ASN  71           HD2      ASN  71 -14.270  -1.250  -1.310
  158   2HD2  ASN  71           HD2      ASN  71 -14.810  -0.680  -2.870
  159    H    CYS  72           H        CYS  72 -13.450  -6.060  -5.240
  160    OH   TYR  73           OH       TYR  73 -15.480  -2.290  -9.030
  161    H    TYR  73           H        TYR  73  -9.590  -4.710  -6.370
  162    HH   TYR  73           HH       TYR  73 -16.020  -2.770  -9.720
  163    H    GLN  74           H        GLN  74  -8.840  -7.110  -9.850
  164   1HE2  GLN  74           HE2      GLN  74  -4.390 -12.160 -10.720
  165   2HE2  GLN  74           HE2      GLN  74  -3.980 -10.590 -11.360
  166    H    SER  75           H        SER  75  -4.480  -6.150 -10.340
  167    HG   SER  75           HG       SER  75  -1.430  -5.720 -11.700
  168    OH   TYR  76           OH       TYR  76  -9.680  -9.040 -16.700
  169    H    TYR  76           H        TYR  76  -4.500  -6.440 -14.890
  170    HH   TYR  76           HH       TYR  76 -10.120  -8.130 -16.720
  171    H    SER  77           H        SER  77  -1.840  -6.330 -15.060
  172    HG   SER  77           HG       SER  77   2.460  -5.190 -15.400
  173    H    THR  78           H        THR  78   2.350  -7.620 -13.970
  174    HG1  THR  78           HG1      THR  78   5.410  -8.070 -12.640
  175    H    MET  79           H        MET  79   2.580  -6.020  -9.660
  176    H    SER  80           H        SER  80   4.850  -2.200  -9.400
  177    HG   SER  80           HG       SER  80   8.910  -1.050  -7.650
  178    H    ILE  81           H        ILE  81   6.050  -4.430  -5.810
  179    H    THR  82           H        THR  82   5.470  -2.240  -2.090
  180    HG1  THR  82           HG1      THR  82   8.650  -2.600  -2.580
  181    H    ASP  83           H        ASP  83   6.800  -5.360   0.130
  182    H    CYS  84           H        CYS  84   4.880  -3.960   3.910
  183    NH1  ARG  85           NH2      ARG  85   6.960  -9.750   3.560
  184    NH2  ARG  85           NH1      ARG  85   4.860 -10.250   2.860
  185    H    ARG  85           H        ARG  85   7.470  -5.590   6.820
  186    HE   ARG  85           HE       ARG  85   4.140  -8.850   4.790
  187   1HH1  ARG  85           HH2      ARG  85   7.570  -9.250   4.170
  188   2HH1  ARG  85           HH2      ARG  85   7.350 -10.310   2.830
  189   1HH2  ARG  85           HH1      ARG  85   3.870 -10.180   2.940
  190   2HH2  ARG  85           HH1      ARG  85   5.270 -10.810   2.140
  191    H    GLU  86           H        GLU  86   5.260  -5.570  10.670
  192    H    THR  87           H        THR  87   9.310  -4.710  12.680
  193    HG1  THR  87           HG1      THR  87  11.180  -4.100  13.490
  194    H    GLY  88           H        GLY  88  11.050  -8.170  15.300
  195    H    SER  89           H        SER  89  12.350  -6.090  16.740
  196    HG   SER  89           HG       SER  89  13.940  -4.080  16.030
  197    H    SER  90           H        SER  90   9.910  -4.010  17.200
  198    HG   SER  90           HG       SER  90   7.610  -1.060  15.030
  199    H    LYS  91           H        LYS  91  10.460   0.080  17.620
  200   1HZ   LYS  91           HZ3      LYS  91  12.330   4.140  20.760
  201   2HZ   LYS  91           HZ1      LYS  91  11.460   4.450  22.110
  202   3HZ   LYS  91           HZ2      LYS  91  13.040   4.060  22.240
  203    OH   TYR  92           OH       TYR  92   4.350   9.570  18.440
  204    H    TYR  92           H        TYR  92   7.360   2.310  19.900
  205    HH   TYR  92           HH       TYR  92   3.780   9.550  17.610
  206    H    ASN  94           H        ASN  94  10.770   4.390  17.830
  207   1HD2  ASN  94           HD2      ASN  94  15.380   2.470  15.050
  208   2HD2  ASN  94           HD2      ASN  94  13.980   2.070  16.020
  209    H    CYS  95           H        CYS  95  10.050   3.900  14.380
  210    H    ALA  96           H        ALA  96  10.130  -0.650  13.850
  211    OH   TYR  97           OH       TYR  97   5.260  -0.240  11.660
  212    H    TYR  97           H        TYR  97  12.010  -1.720  10.130
  213    HH   TYR  97           HH       TYR  97   4.480  -0.880  11.510
  214    H    LYS  98           H        LYS  98   9.700  -5.280   8.920
  215   1HZ   LYS  98           HZ3      LYS  98   8.720 -11.640   6.380
  216   2HZ   LYS  98           HZ1      LYS  98   9.800 -12.640   5.660
  217   3HZ   LYS  98           HZ2      LYS  98   9.810 -12.470   7.280
  218    H    THR  99           H        THR  99  12.340  -5.640   5.360
  219    HG1  THR  99           HG1      THR  99  12.150  -3.160   5.390
  220    H    THR 100           H        THR 100   9.280  -5.560   2.200
  221    HG1  THR 100           HG1      THR 100  10.420  -8.430   2.530
  222    H    GLN 101           H        GLN 101  11.690  -6.260  -1.110
  223   1HE2  GLN 101           HE2      GLN 101   8.790  -3.600  -5.980
  224   2HE2  GLN 101           HE2      GLN 101   9.770  -5.030  -6.010
  225    H    ALA 102           H        ALA 102   8.310  -5.930  -3.810
  226    H    ASN 103           H        ASN 103   8.100  -8.660  -7.270
  227   1HD2  ASN 103           HD2      ASN 103   6.090  -5.580 -11.810
  228   2HD2  ASN 103           HD2      ASN 103   6.690  -5.200 -10.220
  229    H    LYS 104           H        LYS 104   4.340  -7.070  -7.930
  230   1HZ   LYS 104           HZ2      LYS 104   4.440 -12.830  -5.220
  231   2HZ   LYS 104           HZ3      LYS 104   5.050 -13.520  -3.860
  232   3HZ   LYS 104           HZ1      LYS 104   3.490 -13.070  -3.920
  233    H    HIS 105           H        HIS 105   0.970  -9.780  -8.090
  234    HD1  HIS 105           HD1      HIS 105  -1.700  -8.950 -12.280
  235    HE2  HIS 105           HE2      HIS 105   0.720 -12.190 -12.450
  236    H    ILE 106           H        ILE 106  -2.080  -6.400  -8.850
  237    H    ILE 107           H        ILE 107  -3.800  -6.370  -4.820
  238    H    VAL 108           H        VAL 108  -6.900  -3.910  -6.080
  239    H    ALA 109           H        ALA 109  -8.380  -1.420  -2.640
  240    H    CYS 110           H        CYS 110 -12.210  -1.200  -4.720
  241    H    GLU 111           H        GLU 111 -12.600   3.200  -5.540
  242    H    GLY 112           H        GLY 112 -16.370   5.300  -5.310
  243    H    ASN 113           H        ASN 113 -16.470   9.210  -6.760
  244   1HD2  ASN 113           HD2      ASN 113 -18.840  12.160  -7.160
  245   2HD2  ASN 113           HD2      ASN 113 -17.820  12.190  -8.570
  246    OH   TYR 115           OH       TYR 115 -15.970   0.100  -7.960
  247    H    TYR 115           H        TYR 115 -13.930   6.810 -11.340
  248    HH   TYR 115           HH       TYR 115 -15.600  -0.760  -8.350
  249    H    VAL 116           H        VAL 116 -12.020   5.180  -7.740
  250    H    VAL 118           H        VAL 118  -9.600   2.500  -3.340
  251    H    HIS 119           H        HIS 119  -8.690   1.490  -1.700
  252    HD1  HIS 119           HD1      HIS 119  -8.560   2.840   2.400
  253    HE2  HIS 119           HE2      HIS 119 -12.560   2.340   2.360
  254    H    PHE 120           H        PHE 120  -5.560  -0.100   0.850
  255    H    ASP 121           H        ASP 121  -5.250  -3.990  -1.280
  256    H    ALA 122           H        ALA 122  -5.200  -6.670  -1.690
  257    H    SER 123           H        SER 123  -1.040  -8.190  -1.250
  258    HG   SER 123           HG       SER 123   1.640  -9.100  -1.620
  259    H    VAL 124           H        VAL 124  -0.850  -9.470  -5.490
   
  Start of MODEL           6
 Raw file had 259 H/Q atoms
  Start of MODEL    6
    1   1H    LYS   1           H3       LYS   1 -10.780  17.970   1.800
    2   2H    LYS   1           H1       LYS   1 -10.540  19.000   3.050
    3   3H    LYS   1           H2       LYS   1  -9.260  18.240   2.360
    4   1HZ   LYS   1           HZ3      LYS   1 -15.400  14.710   2.960
    5   2HZ   LYS   1           HZ1      LYS   1 -15.610  14.420   1.340
    6   3HZ   LYS   1           HZ2      LYS   1 -14.120  14.280   2.030
    7    H    GLU   2           H        GLU   2 -10.060  15.010   4.950
    8    H    THR   3           H        THR   3  -9.940  12.870   1.390
    9    HG1  THR   3           HG1      THR   3 -13.320  11.270  -1.400
   10    H    ALA   4           H        ALA   4 -12.410   9.250   0.590
   11    H    ALA   5           H        ALA   5 -10.480   8.240  -1.470
   12    H    ALA   6           H        ALA   6  -8.240   9.610  -0.060
   13    H    LYS   7           H        LYS   7  -7.420   8.160   1.950
   14   1HZ   LYS   7           HZ2      LYS   7  -6.820   2.730   5.150
   15   2HZ   LYS   7           HZ3      LYS   7  -7.380   1.920   6.440
   16   3HZ   LYS   7           HZ1      LYS   7  -8.360   2.180   5.160
   17    H    PHE   8           H        PHE   8  -6.590   5.640   0.800
   18    H    GLU   9           H        GLU   9  -4.440   7.000  -0.780
   19    NH1  ARG  10           NH2      ARG  10  -4.460  10.840   5.750
   20    NH2  ARG  10           NH1      ARG  10  -5.800   9.100   6.320
   21    H    ARG  10           H        ARG  10  -2.750   7.990   1.590
   22    HE   ARG  10           HE       ARG  10  -3.780   7.790   6.360
   23   1HH1  ARG  10           HH2      ARG  10  -3.550  11.180   5.520
   24   2HH1  ARG  10           HH2      ARG  10  -5.250  11.440   5.710
   25   1HH2  ARG  10           HH1      ARG  10  -5.940   8.120   6.470
   26   2HH2  ARG  10           HH1      ARG  10  -6.580   9.720   6.330
   27    H    GLN  11           H        GLN  11  -2.050   5.490   2.980
   28   1HE2  GLN  11           HE2      GLN  11  -3.450   0.060   5.520
   29   2HE2  GLN  11           HE2      GLN  11  -1.820   0.620   5.230
   30    H    HIS  12           H        HIS  12  -0.740   4.340   0.820
   31    HD1  HIS  12           HD1      HIS  12  -0.020   0.000   0.840
   32    HE2  HIS  12           HE2      HIS  12  -3.570   0.630   2.570
   33    H    MET  13           H        MET  13   0.460   5.390  -1.030
   34    H    ASP  14           H        ASP  14   3.700   4.690  -4.200
   35    H    SER  15           H        SER  15   4.470   6.990  -5.070
   36    HG   SER  15           HG       SER  15   5.830   8.150  -8.930
   37    H    SER  16           H        SER  16   7.070   8.500  -5.080
   38    HG   SER  16           HG       SER  16   9.050   7.960  -3.130
   39    H    THR  17           H        THR  17   8.940   6.430  -5.280
   40    HG1  THR  17           HG1      THR  17  10.410   4.380  -2.770
   41    H    SER  18           H        SER  18  11.710   4.140  -7.760
   42    HG   SER  18           HG       SER  18  13.150   1.900  -9.710
   43    H    ALA  19           H        ALA  19  11.740   1.950  -6.310
   44    H    ALA  20           H        ALA  20  11.250  -1.470  -3.770
   45    H    SER  21           H        SER  21  14.620   0.760  -2.390
   46    HG   SER  21           HG       SER  21  16.760   2.830  -1.710
   47    H    SER  22           H        SER  22  15.560  -1.240  -0.520
   48    HG   SER  22           HG       SER  22  17.990  -0.120   2.870
   49    H    SER  23           H        SER  23  17.740  -4.220   1.670
   50    HG   SER  23           HG       SER  23  17.970  -4.890   5.010
   51    H    ASN  24           H        ASN  24  16.620  -2.650   3.780
   52   1HD2  ASN  24           HD2      ASN  24  16.070  -4.560   8.490
   53   2HD2  ASN  24           HD2      ASN  24  15.090  -3.140   8.270
   54    OH   TYR  25           OH       TYR  25  10.060   3.560  -1.280
   55    H    TYR  25           H        TYR  25  14.540  -1.480   2.940
   56    HH   TYR  25           HH       TYR  25   9.090   3.300  -1.130
   57    H    CYS  26           H        CYS  26  11.780  -0.920   3.840
   58    H    ASN  27           H        ASN  27  12.420   0.330   6.430
   59   1HD2  ASN  27           HD2      ASN  27  14.610   0.450  11.180
   60   2HD2  ASN  27           HD2      ASN  27  14.440   1.990  10.360
   61    H    GLN  28           H        GLN  28  13.110   3.350   6.680
   62   1HE2  GLN  28           HE2      GLN  28  16.100   5.140   9.730
   63   2HE2  GLN  28           HE2      GLN  28  15.570   6.730   9.220
   64    H    MET  29           H        MET  29  11.170   4.020   5.010
   65    H    MET  30           H        MET  30   8.660   3.300   6.050
   66    H    LYS  31           H        LYS  31   8.610   5.390   8.060
   67   1HZ   LYS  31           HZ2      LYS  31  12.210   6.210  13.020
   68   2HZ   LYS  31           HZ3      LYS  31  12.870   4.710  12.840
   69   3HZ   LYS  31           HZ1      LYS  31  13.380   5.960  11.910
   70    H    SER  32           H        SER  32   8.500   7.820   6.750
   71    HG   SER  32           HG       SER  32  10.120   8.820   4.420
   72    NH1  ARG  33           NH2      ARG  33   5.730  10.430   1.250
   73    NH2  ARG  33           NH1      ARG  33   5.870   9.070  -0.560
   74    H    ARG  33           H        ARG  33   5.730   7.900   5.580
   75    HE   ARG  33           HE       ARG  33   4.200   7.670   0.640
   76   1HH1  ARG  33           HH2      ARG  33   5.360  10.610   2.160
   77   2HH1  ARG  33           HH2      ARG  33   6.400  11.040   0.840
   78   1HH2  ARG  33           HH1      ARG  33   5.640   8.220  -1.040
   79   2HH2  ARG  33           HH1      ARG  33   6.530   9.710  -0.960
   80    H    ASN  34           H        ASN  34   4.580   9.670   7.810
   81   1HD2  ASN  34           HD2      ASN  34   1.550  11.810  12.220
   82   2HD2  ASN  34           HD2      ASN  34   1.120  10.270  11.520
   83    H    LEU  35           H        LEU  35   3.000   7.180   8.260
   84    H    THR  36           H        THR  36   4.470   5.920  10.400
   85    HG1  THR  36           HG1      THR  36   7.620   5.060  11.520
   86    H    LYS  37           H        LYS  37   4.080   7.640  12.210
   87   1HZ   LYS  37           HZ1      LYS  37   6.740  13.420  10.460
   88   2HZ   LYS  37           HZ2      LYS  37   7.770  12.760   9.370
   89   3HZ   LYS  37           HZ3      LYS  37   6.180  12.340   9.370
   90    H    ASP  38           H        ASP  38   2.900   7.020  14.520
   91    NH1  ARG  39           NH2      ARG  39  -0.970  -0.060  17.980
   92    NH2  ARG  39           NH1      ARG  39   0.190  -0.690  19.810
   93    H    ARG  39           H        ARG  39   1.790   5.200  15.430
   94    HE   ARG  39           HE       ARG  39   0.410   1.820  20.180
   95   1HH1  ARG  39           HH2      ARG  39  -1.360   0.660  17.420
   96   2HH1  ARG  39           HH2      ARG  39  -1.090  -1.020  17.740
   97   1HH2  ARG  39           HH1      ARG  39   0.670  -0.520  20.660
   98   2HH2  ARG  39           HH1      ARG  39   0.030  -1.630  19.510
   99    H    CYS  40           H        CYS  40   4.050   1.810  16.830
  100    H    LYS  41           H        LYS  41   3.300   1.270  12.690
  101   1HZ   LYS  41           HZ2      LYS  41  -1.070  -0.130   7.940
  102   2HZ   LYS  41           HZ3      LYS  41  -1.730   1.340   8.260
  103   3HZ   LYS  41           HZ1      LYS  41  -0.610   1.180   7.050
  104    H    VAL  43           H        VAL  43   1.130  -3.630  10.300
  105    H    ASN  44           H        ASN  44   3.000  -3.740   6.520
  106   1HD2  ASN  44           HD2      ASN  44   1.850   1.580   3.850
  107   2HD2  ASN  44           HD2      ASN  44   3.130   1.070   4.910
  108    H    THR  45           H        THR  45   1.110  -1.550   3.240
  109    HG1  THR  45           HG1      THR  45   1.660  -4.680   2.380
  110    H    PHE  46           H        PHE  46   4.520  -1.320   0.750
  111    H    VAL  47           H        VAL  47   3.010   1.590  -2.160
  112    H    HIS  48           H        HIS  48   4.790   0.200  -5.640
  113    HD1  HIS  48           HD1      HIS  48   8.630   3.100  -4.940
  114    HE2  HIS  48           HE2      HIS  48   8.910  -0.220  -2.640
  115    H    GLU  49           H        GLU  49   3.340   3.150  -6.770
  116    H    SER  50           H        SER  50   2.520   5.630 -10.290
  117    HG   SER  50           HG       SER  50   1.240   6.340 -11.800
  118    H    LEU  51           H        LEU  51  -0.720   8.240  -8.110
  119    H    ALA  52           H        ALA  52  -2.430   8.350 -10.520
  120    H    ASP  53           H        ASP  53  -1.330   5.720 -11.720
  121    H    VAL  54           H        VAL  54  -3.050   4.160 -10.220
  122    H    GLN  55           H        GLN  55  -5.540   4.460  -9.490
  123   1HE2  GLN  55           HE2      GLN  55  -8.550   8.990 -11.390
  124   2HE2  GLN  55           HE2      GLN  55  -9.210   7.430 -10.950
  125    H    ALA  56           H        ALA  56  -5.420   3.260 -12.410
  126    H    VAL  57           H        VAL  57  -6.150   0.630 -11.380
  127    H    CYS  58           H        CYS  58  -8.200   0.190 -10.710
  128    H    SER  59           H        SER  59  -9.440  -0.470 -13.140
  129    HG   SER  59           HG       SER  59  -9.110   0.170 -16.130
  130    H    GLN  60           H        GLN  60  -9.500  -3.180 -13.430
  131   1HE2  GLN  60           HE2      GLN  60  -3.700  -2.510 -15.390
  132   2HE2  GLN  60           HE2      GLN  60  -5.220  -1.660 -15.280
  133    H    LYS  61           H        LYS  61  -8.930  -6.280 -13.150
  134   1HZ   LYS  61           HZ3      LYS  61  -7.040 -12.650 -12.610
  135   2HZ   LYS  61           HZ1      LYS  61  -8.420 -13.500 -12.330
  136   3HZ   LYS  61           HZ2      LYS  61  -8.090 -12.960 -13.840
  137    H    ASN  62           H        ASN  62 -12.930  -7.970 -12.690
  138   1HD2  ASN  62           HD2      ASN  62 -15.610  -6.880  -7.660
  139   2HD2  ASN  62           HD2      ASN  62 -14.240  -6.180  -8.470
  140    H    VAL  63           H        VAL  63 -12.760  -7.890  -8.140
  141    H    ALA  64           H        ALA  64 -12.320 -11.270  -5.370
  142    H    CYS  65           H        CYS  65 -13.720  -8.400  -2.260
  143    H    LYS  66           H        LYS  66 -10.430  -8.440   1.020
  144   1HZ   LYS  66           HZ3      LYS  66  -6.340 -11.080   0.190
  145   2HZ   LYS  66           HZ1      LYS  66  -7.840 -11.740   0.210
  146   3HZ   LYS  66           HZ2      LYS  66  -7.250 -11.120  -1.180
  147    H    ASN  67           H        ASN  67 -12.820  -8.610   2.820
  148   1HD2  ASN  67           HD2      ASN  67 -15.850  -5.560   3.280
  149   2HD2  ASN  67           HD2      ASN  67 -16.200  -6.450   4.710
  150    H    GLY  68           H        GLY  68 -14.400 -10.130   1.390
  151    H    GLN  69           H        GLN  69 -15.630  -8.270   0.790
  152   1HE2  GLN  69           HE2      GLN  69 -16.780  -2.180   1.060
  153   2HE2  GLN  69           HE2      GLN  69 -16.950  -3.130  -0.400
  154    H    THR  70           H        THR  70 -18.340  -7.000  -2.720
  155    HG1  THR  70           HG1      THR  70 -19.770  -6.540  -5.730
  156    H    ASN  71           H        ASN  71 -15.830  -5.620  -3.510
  157   1HD2  ASN  71           HD2      ASN  71 -15.250  -1.390  -1.870
  158   2HD2  ASN  71           HD2      ASN  71 -15.330  -0.970  -3.560
  159    H    CYS  72           H        CYS  72 -13.530  -6.100  -5.560
  160    OH   TYR  73           OH       TYR  73 -15.520  -2.110  -9.450
  161    H    TYR  73           H        TYR  73  -9.670  -4.680  -6.530
  162    HH   TYR  73           HH       TYR  73 -16.060  -2.610 -10.140
  163    H    GLN  74           H        GLN  74  -8.850  -7.040 -10.010
  164   1HE2  GLN  74           HE2      GLN  74  -4.480 -12.180 -10.510
  165   2HE2  GLN  74           HE2      GLN  74  -3.970 -10.640 -11.170
  166    H    SER  75           H        SER  75  -4.600  -5.850 -10.430
  167    HG   SER  75           HG       SER  75  -1.480  -5.720 -11.930
  168    OH   TYR  76           OH       TYR  76  -9.760  -8.330 -17.200
  169    H    TYR  76           H        TYR  76  -4.510  -6.300 -15.020
  170    HH   TYR  76           HH       TYR  76 -10.120  -7.400 -17.000
  171    H    SER  77           H        SER  77  -1.890  -6.440 -14.860
  172    HG   SER  77           HG       SER  77   2.320  -6.000 -16.940
  173    H    THR  78           H        THR  78   2.300  -7.810 -14.000
  174    HG1  THR  78           HG1      THR  78   4.570  -6.920 -12.950
  175    H    MET  79           H        MET  79   2.340  -5.990  -9.760
  176    H    SER  80           H        SER  80   4.700  -2.210  -9.480
  177    HG   SER  80           HG       SER  80   8.660  -0.980  -7.630
  178    H    ILE  81           H        ILE  81   5.840  -4.510  -5.890
  179    H    THR  82           H        THR  82   5.400  -2.320  -2.150
  180    HG1  THR  82           HG1      THR  82   8.600  -2.670  -2.730
  181    H    ASP  83           H        ASP  83   6.910  -5.330   0.040
  182    H    CYS  84           H        CYS  84   4.970  -4.040   3.910
  183    NH1  ARG  85           NH2      ARG  85   2.900 -10.940   9.180
  184    NH2  ARG  85           NH1      ARG  85   3.540 -11.380  11.320
  185    H    ARG  85           H        ARG  85   7.820  -5.460   6.720
  186    HE   ARG  85           HE       ARG  85   5.620 -10.190  10.710
  187   1HH1  ARG  85           HH2      ARG  85   3.130 -10.590   8.270
  188   2HH1  ARG  85           HH2      ARG  85   2.020 -11.370   9.350
  189   1HH2  ARG  85           HH1      ARG  85   4.210 -11.350  12.060
  190   2HH2  ARG  85           HH1      ARG  85   2.650 -11.830  11.460
  191    H    GLU  86           H        GLU  86   5.750  -5.220  10.510
  192    H    THR  87           H        THR  87   9.690  -4.650  12.750
  193    HG1  THR  87           HG1      THR  87  11.730  -4.170  13.230
  194    H    GLY  88           H        GLY  88  11.290  -8.020  15.530
  195    H    SER  89           H        SER  89  12.610  -5.680  16.260
  196    HG   SER  89           HG       SER  89  15.110  -2.550  17.560
  197    H    SER  90           H        SER  90  10.870  -3.530  17.610
  198    HG   SER  90           HG       SER  90   8.180  -1.610  14.810
  199    H    LYS  91           H        LYS  91  11.790   0.480  17.670
  200   1HZ   LYS  91           HZ3      LYS  91  14.770   1.090  17.230
  201   2HZ   LYS  91           HZ1      LYS  91  16.250   0.410  17.050
  202   3HZ   LYS  91           HZ2      LYS  91  14.900  -0.510  16.990
  203    OH   TYR  92           OH       TYR  92   4.820   9.110  18.590
  204    H    TYR  92           H        TYR  92   8.570   2.110  19.140
  205    HH   TYR  92           HH       TYR  92   4.550   9.260  17.620
  206    H    ASN  94           H        ASN  94  11.430   4.840  17.580
  207   1HD2  ASN  94           HD2      ASN  94  16.430   2.960  15.360
  208   2HD2  ASN  94           HD2      ASN  94  15.700   3.100  16.940
  209    H    CYS  95           H        CYS  95  10.450   3.780  14.260
  210    H    ALA  96           H        ALA  96  10.620  -0.770  14.050
  211    OH   TYR  97           OH       TYR  97   5.830  -0.270  11.940
  212    H    TYR  97           H        TYR  97  12.270  -1.580  10.150
  213    HH   TYR  97           HH       TYR  97   5.040  -0.900  11.820
  214    H    LYS  98           H        LYS  98  10.190  -5.300   8.720
  215   1HZ   LYS  98           HZ2      LYS  98   8.480  -8.730   9.640
  216   2HZ   LYS  98           HZ3      LYS  98   8.520 -10.360   9.710
  217   3HZ   LYS  98           HZ1      LYS  98   8.660  -9.480  11.080
  218    H    THR  99           H        THR  99  12.650  -5.850   4.960
  219    HG1  THR  99           HG1      THR  99  12.290  -3.290   5.040
  220    H    THR 100           H        THR 100   9.290  -5.730   2.150
  221    HG1  THR 100           HG1      THR 100  10.060  -8.930   2.220
  222    H    GLN 101           H        GLN 101  11.590  -6.680  -1.290
  223   1HE2  GLN 101           HE2      GLN 101   8.740  -3.690  -6.170
  224   2HE2  GLN 101           HE2      GLN 101   9.710  -5.130  -6.280
  225    H    ALA 102           H        ALA 102   8.300  -5.940  -4.140
  226    H    ASN 103           H        ASN 103   8.210  -8.200  -7.840
  227   1HD2  ASN 103           HD2      ASN 103   8.060  -9.850 -11.690
  228   2HD2  ASN 103           HD2      ASN 103   6.600  -8.900 -11.750
  229    H    LYS 104           H        LYS 104   4.090  -6.940  -7.970
  230   1HZ   LYS 104           HZ3      LYS 104   5.490 -10.490  -3.290
  231   2HZ   LYS 104           HZ1      LYS 104   4.920 -11.550  -2.200
  232   3HZ   LYS 104           HZ2      LYS 104   5.990 -12.060  -3.320
  233    H    HIS 105           H        HIS 105   0.750  -9.710  -8.150
  234    HD1  HIS 105           HD1      HIS 105  -1.770  -8.990 -12.490
  235    HE2  HIS 105           HE2      HIS 105   0.540 -12.300 -12.380
  236    H    ILE 106           H        ILE 106  -2.180  -6.280  -8.880
  237    H    ILE 107           H        ILE 107  -3.950  -6.390  -4.870
  238    H    VAL 108           H        VAL 108  -6.890  -3.880  -6.140
  239    H    ALA 109           H        ALA 109  -8.550  -1.570  -2.650
  240    H    CYS 110           H        CYS 110 -12.410  -1.310  -4.780
  241    H    GLU 111           H        GLU 111 -12.800   3.110  -5.580
  242    H    GLY 112           H        GLY 112 -16.520   5.310  -5.500
  243    H    ASN 113           H        ASN 113 -15.410   9.360  -6.720
  244   1HD2  ASN 113           HD2      ASN 113 -18.910  12.040 -10.720
  245   2HD2  ASN 113           HD2      ASN 113 -18.930  11.930  -8.970
  246    OH   TYR 115           OH       TYR 115 -16.130   0.250  -8.260
  247    H    TYR 115           H        TYR 115 -13.930   7.100 -11.120
  248    HH   TYR 115           HH       TYR 115 -15.710  -0.590  -8.640
  249    H    VAL 116           H        VAL 116 -12.120   5.250  -7.560
  250    H    VAL 118           H        VAL 118  -9.720   2.340  -3.210
  251    H    HIS 119           H        HIS 119  -8.950   1.310  -1.500
  252    HD1  HIS 119           HD1      HIS 119  -8.890   2.570   2.680
  253    HE2  HIS 119           HE2      HIS 119 -12.860   1.830   2.650
  254    H    PHE 120           H        PHE 120  -5.710  -0.270   0.910
  255    H    ASP 121           H        ASP 121  -5.460  -4.180  -1.330
  256    H    ALA 122           H        ALA 122  -4.930  -6.550  -1.860
  257    H    SER 123           H        SER 123  -1.190  -8.590  -1.500
  258    HG   SER 123           HG       SER 123   1.710  -6.660  -4.250
  259    H    VAL 124           H        VAL 124  -1.220  -9.830  -5.660
   
  Start of MODEL           7
 Raw file had 259 H/Q atoms
  Start of MODEL    7
    1   1H    LYS   1           H2       LYS   1  -7.310  17.920   0.580
    2   2H    LYS   1           H3       LYS   1  -8.550  17.730  -0.490
    3   3H    LYS   1           H1       LYS   1  -8.540  19.000   0.550
    4   1HZ   LYS   1           HZ2      LYS   1 -11.910  18.190   5.580
    5   2HZ   LYS   1           HZ3      LYS   1 -12.080  16.810   6.470
    6   3HZ   LYS   1           HZ1      LYS   1 -10.630  17.210   5.830
    7    H    GLU   2           H        GLU   2  -8.510  15.790   3.340
    8    H    THR   3           H        THR   3  -9.100  13.100   0.640
    9    HG1  THR   3           HG1      THR   3  -9.740  12.310  -1.990
   10    H    ALA   4           H        ALA   4 -11.770   9.460   0.830
   11    H    ALA   5           H        ALA   5 -10.140   8.570  -1.560
   12    H    ALA   6           H        ALA   6  -7.790  10.110  -0.750
   13    H    LYS   7           H        LYS   7  -6.920   8.800   1.470
   14   1HZ   LYS   7           HZ3      LYS   7  -9.240   9.930   4.720
   15   2HZ   LYS   7           HZ1      LYS   7 -10.610   9.030   4.780
   16   3HZ   LYS   7           HZ2      LYS   7 -10.250  10.040   6.010
   17    H    PHE   8           H        PHE   8  -6.240   6.110   0.510
   18    H    GLU   9           H        GLU   9  -4.010   7.110  -1.300
   19    NH1  ARG  10           NH2      ARG  10  -2.870  10.090   6.840
   20    NH2  ARG  10           NH1      ARG  10  -4.390   8.440   7.060
   21    H    ARG  10           H        ARG  10  -2.300   8.240   0.930
   22    HE   ARG  10           HE       ARG  10  -2.900   7.100   5.660
   23   1HH1  ARG  10           HH2      ARG  10  -2.090  10.490   6.360
   24   2HH1  ARG  10           HH2      ARG  10  -3.440  10.670   7.430
   25   1HH2  ARG  10           HH1      ARG  10  -4.760   7.550   6.790
   26   2HH2  ARG  10           HH1      ARG  10  -4.930   9.050   7.630
   27    H    GLN  11           H        GLN  11  -1.740   5.900   2.560
   28   1HE2  GLN  11           HE2      GLN  11  -4.710   2.070   5.760
   29   2HE2  GLN  11           HE2      GLN  11  -2.980   2.080   6.020
   30    H    HIS  12           H        HIS  12  -0.510   4.450   0.600
   31    HD1  HIS  12           HD1      HIS  12   0.170  -0.030   0.610
   32    HE2  HIS  12           HE2      HIS  12  -3.230   0.870   2.510
   33    H    MET  13           H        MET  13   0.690   5.430  -1.330
   34    H    ASP  14           H        ASP  14   3.940   4.620  -4.240
   35    H    SER  15           H        SER  15   4.630   7.150  -5.120
   36    HG   SER  15           HG       SER  15   3.060   6.800  -7.120
   37    H    SER  16           H        SER  16   7.290   8.450  -5.600
   38    HG   SER  16           HG       SER  16  11.160   9.810  -6.610
   39    H    THR  17           H        THR  17   9.160   6.470  -5.510
   40    HG1  THR  17           HG1      THR  17  10.370   4.480  -3.010
   41    H    SER  18           H        SER  18  11.590   4.270  -8.300
   42    HG   SER  18           HG       SER  18  10.270   4.160 -10.740
   43    H    ALA  19           H        ALA  19  11.530   2.000  -6.590
   44    H    ALA  20           H        ALA  20  11.130  -1.200  -3.880
   45    H    SER  21           H        SER  21  14.640   1.100  -3.000
   46    HG   SER  21           HG       SER  21  16.890   3.240  -2.750
   47    H    SER  22           H        SER  22  15.700  -0.860  -1.250
   48    HG   SER  22           HG       SER  22  19.140  -0.360   2.210
   49    H    SER  23           H        SER  23  18.120  -3.450   1.010
   50    HG   SER  23           HG       SER  23  19.460  -5.260   3.370
   51    H    ASN  24           H        ASN  24  17.000  -2.010   3.110
   52   1HD2  ASN  24           HD2      ASN  24  15.820  -0.930   8.730
   53   2HD2  ASN  24           HD2      ASN  24  16.080  -2.350   7.750
   54    OH   TYR  25           OH       TYR  25   9.650   3.840  -1.140
   55    H    TYR  25           H        TYR  25  14.850  -1.040   2.490
   56    HH   TYR  25           HH       TYR  25   8.700   3.540  -0.920
   57    H    CYS  26           H        CYS  26  11.900  -0.800   3.580
   58    H    ASN  27           H        ASN  27  12.520   0.370   6.120
   59   1HD2  ASN  27           HD2      ASN  27  13.430   1.530  11.500
   60   2HD2  ASN  27           HD2      ASN  27  12.850   2.500  10.200
   61    H    GLN  28           H        GLN  28  13.210   3.210   6.430
   62   1HE2  GLN  28           HE2      GLN  28  16.570   2.720   7.640
   63   2HE2  GLN  28           HE2      GLN  28  16.300   4.240   8.470
   64    H    MET  29           H        MET  29  11.170   4.020   4.940
   65    H    MET  30           H        MET  30   8.670   3.240   5.830
   66    H    LYS  31           H        LYS  31   8.680   4.940   8.200
   67   1HZ   LYS  31           HZ1      LYS  31   6.560   6.810  14.120
   68   2HZ   LYS  31           HZ2      LYS  31   7.840   6.460  15.060
   69   3HZ   LYS  31           HZ3      LYS  31   7.080   7.910  15.200
   70    H    SER  32           H        SER  32   8.420   7.530   7.310
   71    HG   SER  32           HG       SER  32   8.480   8.020   5.140
   72    NH1  ARG  33           NH2      ARG  33   4.130   9.250  -0.030
   73    NH2  ARG  33           NH1      ARG  33   6.220  10.150  -0.090
   74    H    ARG  33           H        ARG  33   6.010   7.630   6.130
   75    HE   ARG  33           HE       ARG  33   6.210   9.810   2.360
   76   1HH1  ARG  33           HH2      ARG  33   3.440   8.750   0.480
   77   2HH1  ARG  33           HH2      ARG  33   4.050   9.360  -1.020
   78   1HH2  ARG  33           HH1      ARG  33   7.080  10.380   0.360
   79   2HH2  ARG  33           HH1      ARG  33   6.120  10.220  -1.080
   80    H    ASN  34           H        ASN  34   4.000   9.410   8.000
   81   1HD2  ASN  34           HD2      ASN  34  -1.990   9.540   9.840
   82   2HD2  ASN  34           HD2      ASN  34  -1.500   9.120   8.230
   83    H    LEU  35           H        LEU  35   2.580   6.590   8.130
   84    H    THR  36           H        THR  36   3.550   5.860  10.790
   85    HG1  THR  36           HG1      THR  36   6.650   5.240  11.690
   86    H    LYS  37           H        LYS  37   2.340   7.110  12.570
   87   1HZ   LYS  37           HZ2      LYS  37   6.720  11.160  13.060
   88   2HZ   LYS  37           HZ3      LYS  37   6.800  12.310  11.880
   89   3HZ   LYS  37           HZ1      LYS  37   5.940  12.590  13.240
   90    H    ASP  38           H        ASP  38   1.740   6.210  15.320
   91    NH1  ARG  39           NH2      ARG  39  -2.450   2.910  19.270
   92    NH2  ARG  39           NH1      ARG  39  -4.170   2.400  17.830
   93    H    ARG  39           H        ARG  39   0.820   4.230  16.390
   94    HE   ARG  39           HE       ARG  39  -2.670   0.640  17.010
   95   1HH1  ARG  39           HH2      ARG  39  -1.510   2.720  19.550
   96   2HH1  ARG  39           HH2      ARG  39  -2.970   3.620  19.720
   97   1HH2  ARG  39           HH1      ARG  39  -4.550   1.790  17.140
   98   2HH2  ARG  39           HH1      ARG  39  -4.710   3.150  18.200
   99    H    CYS  40           H        CYS  40   3.950   1.280  16.900
  100    H    LYS  41           H        LYS  41   3.160   0.830  12.560
  101   1HZ   LYS  41           HZ2      LYS  41  -1.930  -0.570  10.020
  102   2HZ   LYS  41           HZ3      LYS  41  -2.730   0.280   8.870
  103   3HZ   LYS  41           HZ1      LYS  41  -2.680  -1.350   8.790
  104    H    VAL  43           H        VAL  43   1.290  -4.080  10.010
  105    H    ASN  44           H        ASN  44   3.270  -3.900   6.310
  106   1HD2  ASN  44           HD2      ASN  44   1.770   1.440   3.730
  107   2HD2  ASN  44           HD2      ASN  44   3.120   0.970   4.710
  108    H    THR  45           H        THR  45   1.150  -1.980   3.030
  109    HG1  THR  45           HG1      THR  45   2.050  -5.370   2.010
  110    H    PHE  46           H        PHE  46   4.610  -1.510   0.640
  111    H    VAL  47           H        VAL  47   3.190   1.550  -2.230
  112    H    HIS  48           H        HIS  48   4.900   0.220  -5.800
  113    HD1  HIS  48           HD1      HIS  48   8.630   3.280  -4.910
  114    HE2  HIS  48           HE2      HIS  48   9.020  -0.060  -2.660
  115    H    GLU  49           H        GLU  49   3.370   2.920  -7.070
  116    H    SER  50           H        SER  50   2.470   5.220 -10.750
  117    HG   SER  50           HG       SER  50   1.330   6.030 -12.340
  118    H    LEU  51           H        LEU  51  -0.570   8.120  -8.680
  119    H    ALA  52           H        ALA  52  -2.240   8.080 -11.030
  120    H    ASP  53           H        ASP  53  -1.300   5.380 -12.030
  121    H    VAL  54           H        VAL  54  -3.020   3.950 -10.530
  122    H    GLN  55           H        GLN  55  -5.520   4.350  -9.770
  123   1HE2  GLN  55           HE2      GLN  55  -8.510   8.930 -11.630
  124   2HE2  GLN  55           HE2      GLN  55  -9.200   7.370 -11.230
  125    H    ALA  56           H        ALA  56  -5.420   3.080 -12.650
  126    H    VAL  57           H        VAL  57  -6.140   0.470 -11.410
  127    H    CYS  58           H        CYS  58  -8.210   0.100 -10.660
  128    H    SER  59           H        SER  59  -9.570  -0.540 -13.090
  129    HG   SER  59           HG       SER  59  -9.410  -0.200 -16.150
  130    H    GLN  60           H        GLN  60  -9.830  -3.160 -13.200
  131   1HE2  GLN  60           HE2      GLN  60  -4.170  -2.900 -15.470
  132   2HE2  GLN  60           HE2      GLN  60  -5.690  -2.030 -15.410
  133    H    LYS  61           H        LYS  61  -8.920  -6.660 -13.100
  134   1HZ   LYS  61           HZ3      LYS  61 -13.580 -11.740 -14.360
  135   2HZ   LYS  61           HZ1      LYS  61 -12.620 -12.460 -15.460
  136   3HZ   LYS  61           HZ2      LYS  61 -13.310 -13.360 -14.280
  137    H    ASN  62           H        ASN  62 -13.060  -7.920 -12.380
  138   1HD2  ASN  62           HD2      ASN  62 -15.620  -6.790  -7.300
  139   2HD2  ASN  62           HD2      ASN  62 -14.200  -6.230  -8.130
  140    H    VAL  63           H        VAL  63 -12.910  -7.930  -7.830
  141    H    ALA  64           H        ALA  64 -12.430 -11.250  -5.030
  142    H    CYS  65           H        CYS  65 -13.530  -8.310  -1.910
  143    H    LYS  66           H        LYS  66  -9.770  -8.420   0.830
  144   1HZ   LYS  66           HZ3      LYS  66  -4.150  -8.000   2.830
  145   2HZ   LYS  66           HZ1      LYS  66  -4.000  -9.140   3.980
  146   3HZ   LYS  66           HZ2      LYS  66  -3.130  -9.260   2.600
  147    H    ASN  67           H        ASN  67 -11.860  -8.410   3.100
  148   1HD2  ASN  67           HD2      ASN  67 -14.840  -5.280   3.780
  149   2HD2  ASN  67           HD2      ASN  67 -14.610  -5.970   5.360
  150    H    GLY  68           H        GLY  68 -13.690 -10.060   1.780
  151    H    GLN  69           H        GLN  69 -15.210  -8.100   1.300
  152   1HE2  GLN  69           HE2      GLN  69 -16.000  -2.030   1.540
  153   2HE2  GLN  69           HE2      GLN  69 -15.940  -2.800  -0.040
  154    H    THR  70           H        THR  70 -18.130  -6.790  -1.990
  155    HG1  THR  70           HG1      THR  70 -20.150  -6.350  -4.490
  156    H    ASN  71           H        ASN  71 -15.810  -5.260  -2.960
  157   1HD2  ASN  71           HD2      ASN  71 -15.100  -0.880  -1.630
  158   2HD2  ASN  71           HD2      ASN  71 -15.310  -0.530  -3.320
  159    H    CYS  72           H        CYS  72 -13.570  -6.050  -5.260
  160    OH   TYR  73           OH       TYR  73 -15.510  -2.060  -9.310
  161    H    TYR  73           H        TYR  73  -9.720  -4.660  -6.390
  162    HH   TYR  73           HH       TYR  73 -16.010  -2.460 -10.080
  163    H    GLN  74           H        GLN  74  -8.970  -7.170  -9.830
  164   1HE2  GLN  74           HE2      GLN  74  -4.500 -12.110 -10.570
  165   2HE2  GLN  74           HE2      GLN  74  -4.210 -10.470 -11.100
  166    H    SER  75           H        SER  75  -4.720  -6.070 -10.240
  167    HG   SER  75           HG       SER  75  -1.650  -5.890 -11.700
  168    OH   TYR  76           OH       TYR  76  -9.880  -9.080 -16.770
  169    H    TYR  76           H        TYR  76  -4.690  -6.660 -14.780
  170    HH   TYR  76           HH       TYR  76 -10.110 -10.030 -16.560
  171    H    SER  77           H        SER  77  -2.030  -6.490 -14.960
  172    HG   SER  77           HG       SER  77   0.480  -4.120 -14.970
  173    H    THR  78           H        THR  78   2.170  -7.820 -13.870
  174    HG1  THR  78           HG1      THR  78   5.170  -8.640 -12.550
  175    H    MET  79           H        MET  79   2.440  -6.110  -9.590
  176    H    SER  80           H        SER  80   5.020  -2.440  -9.600
  177    HG   SER  80           HG       SER  80   9.110  -1.407  -8.058
  178    H    ILE  81           H        ILE  81   5.800  -4.640  -5.970
  179    H    THR  82           H        THR  82   5.570  -2.320  -2.260
  180    HG1  THR  82           HG1      THR  82   8.650  -2.540  -2.950
  181    H    ASP  83           H        ASP  83   7.130  -5.350  -0.160
  182    H    CYS  84           H        CYS  84   5.300  -4.080   3.670
  183    NH1  ARG  85           NH2      ARG  85   3.240  -8.950  10.730
  184    NH2  ARG  85           NH1      ARG  85   4.680  -9.230  12.470
  185    H    ARG  85           H        ARG  85   8.220  -5.340   6.570
  186    HE   ARG  85           HE       ARG  85   6.420  -9.290  10.740
  187   1HH1  ARG  85           HH2      ARG  85   3.090  -8.920   9.740
  188   2HH1  ARG  85           HH2      ARG  85   2.470  -8.930  11.360
  189   1HH2  ARG  85           HH1      ARG  85   5.600  -9.420  12.810
  190   2HH2  ARG  85           HH1      ARG  85   3.900  -9.210  13.100
  191    H    GLU  86           H        GLU  86   6.020  -5.950  10.320
  192    H    THR  87           H        THR  87   9.850  -4.690  12.470
  193    HG1  THR  87           HG1      THR  87  11.620  -3.820  13.130
  194    H    GLY  88           H        GLY  88  11.950  -8.100  14.920
  195    H    SER  89           H        SER  89  12.840  -5.700  16.230
  196    HG   SER  89           HG       SER  89  15.060  -3.500  15.740
  197    H    SER  90           H        SER  90  10.580  -4.150  16.990
  198    HG   SER  90           HG       SER  90   8.000  -1.370  15.250
  199    H    LYS  91           H        LYS  91  10.690  -0.360  18.100
  200   1HZ   LYS  91           HZ2      LYS  91  12.520   2.490  22.340
  201   2HZ   LYS  91           HZ3      LYS  91  11.030   2.650  21.690
  202   3HZ   LYS  91           HZ1      LYS  91  11.320   3.200  23.190
  203    OH   TYR  92           OH       TYR  92   4.370   9.070  18.620
  204    H    TYR  92           H        TYR  92   7.040   1.590  19.590
  205    HH   TYR  92           HH       TYR  92   3.770   9.040  17.790
  206    H    ASN  94           H        ASN  94  10.890   4.110  18.290
  207   1HD2  ASN  94           HD2      ASN  94  13.330   1.370  19.530
  208   2HD2  ASN  94           HD2      ASN  94  13.620   1.280  17.810
  209    H    CYS  95           H        CYS  95   9.850   3.580  14.990
  210    H    ALA  96           H        ALA  96  10.210  -0.790  13.810
  211    OH   TYR  97           OH       TYR  97   5.690  -0.460  11.740
  212    H    TYR  97           H        TYR  97  12.310  -1.380  10.000
  213    HH   TYR  97           HH       TYR  97   4.950  -1.150  11.620
  214    H    LYS  98           H        LYS  98  10.450  -5.090   8.640
  215   1HZ   LYS  98           HZ1      LYS  98  11.480  -9.930   5.000
  216   2HZ   LYS  98           HZ2      LYS  98  11.970 -11.460   4.730
  217   3HZ   LYS  98           HZ3      LYS  98  10.600 -11.170   5.580
  218    H    THR  99           H        THR  99  12.930  -5.690   4.910
  219    HG1  THR  99           HG1      THR  99  12.920  -3.040   4.960
  220    H    THR 100           H        THR 100   9.740  -5.580   1.930
  221    HG1  THR 100           HG1      THR 100  11.030  -8.380   2.170
  222    H    GLN 101           H        GLN 101  11.850  -6.350  -1.610
  223   1HE2  GLN 101           HE2      GLN 101   8.380  -4.330  -6.380
  224   2HE2  GLN 101           HE2      GLN 101   9.740  -5.340  -6.690
  225    H    ALA 102           H        ALA 102   8.240  -6.120  -4.010
  226    H    ASN 103           H        ASN 103   8.080  -8.700  -7.530
  227   1HD2  ASN 103           HD2      ASN 103   8.270  -4.610 -10.770
  228   2HD2  ASN 103           HD2      ASN 103   7.000  -5.640 -11.390
  229    H    LYS 104           H        LYS 104   4.150  -7.230  -7.820
  230   1HZ   LYS 104           HZ2      LYS 104   3.090 -12.220  -2.380
  231   2HZ   LYS 104           HZ3      LYS 104   4.530 -12.990  -2.180
  232   3HZ   LYS 104           HZ1      LYS 104   4.380 -11.400  -1.800
  233    H    HIS 105           H        HIS 105   0.730  -9.910  -8.030
  234    HD1  HIS 105           HD1      HIS 105  -1.840  -9.090 -12.310
  235    HE2  HIS 105           HE2      HIS 105   0.260 -12.540 -12.310
  236    H    ILE 106           H        ILE 106  -2.230  -6.480  -8.810
  237    H    ILE 107           H        ILE 107  -4.000  -6.410  -4.780
  238    H    VAL 108           H        VAL 108  -7.080  -3.970  -6.090
  239    H    ALA 109           H        ALA 109  -8.510  -1.510  -2.630
  240    H    CYS 110           H        CYS 110 -12.400  -1.140  -4.610
  241    H    GLU 111           H        GLU 111 -12.600   3.230  -5.580
  242    H    GLY 112           H        GLY 112 -16.220   5.570  -5.410
  243    H    ASN 113           H        ASN 113 -15.140   9.700  -6.410
  244   1HD2  ASN 113           HD2      ASN 113 -18.420  12.890  -9.970
  245   2HD2  ASN 113           HD2      ASN 113 -18.100  12.650  -8.270
  246    OH   TYR 115           OH       TYR 115 -15.980   0.260  -7.990
  247    H    TYR 115           H        TYR 115 -13.920   7.190 -11.020
  248    HH   TYR 115           HH       TYR 115 -15.580  -0.580  -8.400
  249    H    VAL 116           H        VAL 116 -12.050   5.360  -7.540
  250    H    VAL 118           H        VAL 118  -9.610   2.400  -3.280
  251    H    HIS 119           H        HIS 119  -8.820   1.420  -1.600
  252    HD1  HIS 119           HD1      HIS 119  -8.690   2.820   2.470
  253    HE2  HIS 119           HE2      HIS 119 -12.640   2.080   2.880
  254    H    PHE 120           H        PHE 120  -5.510   0.000   0.770
  255    H    ASP 121           H        ASP 121  -5.250  -3.980  -1.320
  256    H    ALA 122           H        ALA 122  -5.250  -6.720  -1.730
  257    H    SER 123           H        SER 123  -1.190  -8.370  -1.290
  258    HG   SER 123           HG       SER 123   1.520  -9.100  -1.540
  259    H    VAL 124           H        VAL 124  -1.070  -9.670  -5.450
   
  Start of MODEL           8
 Raw file had 259 H/Q atoms
  Start of MODEL    8
    1   1H    LYS   1           H3       LYS   1  -7.900  17.860   1.880
    2   2H    LYS   1           H1       LYS   1  -9.100  17.750   0.780
    3   3H    LYS   1           H2       LYS   1  -9.200  18.860   1.980
    4   1HZ   LYS   1           HZ3      LYS   1 -11.720  20.300  -0.100
    5   2HZ   LYS   1           HZ1      LYS   1 -12.920  19.650  -1.000
    6   3HZ   LYS   1           HZ2      LYS   1 -13.300  20.720   0.200
    7    H    GLU   2           H        GLU   2  -9.010  15.270   4.260
    8    H    THR   3           H        THR   3  -9.560  12.810   1.240
    9    HG1  THR   3           HG1      THR   3 -10.720  12.890  -0.750
   10    H    ALA   4           H        ALA   4 -12.150   9.210   1.060
   11    H    ALA   5           H        ALA   5 -10.260   8.700  -1.670
   12    H    ALA   6           H        ALA   6  -8.020  10.020  -0.720
   13    H    LYS   7           H        LYS   7  -7.470   8.450   1.480
   14   1HZ   LYS   7           HZ3      LYS   7 -11.130   6.750   6.220
   15   2HZ   LYS   7           HZ1      LYS   7 -11.630   8.290   6.490
   16   3HZ   LYS   7           HZ2      LYS   7 -11.620   7.700   4.970
   17    H    PHE   8           H        PHE   8  -6.630   5.840   0.520
   18    H    GLU   9           H        GLU   9  -4.380   6.970  -1.090
   19    NH1  ARG  10           NH2      ARG  10  -3.070   9.820   7.760
   20    NH2  ARG  10           NH1      ARG  10  -5.120   8.980   7.270
   21    H    ARG  10           H        ARG  10  -2.840   8.060   1.340
   22    HE   ARG  10           HE       ARG  10  -3.840   7.270   6.030
   23   1HH1  ARG  10           HH2      ARG  10  -2.080   9.770   7.660
   24   2HH1  ARG  10           HH2      ARG  10  -3.490  10.480   8.370
   25   1HH2  ARG  10           HH1      ARG  10  -5.710   8.350   6.760
   26   2HH2  ARG  10           HH1      ARG  10  -5.500   9.640   7.910
   27    H    GLN  11           H        GLN  11  -2.210   5.690   2.800
   28   1HE2  GLN  11           HE2      GLN  11  -5.920   3.090   5.790
   29   2HE2  GLN  11           HE2      GLN  11  -4.890   4.470   6.120
   30    H    HIS  12           H        HIS  12  -0.870   4.320   0.880
   31    HD1  HIS  12           HD1      HIS  12  -0.130  -0.270   0.980
   32    HE2  HIS  12           HE2      HIS  12  -3.600   0.630   2.810
   33    H    MET  13           H        MET  13   0.440   5.310  -0.940
   34    H    ASP  14           H        ASP  14   3.690   4.610  -4.040
   35    H    SER  15           H        SER  15   4.660   7.080  -4.870
   36    HG   SER  15           HG       SER  15   4.490   9.870  -6.500
   37    H    SER  16           H        SER  16   7.200   8.460  -4.930
   38    HG   SER  16           HG       SER  16   9.620   7.920  -3.090
   39    H    THR  17           H        THR  17   9.000   6.350  -5.070
   40    HG1  THR  17           HG1      THR  17  10.100   4.400  -2.480
   41    H    SER  18           H        SER  18  11.560   4.080  -7.630
   42    HG   SER  18           HG       SER  18  10.370   3.980 -10.370
   43    H    ALA  19           H        ALA  19  11.470   1.890  -5.890
   44    H    ALA  20           H        ALA  20  11.240  -1.460  -3.330
   45    H    SER  21           H        SER  21  14.430   1.100  -2.060
   46    HG   SER  21           HG       SER  21  16.570   3.330  -1.330
   47    H    SER  22           H        SER  22  15.680  -0.550  -0.160
   48    HG   SER  22           HG       SER  22  17.440   0.800   3.200
   49    H    SER  23           H        SER  23  18.020  -3.330   2.150
   50    HG   SER  23           HG       SER  23  19.040  -4.980   4.960
   51    H    ASN  24           H        ASN  24  16.900  -1.700   4.200
   52   1HD2  ASN  24           HD2      ASN  24  17.660   2.450   5.530
   53   2HD2  ASN  24           HD2      ASN  24  16.280   1.970   6.450
   54    OH   TYR  25           OH       TYR  25   9.460   3.710  -0.920
   55    H    TYR  25           H        TYR  25  14.670  -0.790   3.280
   56    HH   TYR  25           HH       TYR  25   8.510   3.400  -0.740
   57    H    CYS  26           H        CYS  26  11.580  -0.830   4.050
   58    H    ASN  27           H        ASN  27  11.940   0.170   6.770
   59   1HD2  ASN  27           HD2      ASN  27  14.410  -1.660   9.960
   60   2HD2  ASN  27           HD2      ASN  27  14.250  -0.070  10.670
   61    H    GLN  28           H        GLN  28  12.680   2.970   6.890
   62   1HE2  GLN  28           HE2      GLN  28  17.200   6.330   6.240
   63   2HE2  GLN  28           HE2      GLN  28  15.820   7.370   6.540
   64    H    MET  29           H        MET  29  10.760   3.800   5.170
   65    H    MET  30           H        MET  30   8.180   3.190   6.140
   66    H    LYS  31           H        LYS  31   8.300   5.490   7.890
   67   1HZ   LYS  31           HZ1      LYS  31   7.980   6.700  12.890
   68   2HZ   LYS  31           HZ2      LYS  31   9.060   6.370  14.070
   69   3HZ   LYS  31           HZ3      LYS  31   8.320   7.840  13.990
   70    H    SER  32           H        SER  32   8.410   7.790   6.690
   71    HG   SER  32           HG       SER  32   8.170   8.380   3.420
   72    NH1  ARG  33           NH1      ARG  33   5.790  10.360   1.490
   73    NH2  ARG  33           NH2      ARG  33   6.200   9.320  -0.500
   74    H    ARG  33           H        ARG  33   6.100   7.630   5.100
   75    HE   ARG  33           HE       ARG  33   4.530   7.670   0.220
   76   1HH1  ARG  33           HH1      ARG  33   5.290  10.410   2.350
   77   2HH1  ARG  33           HH1      ARG  33   6.470  11.050   1.250
   78   1HH2  ARG  33           HH2      ARG  33   6.000   8.590  -1.150
   79   2HH2  ARG  33           HH2      ARG  33   6.890  10.010  -0.710
   80    H    ASN  34           H        ASN  34   3.270   9.990   6.590
   81   1HD2  ASN  34           HD2      ASN  34   3.270  12.890   6.550
   82   2HD2  ASN  34           HD2      ASN  34   1.920  11.860   6.160
   83    H    LEU  35           H        LEU  35   2.970   7.020   8.560
   84    H    THR  36           H        THR  36   3.920   5.760  10.430
   85    HG1  THR  36           HG1      THR  36   6.040   5.490  10.520
   86    H    LYS  37           H        LYS  37   2.490   7.310  12.720
   87   1HZ   LYS  37           HZ3      LYS  37   4.970  12.030  10.660
   88   2HZ   LYS  37           HZ1      LYS  37   6.490  12.250  10.070
   89   3HZ   LYS  37           HZ2      LYS  37   5.540  11.060   9.470
   90    H    ASP  38           H        ASP  38   3.060   6.790  15.640
   91    NH1  ARG  39           NH2      ARG  39  -0.090   5.220  14.930
   92    NH2  ARG  39           NH1      ARG  39  -2.280   5.640  14.980
   93    H    ARG  39           H        ARG  39   1.580   5.240  16.760
   94    HE   ARG  39           HE       ARG  39  -2.310   4.340  17.050
   95   1HH1  ARG  39           HH2      ARG  39   0.610   4.520  15.110
   96   2HH1  ARG  39           HH2      ARG  39  -0.030   5.750  14.090
   97   1HH2  ARG  39           HH1      ARG  39  -3.190   5.430  15.310
   98   2HH2  ARG  39           HH1      ARG  39  -2.160   6.130  14.110
   99    H    CYS  40           H        CYS  40   4.480   1.990  17.020
  100    H    LYS  41           H        LYS  41   3.710   1.340  12.600
  101   1HZ   LYS  41           HZ3      LYS  41  -0.420   1.280   7.000
  102   2HZ   LYS  41           HZ1      LYS  41  -1.980   0.770   7.030
  103   3HZ   LYS  41           HZ2      LYS  41  -1.530   2.080   7.900
  104    H    VAL  43           H        VAL  43   1.090  -3.280  10.270
  105    H    ASN  44           H        ASN  44   2.910  -3.780   6.540
  106   1HD2  ASN  44           HD2      ASN  44   2.890   1.620   4.790
  107   2HD2  ASN  44           HD2      ASN  44   1.230   1.190   4.950
  108    H    THR  45           H        THR  45   0.690  -2.670   3.040
  109    HG1  THR  45           HG1      THR  45   1.710  -6.070   0.860
  110    H    PHE  46           H        PHE  46   4.290  -1.630   1.040
  111    H    VAL  47           H        VAL  47   3.050   1.430  -1.960
  112    H    HIS  48           H        HIS  48   4.670   0.180  -5.640
  113    HD1  HIS  48           HD1      HIS  48   8.560   3.180  -4.440
  114    HE2  HIS  48           HE2      HIS  48   8.780  -0.260  -2.310
  115    H    GLU  49           H        GLU  49   3.280   3.040  -6.610
  116    H    SER  50           H        SER  50   2.390   5.440 -10.190
  117    HG   SER  50           HG       SER  50   1.240   6.240 -11.730
  118    H    LEU  51           H        LEU  51  -0.780   8.220  -8.180
  119    H    ALA  52           H        ALA  52  -2.350   8.240 -10.600
  120    H    ASP  53           H        ASP  53  -1.310   5.610 -11.670
  121    H    VAL  54           H        VAL  54  -2.920   4.040 -10.240
  122    H    GLN  55           H        GLN  55  -5.460   4.320  -9.540
  123   1HE2  GLN  55           HE2      GLN  55  -8.290   9.010 -11.390
  124   2HE2  GLN  55           HE2      GLN  55  -9.120   7.560 -10.870
  125    H    ALA  56           H        ALA  56  -5.270   3.110 -12.500
  126    H    VAL  57           H        VAL  57  -5.920   0.480 -11.430
  127    H    CYS  58           H        CYS  58  -8.040   0.130 -10.830
  128    H    SER  59           H        SER  59  -9.340  -0.850 -13.190
  129    HG   SER  59           HG       SER  59 -12.080   0.790 -13.980
  130    H    GLN  60           H        GLN  60  -9.450  -3.270 -13.480
  131   1HE2  GLN  60           HE2      GLN  60  -3.760  -2.550 -15.710
  132   2HE2  GLN  60           HE2      GLN  60  -5.280  -1.690 -15.690
  133    H    LYS  61           H        LYS  61  -9.090  -6.160 -13.120
  134   1HZ   LYS  61           HZ2      LYS  61 -13.320 -11.350 -15.060
  135   2HZ   LYS  61           HZ3      LYS  61 -13.430 -12.670 -14.080
  136   3HZ   LYS  61           HZ1      LYS  61 -13.300 -11.180 -13.440
  137    H    ASN  62           H        ASN  62 -12.940  -8.260 -12.760
  138   1HD2  ASN  62           HD2      ASN  62 -15.680  -6.830  -7.770
  139   2HD2  ASN  62           HD2      ASN  62 -14.290  -6.170  -8.590
  140    H    VAL  63           H        VAL  63 -12.920  -7.880  -8.280
  141    H    ALA  64           H        ALA  64 -12.630 -11.340  -5.630
  142    H    CYS  65           H        CYS  65 -13.530  -8.520  -2.320
  143    H    LYS  66           H        LYS  66  -9.810  -8.990   0.470
  144   1HZ   LYS  66           HZ2      LYS  66  -5.630 -11.870   3.590
  145   2HZ   LYS  66           HZ3      LYS  66  -5.880 -12.010   1.980
  146   3HZ   LYS  66           HZ1      LYS  66  -4.360 -11.910   2.560
  147    H    ASN  67           H        ASN  67 -12.160  -9.000   2.570
  148   1HD2  ASN  67           HD2      ASN  67 -14.930  -5.770   3.550
  149   2HD2  ASN  67           HD2      ASN  67 -14.600  -6.500   5.090
  150    H    GLY  68           H        GLY  68 -13.900 -10.430   1.240
  151    H    GLN  69           H        GLN  69 -15.260  -8.350   0.880
  152   1HE2  GLN  69           HE2      GLN  69 -15.710  -2.280   1.290
  153   2HE2  GLN  69           HE2      GLN  69 -16.270  -3.100  -0.150
  154    H    THR  70           H        THR  70 -18.140  -7.080  -2.460
  155    HG1  THR  70           HG1      THR  70 -19.930  -6.290  -5.120
  156    H    ASN  71           H        ASN  71 -15.710  -5.550  -3.330
  157   1HD2  ASN  71           HD2      ASN  71 -14.840  -1.170  -1.800
  158   2HD2  ASN  71           HD2      ASN  71 -15.110  -0.780  -3.470
  159    H    CYS  72           H        CYS  72 -13.530  -6.110  -5.600
  160    OH   TYR  73           OH       TYR  73 -15.420  -1.980  -9.710
  161    H    TYR  73           H        TYR  73  -9.670  -4.730  -6.580
  162    HH   TYR  73           HH       TYR  73 -15.940  -2.470 -10.420
  163    H    GLN  74           H        GLN  74  -8.950  -7.080 -10.120
  164   1HE2  GLN  74           HE2      GLN  74  -4.620 -12.190 -10.740
  165   2HE2  GLN  74           HE2      GLN  74  -4.390 -10.630 -11.490
  166    H    SER  75           H        SER  75  -4.600  -6.160 -10.450
  167    HG   SER  75           HG       SER  75  -1.520  -5.780 -11.830
  168    OH   TYR  76           OH       TYR  76  -9.690  -8.680 -17.240
  169    H    TYR  76           H        TYR  76  -4.510  -6.470 -15.000
  170    HH   TYR  76           HH       TYR  76 -10.100  -7.750 -17.180
  171    H    SER  77           H        SER  77  -1.910  -6.440 -15.030
  172    HG   SER  77           HG       SER  77   2.390  -5.170 -15.690
  173    H    THR  78           H        THR  78   2.310  -7.630 -13.940
  174    HG1  THR  78           HG1      THR  78   5.080  -7.130 -12.630
  175    H    MET  79           H        MET  79   2.330  -6.070  -9.620
  176    H    SER  80           H        SER  80   4.590  -2.220  -9.370
  177    HG   SER  80           HG       SER  80   8.553  -0.841  -7.845
  178    H    ILE  81           H        ILE  81   5.810  -4.510  -5.820
  179    H    THR  82           H        THR  82   5.200  -2.500  -1.960
  180    HG1  THR  82           HG1      THR  82   8.280  -2.960  -2.580
  181    H    ASP  83           H        ASP  83   6.990  -5.440   0.250
  182    H    CYS  84           H        CYS  84   4.990  -4.270   4.010
  183    NH1  ARG  85           NH2      ARG  85   6.510 -12.200   6.670
  184    NH2  ARG  85           NH1      ARG  85   8.620 -12.050   7.470
  185    H    ARG  85           H        ARG  85   7.680  -5.790   6.810
  186    HE   ARG  85           HE       ARG  85   7.630 -10.200   8.900
  187   1HH1  ARG  85           HH2      ARG  85   5.580 -11.830   6.660
  188   2HH1  ARG  85           HH2      ARG  85   6.780 -12.940   6.070
  189   1HH2  ARG  85           HH1      ARG  85   9.330 -11.590   8.000
  190   2HH2  ARG  85           HH1      ARG  85   8.850 -12.800   6.860
  191    H    GLU  86           H        GLU  86   5.470  -5.800  10.550
  192    H    THR  87           H        THR  87   9.460  -5.160  12.590
  193    HG1  THR  87           HG1      THR  87  13.010  -8.470  12.740
  194    H    GLY  88           H        GLY  88  11.440  -8.170  15.420
  195    H    SER  89           H        SER  89  12.820  -5.880  16.430
  196    HG   SER  89           HG       SER  89  14.520  -3.580  15.410
  197    H    SER  90           H        SER  90  10.590  -3.830  17.290
  198    HG   SER  90           HG       SER  90   7.840  -0.930  15.410
  199    H    LYS  91           H        LYS  91  11.140   0.160  17.780
  200   1HZ   LYS  91           HZ2      LYS  91  13.880  -1.470  23.240
  201   2HZ   LYS  91           HZ3      LYS  91  14.570   0.030  23.260
  202   3HZ   LYS  91           HZ1      LYS  91  13.390  -0.340  24.340
  203    OH   TYR  92           OH       TYR  92   6.370   9.680  16.930
  204    H    TYR  92           H        TYR  92   7.980   2.300  19.250
  205    HH   TYR  92           HH       TYR  92   5.640  10.240  17.310
  206    H    ASN  94           H        ASN  94  11.770   4.180  17.840
  207   1HD2  ASN  94           HD2      ASN  94  15.380   0.500  15.550
  208   2HD2  ASN  94           HD2      ASN  94  13.920   0.600  16.500
  209    H    CYS  95           H        CYS  95  10.770   3.520  14.260
  210    H    ALA  96           H        ALA  96  10.090  -0.930  13.820
  211    OH   TYR  97           OH       TYR  97   5.960  -0.230  12.090
  212    H    TYR  97           H        TYR  97  12.040  -2.190  10.170
  213    HH   TYR  97           HH       TYR  97   5.140  -0.830  12.080
  214    H    LYS  98           H        LYS  98   9.960  -5.860   8.960
  215   1HZ   LYS  98           HZ3      LYS  98   9.270 -11.590  10.310
  216   2HZ   LYS  98           HZ1      LYS  98  10.350 -12.170  11.390
  217   3HZ   LYS  98           HZ2      LYS  98   9.440 -10.870  11.770
  218    H    THR  99           H        THR  99  12.570  -5.810   5.390
  219    HG1  THR  99           HG1      THR  99  12.600  -3.350   5.550
  220    H    THR 100           H        THR 100   9.470  -5.680   2.280
  221    HG1  THR 100           HG1      THR 100  10.660  -8.590   2.460
  222    H    GLN 101           H        GLN 101  11.620  -6.500  -1.310
  223   1HE2  GLN 101           HE2      GLN 101   9.130  -5.050  -6.860
  224   2HE2  GLN 101           HE2      GLN 101   8.720  -4.450  -5.280
  225    H    ALA 102           H        ALA 102   8.020  -6.120  -3.710
  226    H    ASN 103           H        ASN 103   7.780  -8.770  -7.210
  227   1HD2  ASN 103           HD2      ASN 103  10.460  -6.050  -8.920
  228   2HD2  ASN 103           HD2      ASN 103   9.950  -7.590  -9.570
  229    H    LYS 104           H        LYS 104   4.070  -7.150  -7.770
  230   1HZ   LYS 104           HZ1      LYS 104   2.740 -12.460  -2.620
  231   2HZ   LYS 104           HZ2      LYS 104   4.210 -12.890  -2.060
  232   3HZ   LYS 104           HZ3      LYS 104   3.680 -11.340  -1.880
  233    H    HIS 105           H        HIS 105   0.720  -9.900  -8.170
  234    HD1  HIS 105           HD1      HIS 105  -1.800  -9.110 -12.540
  235    HE2  HIS 105           HE2      HIS 105   0.610 -12.350 -12.550
  236    H    ILE 106           H        ILE 106  -2.170  -6.420  -8.920
  237    H    ILE 107           H        ILE 107  -4.080  -6.570  -4.960
  238    H    VAL 108           H        VAL 108  -7.160  -4.000  -6.240
  239    H    ALA 109           H        ALA 109  -8.540  -1.490  -2.780
  240    H    CYS 110           H        CYS 110 -12.270  -1.320  -4.860
  241    H    GLU 111           H        GLU 111 -12.630   3.120  -5.630
  242    H    GLY 112           H        GLY 112 -16.330   5.420  -5.640
  243    H    ASN 113           H        ASN 113 -15.160   9.520  -6.710
  244   1HD2  ASN 113           HD2      ASN 113 -18.940  12.260 -10.540
  245   2HD2  ASN 113           HD2      ASN 113 -18.810  12.140  -8.800
  246    OH   TYR 115           OH       TYR 115 -15.940   0.190  -8.350
  247    H    TYR 115           H        TYR 115 -13.820   7.120 -11.200
  248    HH   TYR 115           HH       TYR 115 -15.640  -0.640  -8.880
  249    H    VAL 116           H        VAL 116 -12.070   5.280  -7.610
  250    H    VAL 118           H        VAL 118  -9.670   2.290  -3.280
  251    H    HIS 119           H        HIS 119  -8.830   1.280  -1.630
  252    HD1  HIS 119           HD1      HIS 119  -8.830   2.600   2.520
  253    HE2  HIS 119           HE2      HIS 119 -12.800   1.880   2.570
  254    H    PHE 120           H        PHE 120  -5.730  -0.370   0.910
  255    H    ASP 121           H        ASP 121  -5.440  -4.170  -1.420
  256    H    ALA 122           H        ALA 122  -5.350  -6.770  -1.970
  257    H    SER 123           H        SER 123  -1.420  -8.710  -1.390
  258    HG   SER 123           HG       SER 123   1.140  -9.630  -1.730
  259    H    VAL 124           H        VAL 124  -1.220  -9.710  -5.570
   
  Start of MODEL           9
 Raw file had 259 H/Q atoms
  Start of MODEL    9
    1   1H    LYS   1           H1       LYS   1  -9.590  17.720   2.240
    2   2H    LYS   1           H2       LYS   1  -9.550  18.790   3.470
    3   3H    LYS   1           H3       LYS   1  -8.150  18.150   2.880
    4   1HZ   LYS   1           HZ2      LYS   1 -12.480  14.320   3.530
    5   2HZ   LYS   1           HZ3      LYS   1 -13.130  13.310   4.650
    6   3HZ   LYS   1           HZ1      LYS   1 -14.100  14.180   3.660
    7    H    GLU   2           H        GLU   2  -8.640  14.850   5.420
    8    H    THR   3           H        THR   3  -9.120  12.980   1.960
    9    HG1  THR   3           HG1      THR   3  -9.550  12.630  -0.700
   10    H    ALA   4           H        ALA   4 -11.750   9.240   1.570
   11    H    ALA   5           H        ALA   5 -10.230   8.540  -0.830
   12    H    ALA   6           H        ALA   6  -7.940  10.090  -0.230
   13    H    LYS   7           H        LYS   7  -6.940   8.630   1.850
   14   1HZ   LYS   7           HZ1      LYS   7  -8.340   3.660   5.250
   15   2HZ   LYS   7           HZ2      LYS   7  -7.090   2.890   4.530
   16   3HZ   LYS   7           HZ3      LYS   7  -7.600   2.450   6.050
   17    H    PHE   8           H        PHE   8  -6.320   6.050   0.710
   18    H    GLU   9           H        GLU   9  -4.170   7.120  -1.140
   19    NH1  ARG  10           NH1      ARG  10  -2.250   9.130   7.730
   20    NH2  ARG  10           NH2      ARG  10  -3.970   7.660   7.580
   21    H    ARG  10           H        ARG  10  -2.390   8.120   1.120
   22    HE   ARG  10           HE       ARG  10  -2.710   6.700   5.690
   23   1HH1  ARG  10           HH1      ARG  10  -1.390   9.490   7.360
   24   2HH1  ARG  10           HH1      ARG  10  -2.670   9.540   8.530
   25   1HH2  ARG  10           HH2      ARG  10  -4.470   6.930   7.120
   26   2HH2  ARG  10           HH2      ARG  10  -4.360   8.090   8.400
   27    H    GLN  11           H        GLN  11  -1.740   5.750   2.640
   28   1HE2  GLN  11           HE2      GLN  11  -4.460   1.920   6.390
   29   2HE2  GLN  11           HE2      GLN  11  -3.030   2.760   6.950
   30    H    HIS  12           H        HIS  12  -0.530   4.470   0.570
   31    HD1  HIS  12           HD1      HIS  12  -0.030  -0.030   0.470
   32    HE2  HIS  12           HE2      HIS  12  -3.340   0.960   2.510
   33    H    MET  13           H        MET  13   0.800   5.490  -1.300
   34    H    ASP  14           H        ASP  14   3.930   4.410  -4.320
   35    H    SER  15           H        SER  15   4.810   6.700  -5.590
   36    HG   SER  15           HG       SER  15   6.480   7.160  -9.460
   37    H    SER  16           H        SER  16   7.420   8.270  -5.740
   38    HG   SER  16           HG       SER  16   8.700  10.920  -4.790
   39    H    THR  17           H        THR  17   9.280   6.100  -5.460
   40    HG1  THR  17           HG1      THR  17  10.240   4.300  -2.680
   41    H    SER  18           H        SER  18  11.970   3.730  -7.770
   42    HG   SER  18           HG       SER  18  10.510   3.560 -10.330
   43    H    ALA  19           H        ALA  19  11.670   1.600  -6.010
   44    H    ALA  20           H        ALA  20  11.140  -1.670  -3.410
   45    H    SER  21           H        SER  21  14.820  -0.060  -1.180
   46    HG   SER  21           HG       SER  21  17.310  -0.670   0.970
   47    H    SER  22           H        SER  22  15.410  -2.400   0.310
   48    HG   SER  22           HG       SER  22  18.520  -6.220   1.060
   49    H    SER  23           H        SER  23  16.510  -5.550   2.910
   50    HG   SER  23           HG       SER  23  14.510  -5.420   6.770
   51    H    ASN  24           H        ASN  24  16.440  -2.870   4.080
   52   1HD2  ASN  24           HD2      ASN  24  17.820   1.020   2.480
   53   2HD2  ASN  24           HD2      ASN  24  17.510   1.450   4.140
   54    OH   TYR  25           OH       TYR  25   9.660   3.610  -1.080
   55    H    TYR  25           H        TYR  25  14.620  -1.150   3.170
   56    HH   TYR  25           HH       TYR  25   8.680   3.420  -0.890
   57    H    CYS  26           H        CYS  26  11.410  -0.850   4.170
   58    H    ASN  27           H        ASN  27  12.070   0.110   6.830
   59   1HD2  ASN  27           HD2      ASN  27  14.640  -1.950   9.840
   60   2HD2  ASN  27           HD2      ASN  27  14.800  -0.310  10.410
   61    H    GLN  28           H        GLN  28  12.990   2.890   6.830
   62   1HE2  GLN  28           HE2      GLN  28  16.180   4.090   9.670
   63   2HE2  GLN  28           HE2      GLN  28  15.450   5.650   9.380
   64    H    MET  29           H        MET  29  11.180   3.850   5.170
   65    H    MET  30           H        MET  30   8.630   3.560   6.140
   66    H    LYS  31           H        LYS  31   8.590   5.370   8.170
   67   1HZ   LYS  31           HZ2      LYS  31   9.950   7.600  13.680
   68   2HZ   LYS  31           HZ3      LYS  31  11.450   6.960  13.830
   69   3HZ   LYS  31           HZ1      LYS  31  11.260   8.590  13.650
   70    H    SER  32           H        SER  32   8.630   7.940   7.040
   71    HG   SER  32           HG       SER  32   7.630  11.520   5.070
   72    NH1  ARG  33           NH2      ARG  33   3.190   7.720   0.350
   73    NH2  ARG  33           NH1      ARG  33   4.960   8.690  -0.660
   74    H    ARG  33           H        ARG  33   6.030   8.090   6.190
   75    HE   ARG  33           HE       ARG  33   5.440   9.660   1.580
   76   1HH1  ARG  33           HH2      ARG  33   2.630   7.550   1.160
   77   2HH1  ARG  33           HH2      ARG  33   2.970   7.290  -0.520
   78   1HH2  ARG  33           HH1      ARG  33   5.760   9.290  -0.680
   79   2HH2  ARG  33           HH1      ARG  33   4.670   8.190  -1.480
   80    H    ASN  34           H        ASN  34   4.770   9.530   8.360
   81   1HD2  ASN  34           HD2      ASN  34   3.060  13.040   7.880
   82   2HD2  ASN  34           HD2      ASN  34   2.080  11.650   7.460
   83    H    LEU  35           H        LEU  35   3.210   7.050   8.550
   84    H    THR  36           H        THR  36   4.390   5.940  10.910
   85    HG1  THR  36           HG1      THR  36   7.470   5.420  12.210
   86    H    LYS  37           H        LYS  37   3.400   7.240  12.810
   87   1HZ   LYS  37           HZ2      LYS  37   6.610  11.650  11.400
   88   2HZ   LYS  37           HZ3      LYS  37   8.250  11.630  11.500
   89   3HZ   LYS  37           HZ1      LYS  37   7.450  10.360  10.860
   90    H    ASP  38           H        ASP  38   2.720   6.330  15.350
   91    NH1  ARG  39           NH2      ARG  39  -2.060  -0.950  17.190
   92    NH2  ARG  39           NH1      ARG  39  -3.600   0.600  16.600
   93    H    ARG  39           H        ARG  39   1.510   4.350  16.310
   94    HE   ARG  39           HE       ARG  39  -2.020   2.230  17.670
   95   1HH1  ARG  39           HH2      ARG  39  -1.170  -1.180  17.570
   96   2HH1  ARG  39           HH2      ARG  39  -2.660  -1.650  16.800
   97   1HH2  ARG  39           HH1      ARG  39  -3.930   1.540  16.530
   98   2HH2  ARG  39           HH1      ARG  39  -4.130  -0.150  16.220
   99    H    CYS  40           H        CYS  40   4.560   1.340  16.940
  100    H    LYS  41           H        LYS  41   3.710   1.020  12.540
  101   1HZ   LYS  41           HZ3      LYS  41  -0.340  -0.720   8.010
  102   2HZ   LYS  41           HZ1      LYS  41  -1.730  -0.240   7.320
  103   3HZ   LYS  41           HZ2      LYS  41  -0.360   0.570   7.000
  104    H    VAL  43           H        VAL  43   1.080  -3.280  10.070
  105    H    ASN  44           H        ASN  44   2.800  -3.950   6.290
  106   1HD2  ASN  44           HD2      ASN  44   2.280   1.930   4.220
  107   2HD2  ASN  44           HD2      ASN  44   2.570   1.640   5.930
  108    H    THR  45           H        THR  45   0.990  -1.920   2.980
  109    HG1  THR  45           HG1      THR  45   1.290  -5.270   2.130
  110    H    PHE  46           H        PHE  46   4.400  -1.520   0.790
  111    H    VAL  47           H        VAL  47   3.080   1.460  -2.230
  112    H    HIS  48           H        HIS  48   4.820  -0.010  -5.740
  113    HD1  HIS  48           HD1      HIS  48   8.610   2.940  -4.680
  114    HE2  HIS  48           HE2      HIS  48   8.970  -0.430  -2.470
  115    H    GLU  49           H        GLU  49   3.520   2.800  -6.890
  116    H    SER  50           H        SER  50   3.070   5.260 -10.530
  117    HG   SER  50           HG       SER  50   1.780   5.760 -12.200
  118    H    LEU  51           H        LEU  51  -0.140   8.030  -8.490
  119    H    ALA  52           H        ALA  52  -1.730   8.110 -11.080
  120    H    ASP  53           H        ASP  53  -0.780   5.390 -12.240
  121    H    VAL  54           H        VAL  54  -2.250   3.840 -10.410
  122    H    GLN  55           H        GLN  55  -4.650   4.500 -10.300
  123   1HE2  GLN  55           HE2      GLN  55  -8.630   9.020 -10.620
  124   2HE2  GLN  55           HE2      GLN  55  -8.990   7.340 -10.300
  125    H    ALA  56           H        ALA  56  -5.070   3.290 -12.860
  126    H    VAL  57           H        VAL  57  -6.000   0.780 -11.680
  127    H    CYS  58           H        CYS  58  -8.190   0.720 -10.840
  128    H    SER  59           H        SER  59  -9.570   0.380 -13.180
  129    HG   SER  59           HG       SER  59  -9.190   0.440 -16.280
  130    H    GLN  60           H        GLN  60 -10.300  -2.250 -13.250
  131   1HE2  GLN  60           HE2      GLN  60  -4.480  -2.950 -15.430
  132   2HE2  GLN  60           HE2      GLN  60  -5.830  -1.840 -15.580
  133    H    LYS  61           H        LYS  61  -9.920  -6.390 -13.900
  134   1HZ   LYS  61           HZ2      LYS  61 -13.720  -7.090 -17.480
  135   2HZ   LYS  61           HZ3      LYS  61 -12.190  -7.600 -17.770
  136   3HZ   LYS  61           HZ1      LYS  61 -13.380  -7.920 -18.850
  137    H    ASN  62           H        ASN  62 -14.010  -7.070 -12.370
  138   1HD2  ASN  62           HD2      ASN  62 -16.050  -6.110  -7.100
  139   2HD2  ASN  62           HD2      ASN  62 -14.670  -5.470  -7.990
  140    H    VAL  63           H        VAL  63 -13.300  -7.260  -7.910
  141    H    ALA  64           H        ALA  64 -12.470 -10.650  -5.260
  142    H    CYS  65           H        CYS  65 -13.380  -7.840  -1.950
  143    H    LYS  66           H        LYS  66  -9.460  -7.830   0.480
  144   1HZ   LYS  66           HZ2      LYS  66  -5.100  -8.730   4.650
  145   2HZ   LYS  66           HZ3      LYS  66  -4.700 -10.170   5.370
  146   3HZ   LYS  66           HZ1      LYS  66  -4.080  -9.740   3.900
  147    H    ASN  67           H        ASN  67 -11.250  -7.870   2.730
  148   1HD2  ASN  67           HD2      ASN  67 -14.180  -4.680   3.340
  149   2HD2  ASN  67           HD2      ASN  67 -13.720  -5.180   4.930
  150    H    GLY  68           H        GLY  68 -13.020  -9.590   1.690
  151    H    GLN  69           H        GLN  69 -14.700  -7.700   1.220
  152   1HE2  GLN  69           HE2      GLN  69 -14.670  -1.720   0.740
  153   2HE2  GLN  69           HE2      GLN  69 -14.330  -2.800  -0.590
  154    H    THR  70           H        THR  70 -18.110  -6.700  -1.730
  155    HG1  THR  70           HG1      THR  70 -20.100  -6.120  -4.180
  156    H    ASN  71           H        ASN  71 -16.030  -5.120  -2.870
  157   1HD2  ASN  71           HD2      ASN  71 -16.130  -0.503  -1.898
  158   2HD2  ASN  71           HD2      ASN  71 -17.242  -0.512  -3.208
  159    H    CYS  72           H        CYS  72 -13.750  -5.800  -5.250
  160    OH   TYR  73           OH       TYR  73 -15.640  -1.350  -9.780
  161    H    TYR  73           H        TYR  73  -9.990  -4.170  -6.710
  162    HH   TYR  73           HH       TYR  73 -16.100  -1.720 -10.600
  163    H    GLN  74           H        GLN  74  -9.390  -6.550 -10.310
  164   1HE2  GLN  74           HE2      GLN  74  -4.150  -9.000  -7.870
  165   2HE2  GLN  74           HE2      GLN  74  -4.160  -8.240  -9.440
  166    H    SER  75           H        SER  75  -4.830  -6.040 -10.160
  167    HG   SER  75           HG       SER  75  -1.600  -6.010 -11.570
  168    OH   TYR  76           OH       TYR  76  -8.680  -7.590 -13.110
  169    H    TYR  76           H        TYR  76  -4.800  -6.730 -14.580
  170    HH   TYR  76           HH       TYR  76  -8.100  -6.810 -12.790
  171    H    SER  77           H        SER  77  -2.050  -6.700 -14.820
  172    HG   SER  77           HG       SER  77   0.020  -4.260 -15.140
  173    H    THR  78           H        THR  78   2.180  -7.950 -13.800
  174    HG1  THR  78           HG1      THR  78   5.220  -8.620 -12.450
  175    H    MET  79           H        MET  79   2.320  -6.170  -9.570
  176    H    SER  80           H        SER  80   5.010  -2.680  -9.700
  177    HG   SER  80           HG       SER  80   8.767  -1.175  -8.136
  178    H    ILE  81           H        ILE  81   5.740  -4.730  -5.900
  179    H    THR  82           H        THR  82   5.330  -2.470  -2.160
  180    HG1  THR  82           HG1      THR  82   8.550  -2.920  -2.580
  181    H    ASP  83           H        ASP  83   6.650  -5.630  -0.130
  182    H    CYS  84           H        CYS  84   4.640  -4.700   3.770
  183    NH1  ARG  85           NH2      ARG  85   4.900 -10.610  10.210
  184    NH2  ARG  85           NH1      ARG  85   3.470  -9.370  11.460
  185    H    ARG  85           H        ARG  85   7.210  -6.410   6.640
  186    HE   ARG  85           HE       ARG  85   2.510  -8.660   9.300
  187   1HH1  ARG  85           HH2      ARG  85   5.260 -10.870   9.320
  188   2HH1  ARG  85           HH2      ARG  85   5.320 -10.960  11.050
  189   1HH2  ARG  85           HH1      ARG  85   2.730  -8.710  11.550
  190   2HH2  ARG  85           HH1      ARG  85   3.920  -9.730  12.280
  191    H    GLU  86           H        GLU  86   5.070  -6.430  10.530
  192    H    THR  87           H        THR  87   9.240  -5.630  12.260
  193    HG1  THR  87           HG1      THR  87  11.370  -4.930  13.020
  194    H    GLY  88           H        GLY  88  10.730  -8.990  15.190
  195    H    SER  89           H        SER  89  11.960  -6.670  16.080
  196    HG   SER  89           HG       SER  89  14.380  -5.160  15.370
  197    H    SER  90           H        SER  90  10.290  -4.550  16.870
  198    HG   SER  90           HG       SER  90   8.210  -2.930  17.480
  199    H    LYS  91           H        LYS  91  11.740  -0.460  17.030
  200   1HZ   LYS  91           HZ3      LYS  91  12.730   3.770  21.240
  201   2HZ   LYS  91           HZ1      LYS  91  12.780   4.210  22.810
  202   3HZ   LYS  91           HZ2      LYS  91  14.150   4.230  21.920
  203    OH   TYR  92           OH       TYR  92   5.320   8.890  18.870
  204    H    TYR  92           H        TYR  92   9.210   2.010  19.830
  205    HH   TYR  92           HH       TYR  92   4.700   8.930  18.060
  206    H    ASN  94           H        ASN  94  11.630   4.270  16.840
  207   1HD2  ASN  94           HD2      ASN  94  14.890   2.620  18.150
  208   2HD2  ASN  94           HD2      ASN  94  14.770   2.020  16.520
  209    H    CYS  95           H        CYS  95  10.360   2.970  13.770
  210    H    ALA  96           H        ALA  96  10.280  -1.640  13.360
  211    OH   TYR  97           OH       TYR  97   5.920  -0.400  11.350
  212    H    TYR  97           H        TYR  97  11.940  -2.750   9.570
  213    HH   TYR  97           HH       TYR  97   5.170  -1.050  11.550
  214    H    LYS  98           H        LYS  98   9.480  -6.320   8.670
  215   1HZ   LYS  98           HZ2      LYS  98   8.250 -11.180  11.180
  216   2HZ   LYS  98           HZ3      LYS  98   9.450 -11.280  12.290
  217   3HZ   LYS  98           HZ1      LYS  98   9.090  -9.850  11.580
  218    H    THR  99           H        THR  99  11.920  -6.050   5.440
  219    HG1  THR  99           HG1      THR  99  11.890  -3.540   5.840
  220    H    THR 100           H        THR 100   9.080  -6.060   2.140
  221    HG1  THR 100           HG1      THR 100   9.770  -8.740   2.670
  222    H    GLN 101           H        GLN 101  11.570  -6.610  -1.320
  223   1HE2  GLN 101           HE2      GLN 101   8.370  -4.220  -6.270
  224   2HE2  GLN 101           HE2      GLN 101   9.540  -5.480  -6.490
  225    H    ALA 102           H        ALA 102   8.070  -6.210  -3.900
  226    H    ASN 103           H        ASN 103   8.000  -8.680  -7.400
  227   1HD2  ASN 103           HD2      ASN 103   9.060  -5.100 -10.480
  228   2HD2  ASN 103           HD2      ASN 103   7.580  -5.710 -11.160
  229    H    LYS 104           H        LYS 104   4.010  -7.270  -7.650
  230   1HZ   LYS 104           HZ3      LYS 104   3.970 -13.240  -5.050
  231   2HZ   LYS 104           HZ1      LYS 104   4.790 -13.860  -3.780
  232   3HZ   LYS 104           HZ2      LYS 104   3.230 -13.440  -3.590
  233    H    HIS 105           H        HIS 105   0.550  -9.900  -7.940
  234    HD1  HIS 105           HD1      HIS 105  -1.660  -9.140 -12.410
  235    HE2  HIS 105           HE2      HIS 105   0.430 -12.580 -12.080
  236    H    ILE 106           H        ILE 106  -2.220  -6.310  -8.930
  237    H    ILE 107           H        ILE 107  -4.250  -6.200  -4.990
  238    H    VAL 108           H        VAL 108  -7.400  -3.710  -6.320
  239    H    ALA 109           H        ALA 109  -8.850  -1.260  -2.870
  240    H    CYS 110           H        CYS 110 -12.870  -0.400  -4.850
  241    H    GLU 111           H        GLU 111 -12.620   4.020  -5.740
  242    H    GLY 112           H        GLY 112 -16.350   6.330  -5.700
  243    H    ASN 113           H        ASN 113 -14.980  10.280  -7.310
  244   1HD2  ASN 113           HD2      ASN 113 -18.390  12.300 -12.090
  245   2HD2  ASN 113           HD2      ASN 113 -18.710  12.350 -10.370
  246    OH   TYR 115           OH       TYR 115 -15.820   0.790  -8.170
  247    H    TYR 115           H        TYR 115 -13.330   7.550 -11.550
  248    HH   TYR 115           HH       TYR 115 -15.640  -0.040  -8.750
  249    H    VAL 116           H        VAL 116 -11.970   6.140  -7.680
  250    H    VAL 118           H        VAL 118  -9.730   2.730  -3.380
  251    H    HIS 119           H        HIS 119  -9.050   1.530  -1.730
  252    HD1  HIS 119           HD1      HIS 119  -8.860   2.430   2.700
  253    HE2  HIS 119           HE2      HIS 119 -12.880   2.280   2.400
  254    H    PHE 120           H        PHE 120  -5.780  -0.010   0.680
  255    H    ASP 121           H        ASP 121  -5.630  -3.920  -1.520
  256    H    ALA 122           H        ALA 122  -5.340  -6.500  -2.060
  257    H    SER 123           H        SER 123  -1.460  -8.330  -1.570
  258    HG   SER 123           HG       SER 123   1.410  -8.620  -1.920
  259    H    VAL 124           H        VAL 124  -1.550  -9.830  -5.570
   
  Start of MODEL          10
 Raw file had 259 H/Q atoms
  Start of MODEL   10
    1   1H    LYS   1           H2       LYS   1  -8.510  17.370   2.000
    2   2H    LYS   1           H3       LYS   1  -9.740  18.320   2.530
    3   3H    LYS   1           H1       LYS   1  -8.230  18.480   3.170
    4   1HZ   LYS   1           HZ3      LYS   1 -12.430  17.110   7.450
    5   2HZ   LYS   1           HZ1      LYS   1 -12.350  15.490   7.600
    6   3HZ   LYS   1           HZ2      LYS   1 -12.270  16.440   8.940
    7    H    GLU   2           H        GLU   2  -8.250  15.080   5.340
    8    H    THR   3           H        THR   3  -9.040  12.770   2.100
    9    HG1  THR   3           HG1      THR   3 -10.200  12.570  -0.500
   10    H    ALA   4           H        ALA   4 -11.600   9.050   2.110
   11    H    ALA   5           H        ALA   5 -10.120   8.620  -0.510
   12    H    ALA   6           H        ALA   6  -7.780  10.210  -0.080
   13    H    LYS   7           H        LYS   7  -6.810   8.710   2.090
   14   1HZ   LYS   7           HZ3      LYS   7  -9.700   4.500   5.660
   15   2HZ   LYS   7           HZ1      LYS   7  -9.510   3.070   4.890
   16   3HZ   LYS   7           HZ2      LYS   7  -8.740   3.340   6.310
   17    H    PHE   8           H        PHE   8  -6.210   6.120   0.880
   18    H    GLU   9           H        GLU   9  -4.070   7.180  -1.080
   19    NH1  ARG  10           NH1      ARG  10  -1.820  10.500   7.170
   20    NH2  ARG  10           NH2      ARG  10  -3.780   9.460   7.530
   21    H    ARG  10           H        ARG  10  -2.250   8.110   1.150
   22    HE   ARG  10           HE       ARG  10  -2.790   7.620   6.170
   23   1HH1  ARG  10           HH1      ARG  10  -0.980  10.540   6.630
   24   2HH1  ARG  10           HH1      ARG  10  -2.090  11.240   7.800
   25   1HH2  ARG  10           HH2      ARG  10  -4.410   8.690   7.420
   26   2HH2  ARG  10           HH2      ARG  10  -4.060  10.250   8.070
   27    H    GLN  11           H        GLN  11  -1.680   5.800   2.640
   28   1HE2  GLN  11           HE2      GLN  11  -4.790   2.490   6.470
   29   2HE2  GLN  11           HE2      GLN  11  -3.460   3.470   7.030
   30    H    HIS  12           H        HIS  12  -0.400   4.420   0.650
   31    HD1  HIS  12           HD1      HIS  12   0.000  -0.140   0.660
   32    HE2  HIS  12           HE2      HIS  12  -3.340   0.950   2.610
   33    H    MET  13           H        MET  13   0.810   5.240  -1.200
   34    H    ASP  14           H        ASP  14   4.130   4.280  -4.100
   35    H    SER  15           H        SER  15   5.070   6.740  -5.030
   36    HG   SER  15           HG       SER  15   5.260   9.540  -6.950
   37    H    SER  16           H        SER  16   7.590   8.070  -5.310
   38    HG   SER  16           HG       SER  16  10.050   7.670  -3.320
   39    H    THR  17           H        THR  17   9.320   5.780  -5.450
   40    HG1  THR  17           HG1      THR  17  10.500   3.750  -2.810
   41    H    SER  18           H        SER  18  12.060   3.160  -7.670
   42    HG   SER  18           HG       SER  18  13.300   0.790  -9.580
   43    H    ALA  19           H        ALA  19  11.810   1.040  -6.130
   44    H    ALA  20           H        ALA  20  10.970  -2.220  -3.540
   45    H    SER  21           H        SER  21  14.680  -0.490  -2.550
   46    HG   SER  21           HG       SER  21  17.450   1.200  -2.160
   47    H    SER  22           H        SER  22  15.290  -2.560  -0.570
   48    HG   SER  22           HG       SER  22  18.730  -2.360   2.940
   49    H    SER  23           H        SER  23  17.150  -5.370   2.000
   50    HG   SER  23           HG       SER  23  17.570  -5.910   5.240
   51    H    ASN  24           H        ASN  24  16.270  -3.520   3.980
   52   1HD2  ASN  24           HD2      ASN  24  15.620  -4.890   8.920
   53   2HD2  ASN  24           HD2      ASN  24  14.540  -3.720   8.220
   54    OH   TYR  25           OH       TYR  25   9.960   3.000  -1.220
   55    H    TYR  25           H        TYR  25  14.190  -2.250   3.130
   56    HH   TYR  25           HH       TYR  25   8.980   2.810  -1.040
   57    H    CYS  26           H        CYS  26  11.420  -1.370   4.050
   58    H    ASN  27           H        ASN  27  12.280  -0.140   6.590
   59   1HD2  ASN  27           HD2      ASN  27  14.840  -1.920   9.970
   60   2HD2  ASN  27           HD2      ASN  27  15.060  -0.210  10.220
   61    H    GLN  28           H        GLN  28  13.340   2.970   6.890
   62   1HE2  GLN  28           HE2      GLN  28  12.790   8.770   8.770
   63   2HE2  GLN  28           HE2      GLN  28  11.960   8.330   7.300
   64    H    MET  29           H        MET  29  11.540   3.740   5.110
   65    H    MET  30           H        MET  30   8.800   3.170   6.140
   66    H    LYS  31           H        LYS  31   8.630   5.240   8.190
   67   1HZ   LYS  31           HZ2      LYS  31  11.650   4.260  12.140
   68   2HZ   LYS  31           HZ3      LYS  31  11.650   4.210  10.510
   69   3HZ   LYS  31           HZ1      LYS  31  13.060   4.170  11.330
   70    H    SER  32           H        SER  32   9.060   7.430   6.810
   71    HG   SER  32           HG       SER  32  11.360   8.940   4.650
   72    NH1  ARG  33           NH2      ARG  33   7.580   9.600   0.870
   73    NH2  ARG  33           NH1      ARG  33   7.060   8.560  -1.090
   74    H    ARG  33           H        ARG  33   6.620   7.690   5.190
   75    HE   ARG  33           HE       ARG  33   5.820   6.960   0.310
   76   1HH1  ARG  33           HH2      ARG  33   7.470   9.670   1.860
   77   2HH1  ARG  33           HH2      ARG  33   8.070  10.300   0.360
   78   1HH2  ARG  33           HH1      ARG  33   6.550   7.850  -1.580
   79   2HH2  ARG  33           HH1      ARG  33   7.570   9.250  -1.590
   80    H    ASN  34           H        ASN  34   5.380   9.640   7.250
   81   1HD2  ASN  34           HD2      ASN  34   0.030  10.820   7.460
   82   2HD2  ASN  34           HD2      ASN  34   1.280   9.650   7.100
   83    H    LEU  35           H        LEU  35   3.820   7.100   8.080
   84    H    THR  36           H        THR  36   4.420   6.430  10.660
   85    HG1  THR  36           HG1      THR  36   7.120   5.990  12.470
   86    H    LYS  37           H        LYS  37   2.850   7.520  12.600
   87   1HZ   LYS  37           HZ1      LYS  37   5.720  12.890  13.250
   88   2HZ   LYS  37           HZ2      LYS  37   4.890  14.230  13.690
   89   3HZ   LYS  37           HZ3      LYS  37   4.990  12.930  14.710
   90    H    ASP  38           H        ASP  38   2.950   6.740  15.550
   91    NH1  ARG  39           NH2      ARG  39   0.080  -1.500  19.010
   92    NH2  ARG  39           NH1      ARG  39   1.320  -2.180  17.220
   93    H    ARG  39           H        ARG  39   1.520   4.930  16.400
   94    HE   ARG  39           HE       ARG  39   1.140   0.170  16.480
   95   1HH1  ARG  39           HH2      ARG  39  -0.340  -0.760  19.530
   96   2HH1  ARG  39           HH2      ARG  39   0.080  -2.440  19.350
   97   1HH2  ARG  39           HH1      ARG  39   1.900  -1.960  16.430
   98   2HH2  ARG  39           HH1      ARG  39   1.280  -3.110  17.570
   99    H    CYS  40           H        CYS  40   4.680   1.970  16.540
  100    H    LYS  41           H        LYS  41   3.420   1.490  12.210
  101   1HZ   LYS  41           HZ1      LYS  41  -0.640   2.050  10.940
  102   2HZ   LYS  41           HZ2      LYS  41  -0.410   3.180   9.790
  103   3HZ   LYS  41           HZ3      LYS  41  -1.920   2.880  10.380
  104    H    VAL  43           H        VAL  43   0.780  -3.340  10.010
  105    H    ASN  44           H        ASN  44   2.820  -4.080   6.360
  106   1HD2  ASN  44           HD2      ASN  44   2.010   1.560   4.080
  107   2HD2  ASN  44           HD2      ASN  44   1.270   0.960   5.540
  108    H    THR  45           H        THR  45   1.060  -1.930   3.050
  109    HG1  THR  45           HG1      THR  45   1.990  -5.080   2.430
  110    H    PHE  46           H        PHE  46   4.390  -1.810   0.740
  111    H    VAL  47           H        VAL  47   3.100   1.260  -2.130
  112    H    HIS  48           H        HIS  48   4.890  -0.210  -5.570
  113    HD1  HIS  48           HD1      HIS  48   8.780   2.580  -4.790
  114    HE2  HIS  48           HE2      HIS  48   9.010  -0.790  -2.550
  115    H    GLU  49           H        GLU  49   3.700   2.870  -6.870
  116    H    SER  50           H        SER  50   3.170   5.080 -10.600
  117    HG   SER  50           HG       SER  50   2.030   5.720 -12.220
  118    H    LEU  51           H        LEU  51   0.150   8.070  -8.540
  119    H    ALA  52           H        ALA  52  -1.460   8.200 -11.060
  120    H    ASP  53           H        ASP  53  -0.640   5.400 -12.060
  121    H    VAL  54           H        VAL  54  -2.100   3.940 -10.360
  122    H    GLN  55           H        GLN  55  -4.460   4.630 -10.200
  123   1HE2  GLN  55           HE2      GLN  55  -8.270   9.280 -10.630
  124   2HE2  GLN  55           HE2      GLN  55  -8.760   7.620 -10.430
  125    H    ALA  56           H        ALA  56  -4.970   3.430 -12.760
  126    H    VAL  57           H        VAL  57  -5.920   0.890 -11.560
  127    H    CYS  58           H        CYS  58  -8.120   0.880 -10.870
  128    H    SER  59           H        SER  59  -9.450   0.580 -13.190
  129    HG   SER  59           HG       SER  59 -11.820   2.480 -14.090
  130    H    GLN  60           H        GLN  60 -10.150  -1.950 -13.430
  131   1HE2  GLN  60           HE2      GLN  60  -4.410  -2.380 -15.240
  132   2HE2  GLN  60           HE2      GLN  60  -5.820  -1.380 -15.560
  133    H    LYS  61           H        LYS  61  -9.860  -5.990 -14.010
  134   1HZ   LYS  61           HZ1      LYS  61  -9.810 -10.460 -17.770
  135   2HZ   LYS  61           HZ2      LYS  61 -11.170 -11.370 -17.810
  136   3HZ   LYS  61           HZ3      LYS  61 -10.660 -10.560 -19.160
  137    H    ASN  62           H        ASN  62 -14.040  -6.330 -12.730
  138   1HD2  ASN  62           HD2      ASN  62 -16.140  -6.010  -7.400
  139   2HD2  ASN  62           HD2      ASN  62 -14.780  -5.300  -8.190
  140    H    VAL  63           H        VAL  63 -13.470  -6.930  -8.280
  141    H    ALA  64           H        ALA  64 -13.270 -10.680  -6.010
  142    H    CYS  65           H        CYS  65 -13.760  -8.020  -2.400
  143    H    LYS  66           H        LYS  66  -9.840  -9.080  -0.190
  144   1HZ   LYS  66           HZ1      LYS  66  -7.900 -14.100  -1.840
  145   2HZ   LYS  66           HZ2      LYS  66  -6.310 -14.350  -2.070
  146   3HZ   LYS  66           HZ3      LYS  66  -7.000 -14.720  -0.630
  147    H    ASN  67           H        ASN  67 -11.850  -9.360   2.220
  148   1HD2  ASN  67           HD2      ASN  67 -14.070  -6.140   3.840
  149   2HD2  ASN  67           HD2      ASN  67 -14.370  -7.280   5.120
  150    H    GLY  68           H        GLY  68 -13.880 -10.420   0.930
  151    H    GLN  69           H        GLN  69 -14.970  -8.280   0.830
  152   1HE2  GLN  69           HE2      GLN  69 -14.910  -2.720  -1.560
  153   2HE2  GLN  69           HE2      GLN  69 -14.240  -3.440  -0.130
  154    H    THR  70           H        THR  70 -18.130  -6.160  -1.770
  155    HG1  THR  70           HG1      THR  70 -20.550  -5.640  -3.850
  156    H    ASN  71           H        ASN  71 -16.440  -4.540  -2.910
  157   1HD2  ASN  71           HD2      ASN  71 -15.876  -0.042  -1.558
  158   2HD2  ASN  71           HD2      ASN  71 -16.198   0.311  -3.206
  159    H    CYS  72           H        CYS  72 -14.010  -5.380  -5.360
  160    OH   TYR  73           OH       TYR  73 -15.900  -1.340  -8.900
  161    H    TYR  73           H        TYR  73 -10.090  -4.060  -6.740
  162    HH   TYR  73           HH       TYR  73 -16.490  -1.880  -9.520
  163    H    GLN  74           H        GLN  74  -9.540  -6.230 -10.400
  164   1HE2  GLN  74           HE2      GLN  74  -5.400 -10.080  -7.570
  165   2HE2  GLN  74           HE2      GLN  74  -6.560 -10.680  -8.730
  166    H    SER  75           H        SER  75  -4.950  -6.090 -10.350
  167    HG   SER  75           HG       SER  75  -1.840  -5.910 -11.680
  168    OH   TYR  76           OH       TYR  76  -8.750  -7.350 -13.230
  169    H    TYR  76           H        TYR  76  -4.810  -6.360 -14.840
  170    HH   TYR  76           HH       TYR  76  -8.100  -6.780 -12.700
  171    H    SER  77           H        SER  77  -2.100  -6.490 -15.110
  172    HG   SER  77           HG       SER  77   0.200  -4.380 -15.310
  173    H    THR  78           H        THR  78   1.950  -8.010 -13.840
  174    HG1  THR  78           HG1      THR  78   4.790  -9.100 -12.580
  175    H    MET  79           H        MET  79   2.030  -6.330  -9.570
  176    H    SER  80           H        SER  80   4.740  -2.870  -9.590
  177    HG   SER  80           HG       SER  80   8.730  -1.720  -8.190
  178    H    ILE  81           H        ILE  81   5.640  -5.030  -5.860
  179    H    THR  82           H        THR  82   5.290  -2.780  -2.170
  180    HG1  THR  82           HG1      THR  82   8.350  -3.180  -2.710
  181    H    ASP  83           H        ASP  83   6.650  -5.930  -0.060
  182    H    CYS  84           H        CYS  84   4.570  -5.000   3.820
  183    NH1  ARG  85           NH2      ARG  85   5.210  -9.200  13.210
  184    NH2  ARG  85           NH1      ARG  85   3.100  -9.980  13.490
  185    H    ARG  85           H        ARG  85   7.290  -5.990   7.160
  186    HE   ARG  85           HE       ARG  85   3.020 -10.080  11.020
  187   1HH1  ARG  85           HH2      ARG  85   5.950  -8.860  12.630
  188   2HH1  ARG  85           HH2      ARG  85   5.310  -9.180  14.200
  189   1HH2  ARG  85           HH1      ARG  85   2.230 -10.290  13.130
  190   2HH2  ARG  85           HH1      ARG  85   3.260  -9.990  14.480
  191    H    GLU  86           H        GLU  86   5.250  -5.340  10.960
  192    H    THR  87           H        THR  87   9.450  -4.860  12.750
  193    HG1  THR  87           HG1      THR  87  11.440  -4.360  13.320
  194    H    GLY  88           H        GLY  88  11.190  -8.350  15.310
  195    H    SER  89           H        SER  89  12.200  -5.890  16.210
  196    HG   SER  89           HG       SER  89  14.390  -5.800  18.820
  197    H    SER  90           H        SER  90  10.280  -4.020  16.880
  198    HG   SER  90           HG       SER  90   7.960  -1.000  14.990
  199    H    LYS  91           H        LYS  91  11.000   0.020  17.240
  200   1HZ   LYS  91           HZ2      LYS  91  13.290  -0.820  23.560
  201   2HZ   LYS  91           HZ3      LYS  91  13.510   0.650  22.860
  202   3HZ   LYS  91           HZ1      LYS  91  12.710   0.520  24.280
  203    OH   TYR  92           OH       TYR  92   5.610   9.860  17.680
  204    H    TYR  92           H        TYR  92   8.370   2.600  19.850
  205    HH   TYR  92           HH       TYR  92   4.660  10.130  17.880
  206    H    ASN  94           H        ASN  94  11.470   4.350  17.560
  207   1HD2  ASN  94           HD2      ASN  94  13.510   1.210  19.250
  208   2HD2  ASN  94           HD2      ASN  94  14.040   1.020  17.610
  209    H    CYS  95           H        CYS  95  10.610   3.590  14.220
  210    H    ALA  96           H        ALA  96  10.470  -0.880  13.570
  211    OH   TYR  97           OH       TYR  97   5.470  -0.130  11.230
  212    H    TYR  97           H        TYR  97  12.090  -2.170   9.800
  213    HH   TYR  97           HH       TYR  97   4.630  -0.690  11.110
  214    H    LYS  98           H        LYS  98   9.630  -5.800   8.910
  215   1HZ   LYS  98           HZ1      LYS  98   9.400 -11.700  10.640
  216   2HZ   LYS  98           HZ2      LYS  98   9.370 -10.960  12.110
  217   3HZ   LYS  98           HZ3      LYS  98   8.110 -10.790  11.070
  218    H    THR  99           H        THR  99  12.110  -6.480   5.290
  219    HG1  THR  99           HG1      THR  99  11.610  -4.030   5.580
  220    H    THR 100           H        THR 100   9.020  -6.400   2.180
  221    HG1  THR 100           HG1      THR 100  10.130  -9.420   2.210
  222    H    GLN 101           H        GLN 101  11.440  -6.950  -1.290
  223   1HE2  GLN 101           HE2      GLN 101   8.250  -4.540  -6.380
  224   2HE2  GLN 101           HE2      GLN 101   9.340  -5.870  -6.570
  225    H    ALA 102           H        ALA 102   7.850  -6.560  -3.850
  226    H    ASN 103           H        ASN 103   7.580  -9.150  -7.360
  227   1HD2  ASN 103           HD2      ASN 103   8.250  -5.050 -10.450
  228   2HD2  ASN 103           HD2      ASN 103   6.850  -5.860 -11.120
  229    H    LYS 104           H        LYS 104   3.720  -7.500  -7.760
  230   1HZ   LYS 104           HZ2      LYS 104   4.890 -11.000  -2.910
  231   2HZ   LYS 104           HZ3      LYS 104   3.660 -11.430  -1.910
  232   3HZ   LYS 104           HZ1      LYS 104   4.830 -12.510  -2.280
  233    H    HIS 105           H        HIS 105   0.160  -9.980  -8.040
  234    HD1  HIS 105           HD1      HIS 105  -2.290  -9.070 -12.370
  235    HE2  HIS 105           HE2      HIS 105  -0.080 -12.460 -12.310
  236    H    ILE 106           H        ILE 106  -2.570  -6.390  -8.870
  237    H    ILE 107           H        ILE 107  -4.480  -6.170  -4.970
  238    H    VAL 108           H        VAL 108  -7.300  -3.460  -6.400
  239    H    ALA 109           H        ALA 109  -8.850  -1.000  -2.970
  240    H    CYS 110           H        CYS 110 -12.780  -0.130  -4.980
  241    H    GLU 111           H        GLU 111 -12.500   4.290  -5.760
  242    H    GLY 112           H        GLY 112 -16.190   6.640  -5.820
  243    H    ASN 113           H        ASN 113 -14.710  10.620  -7.320
  244   1HD2  ASN 113           HD2      ASN 113 -17.040  13.190 -12.200
  245   2HD2  ASN 113           HD2      ASN 113 -17.500  13.120 -10.520
  246    OH   TYR 115           OH       TYR 115 -16.030   1.320  -8.470
  247    H    TYR 115           H        TYR 115 -12.950   7.880 -11.610
  248    HH   TYR 115           HH       TYR 115 -15.690   0.420  -8.780
  249    H    VAL 116           H        VAL 116 -11.740   6.450  -7.700
  250    H    VAL 118           H        VAL 118  -9.800   3.020  -3.420
  251    H    HIS 119           H        HIS 119  -9.050   1.740  -1.800
  252    HD1  HIS 119           HD1      HIS 119  -9.120   2.780   2.350
  253    HE2  HIS 119           HE2      HIS 119 -13.120   2.310   2.230
  254    H    PHE 120           H        PHE 120  -5.970   0.040   0.780
  255    H    ASP 121           H        ASP 121  -5.680  -3.850  -1.420
  256    H    ALA 122           H        ALA 122  -5.760  -6.460  -1.920
  257    H    SER 123           H        SER 123  -1.860  -8.440  -1.460
  258    HG   SER 123           HG       SER 123  -0.320  -6.170  -3.270
  259    H    VAL 124           H        VAL 124  -1.810  -9.850  -5.570
   
  Start of MODEL          11
 Raw file had 259 H/Q atoms
  Start of MODEL   11
    1   1H    LYS   1           H3       LYS   1  -8.210  17.660  -0.600
    2   2H    LYS   1           H1       LYS   1  -9.670  17.660  -1.340
    3   3H    LYS   1           H2       LYS   1  -9.190  19.010  -0.520
    4   1HZ   LYS   1           HZ1      LYS   1 -15.670  18.220   0.870
    5   2HZ   LYS   1           HZ2      LYS   1 -15.790  16.640   1.310
    6   3HZ   LYS   1           HZ3      LYS   1 -16.250  17.840   2.370
    7    H    GLU   2           H        GLU   2  -9.290  16.470   2.800
    8    H    THR   3           H        THR   3  -9.400  13.020   0.670
    9    HG1  THR   3           HG1      THR   3 -10.280  12.370  -1.610
   10    H    ALA   4           H        ALA   4 -11.770   9.370   1.540
   11    H    ALA   5           H        ALA   5 -10.160   8.680  -0.840
   12    H    ALA   6           H        ALA   6  -7.800  10.280  -0.370
   13    H    LYS   7           H        LYS   7  -6.780   8.960   1.870
   14   1HZ   LYS   7           HZ3      LYS   7  -6.360   3.880   4.780
   15   2HZ   LYS   7           HZ1      LYS   7  -7.690   2.970   5.030
   16   3HZ   LYS   7           HZ2      LYS   7  -7.280   3.460   3.510
   17    H    PHE   8           H        PHE   8  -6.110   6.350   0.800
   18    H    GLU   9           H        GLU   9  -3.950   7.330  -1.080
   19    NH1  ARG  10           NH1      ARG  10  -3.920  11.780   3.670
   20    NH2  ARG  10           NH2      ARG  10  -5.130  10.610   5.190
   21    H    ARG  10           H        ARG  10  -2.150   8.360   1.190
   22    HE   ARG  10           HE       ARG  10  -2.990   9.780   6.010
   23   1HH1  ARG  10           HH1      ARG  10  -3.030  12.040   3.290
   24   2HH1  ARG  10           HH1      ARG  10  -4.760  12.160   3.300
   25   1HH2  ARG  10           HH2      ARG  10  -5.180  10.150   6.080
   26   2HH2  ARG  10           HH2      ARG  10  -5.970  10.910   4.740
   27    H    GLN  11           H        GLN  11  -1.510   6.040   2.710
   28   1HE2  GLN  11           HE2      GLN  11  -4.760   3.010   6.470
   29   2HE2  GLN  11           HE2      GLN  11  -3.400   3.970   6.980
   30    H    HIS  12           H        HIS  12  -0.300   4.640   0.670
   31    HD1  HIS  12           HD1      HIS  12   0.110   0.130   0.720
   32    HE2  HIS  12           HE2      HIS  12  -3.260   1.290   2.590
   33    H    MET  13           H        MET  13   0.890   5.550  -1.220
   34    H    ASP  14           H        ASP  14   4.130   4.540  -4.090
   35    H    SER  15           H        SER  15   5.010   7.080  -5.010
   36    HG   SER  15           HG       SER  15   3.490   6.640  -7.140
   37    H    SER  16           H        SER  16   7.640   8.300  -5.430
   38    HG   SER  16           HG       SER  16   9.770   9.040  -3.160
   39    H    THR  17           H        THR  17   9.310   6.030  -5.470
   40    HG1  THR  17           HG1      THR  17  10.510   3.990  -2.780
   41    H    SER  18           H        SER  18  11.980   3.590  -7.790
   42    HG   SER  18           HG       SER  18  10.240   0.450  -9.980
   43    H    ALA  19           H        ALA  19  11.670   1.420  -6.080
   44    H    ALA  20           H        ALA  20  11.040  -1.900  -3.520
   45    H    SER  21           H        SER  21  14.760  -0.060  -2.000
   46    HG   SER  21           HG       SER  21  17.410   1.290  -0.720
   47    H    SER  22           H        SER  22  15.680  -2.020  -0.230
   48    HG   SER  22           HG       SER  22  17.870  -1.060   2.280
   49    H    SER  23           H        SER  23  17.040  -5.600   1.820
   50    HG   SER  23           HG       SER  23  17.970  -7.530   4.150
   51    H    ASN  24           H        ASN  24  16.380  -3.500   3.640
   52   1HD2  ASN  24           HD2      ASN  24  17.390   0.200   7.780
   53   2HD2  ASN  24           HD2      ASN  24  17.040  -1.470   8.130
   54    OH   TYR  25           OH       TYR  25   9.930   3.260  -1.100
   55    H    TYR  25           H        TYR  25  14.710  -1.880   2.910
   56    HH   TYR  25           HH       TYR  25   8.960   3.020  -0.960
   57    H    CYS  26           H        CYS  26  11.610  -1.270   4.000
   58    H    ASN  27           H        ASN  27  12.460  -0.040   6.530
   59   1HD2  ASN  27           HD2      ASN  27  13.410  -2.780   8.570
   60   2HD2  ASN  27           HD2      ASN  27  13.030  -1.580   7.390
   61    H    GLN  28           H        GLN  28  13.510   2.780   7.140
   62   1HE2  GLN  28           HE2      GLN  28  15.600   4.600  10.720
   63   2HE2  GLN  28           HE2      GLN  28  14.800   6.050  10.160
   64    H    MET  29           H        MET  29  11.730   3.710   5.340
   65    H    MET  30           H        MET  30   9.040   3.220   6.110
   66    H    LYS  31           H        LYS  31   8.980   5.060   8.320
   67   1HZ   LYS  31           HZ2      LYS  31  12.770   4.230  11.060
   68   2HZ   LYS  31           HZ3      LYS  31  12.740   3.130  12.300
   69   3HZ   LYS  31           HZ1      LYS  31  11.490   3.250  11.260
   70    H    SER  32           H        SER  32   9.280   7.610   7.170
   71    HG   SER  32           HG       SER  32   8.530  11.120   4.850
   72    NH1  ARG  33           NH2      ARG  33   5.030   9.010  -0.360
   73    NH2  ARG  33           NH1      ARG  33   2.850   8.410  -0.060
   74    H    ARG  33           H        ARG  33   6.690   7.750   5.970
   75    HE   ARG  33           HE       ARG  33   3.480   8.000   2.270
   76   1HH1  ARG  33           HH2      ARG  33   5.940   9.130   0.010
   77   2HH1  ARG  33           HH2      ARG  33   4.830   9.170  -1.330
   78   1HH2  ARG  33           HH1      ARG  33   2.120   8.060   0.510
   79   2HH2  ARG  33           HH1      ARG  33   2.700   8.560  -1.040
   80    H    ASN  34           H        ASN  34   5.270   9.710   7.800
   81   1HD2  ASN  34           HD2      ASN  34   3.200  12.920   6.370
   82   2HD2  ASN  34           HD2      ASN  34   2.400  11.370   6.280
   83    H    LEU  35           H        LEU  35   3.560   7.280   8.130
   84    H    THR  36           H        THR  36   4.630   6.290  10.630
   85    HG1  THR  36           HG1      THR  36   7.550   5.400  12.190
   86    H    LYS  37           H        LYS  37   3.740   7.780  12.550
   87   1HZ   LYS  37           HZ2      LYS  37   5.440  12.930   9.600
   88   2HZ   LYS  37           HZ3      LYS  37   6.380  13.760  10.650
   89   3HZ   LYS  37           HZ1      LYS  37   7.030  13.120   9.300
   90    H    ASP  38           H        ASP  38   3.050   7.050  15.150
   91    NH1  ARG  39           NH2      ARG  39  -3.130   1.420  16.810
   92    NH2  ARG  39           NH1      ARG  39  -4.280   3.340  16.930
   93    H    ARG  39           H        ARG  39   1.670   5.350  16.030
   94    HE   ARG  39           HE       ARG  39  -2.140   4.210  18.000
   95   1HH1  ARG  39           HH2      ARG  39  -2.330   0.900  17.090
   96   2HH1  ARG  39           HH2      ARG  39  -3.920   1.000  16.370
   97   1HH2  ARG  39           HH1      ARG  39  -4.460   4.210  17.390
   98   2HH2  ARG  39           HH1      ARG  39  -5.000   2.870  16.420
   99    H    CYS  40           H        CYS  40   4.090   1.850  16.730
  100    H    LYS  41           H        LYS  41   3.350   1.470  12.350
  101   1HZ   LYS  41           HZ2      LYS  41   0.140   1.300   6.670
  102   2HZ   LYS  41           HZ3      LYS  41  -1.270   0.590   6.230
  103   3HZ   LYS  41           HZ1      LYS  41  -1.250   2.110   6.860
  104    H    VAL  43           H        VAL  43   0.750  -3.130   9.970
  105    H    ASN  44           H        ASN  44   2.840  -3.890   6.390
  106   1HD2  ASN  44           HD2      ASN  44   2.090   1.620   3.880
  107   2HD2  ASN  44           HD2      ASN  44   1.810   1.460   5.600
  108    H    THR  45           H        THR  45   1.020  -1.800   3.040
  109    HG1  THR  45           HG1      THR  45   0.960  -5.210   1.960
  110    H    PHE  46           H        PHE  46   4.460  -1.580   0.760
  111    H    VAL  47           H        VAL  47   3.210   1.510  -2.150
  112    H    HIS  48           H        HIS  48   4.910   0.030  -5.640
  113    HD1  HIS  48           HD1      HIS  48   8.830   2.740  -4.700
  114    HE2  HIS  48           HE2      HIS  48   8.950  -0.600  -2.420
  115    H    GLU  49           H        GLU  49   3.650   2.740  -7.010
  116    H    SER  50           H        SER  50   3.030   5.070 -10.720
  117    HG   SER  50           HG       SER  50   1.850   5.730 -12.330
  118    H    LEU  51           H        LEU  51   0.110   8.050  -8.670
  119    H    ALA  52           H        ALA  52  -1.550   8.160 -11.110
  120    H    ASP  53           H        ASP  53  -0.780   5.390 -12.080
  121    H    VAL  54           H        VAL  54  -2.090   3.910 -10.390
  122    H    GLN  55           H        GLN  55  -4.510   4.570 -10.220
  123   1HE2  GLN  55           HE2      GLN  55  -8.470   9.070 -10.630
  124   2HE2  GLN  55           HE2      GLN  55  -8.850   7.390 -10.330
  125    H    ALA  56           H        ALA  56  -5.030   3.270 -12.750
  126    H    VAL  57           H        VAL  57  -5.930   0.760 -11.410
  127    H    CYS  58           H        CYS  58  -8.190   0.730 -10.720
  128    H    SER  59           H        SER  59  -9.510   0.160 -13.010
  129    HG   SER  59           HG       SER  59  -9.160   0.310 -15.910
  130    H    GLN  60           H        GLN  60 -10.110  -2.370 -13.110
  131   1HE2  GLN  60           HE2      GLN  60  -4.490  -2.720 -15.260
  132   2HE2  GLN  60           HE2      GLN  60  -5.970  -1.780 -15.330
  133    H    LYS  61           H        LYS  61  -9.730  -6.370 -13.430
  134   1HZ   LYS  61           HZ3      LYS  61 -11.910  -9.990 -17.390
  135   2HZ   LYS  61           HZ1      LYS  61 -12.070  -9.430 -18.920
  136   3HZ   LYS  61           HZ2      LYS  61 -10.600  -9.400 -18.190
  137    H    ASN  62           H        ASN  62 -13.930  -7.030 -12.140
  138   1HD2  ASN  62           HD2      ASN  62 -15.790  -6.230  -6.720
  139   2HD2  ASN  62           HD2      ASN  62 -14.490  -5.510  -7.650
  140    H    VAL  63           H        VAL  63 -13.200  -7.260  -7.660
  141    H    ALA  64           H        ALA  64 -12.750 -10.860  -5.240
  142    H    CYS  65           H        CYS  65 -13.300  -8.130  -1.780
  143    H    LYS  66           H        LYS  66  -9.290  -8.970   0.350
  144   1HZ   LYS  66           HZ1      LYS  66  -3.820 -10.400   3.380
  145   2HZ   LYS  66           HZ2      LYS  66  -4.310 -11.100   4.770
  146   3HZ   LYS  66           HZ3      LYS  66  -3.400 -11.950   3.690
  147    H    ASN  67           H        ASN  67 -11.140  -8.790   2.940
  148   1HD2  ASN  67           HD2      ASN  67 -13.440  -5.320   3.890
  149   2HD2  ASN  67           HD2      ASN  67 -13.270  -6.020   5.460
  150    H    GLY  68           H        GLY  68 -13.280 -10.150   1.800
  151    H    GLN  69           H        GLN  69 -14.530  -8.050   1.540
  152   1HE2  GLN  69           HE2      GLN  69 -13.500  -2.000   0.390
  153   2HE2  GLN  69           HE2      GLN  69 -14.010  -2.990  -0.950
  154    H    THR  70           H        THR  70 -17.910  -6.750  -1.200
  155    HG1  THR  70           HG1      THR  70 -20.240  -6.080  -3.480
  156    H    ASN  71           H        ASN  71 -16.050  -5.070  -2.500
  157   1HD2  ASN  71           HD2      ASN  71 -16.425  -0.790  -1.342
  158   2HD2  ASN  71           HD2      ASN  71 -16.677  -0.430  -2.998
  159    H    CYS  72           H        CYS  72 -13.640  -5.870  -4.840
  160    OH   TYR  73           OH       TYR  73 -15.660  -1.340  -9.500
  161    H    TYR  73           H        TYR  73  -9.970  -4.060  -6.410
  162    HH   TYR  73           HH       TYR  73 -16.020  -1.620 -10.400
  163    H    GLN  74           H        GLN  74  -9.340  -6.500 -10.010
  164   1HE2  GLN  74           HE2      GLN  74  -5.020 -11.720 -10.670
  165   2HE2  GLN  74           HE2      GLN  74  -4.340 -10.130 -10.920
  166    H    SER  75           H        SER  75  -4.850  -5.940 -10.140
  167    HG   SER  75           HG       SER  75  -1.680  -5.920 -11.580
  168    OH   TYR  76           OH       TYR  76  -8.580  -8.150 -12.520
  169    H    TYR  76           H        TYR  76  -4.830  -6.630 -14.600
  170    HH   TYR  76           HH       TYR  76  -8.440  -8.930 -11.900
  171    H    SER  77           H        SER  77  -2.170  -6.610 -14.890
  172    HG   SER  77           HG       SER  77  -0.090  -4.200 -15.300
  173    H    THR  78           H        THR  78   1.940  -8.210 -13.770
  174    HG1  THR  78           HG1      THR  78   5.080  -8.820 -12.290
  175    H    MET  79           H        MET  79   2.230  -6.250  -9.610
  176    H    SER  80           H        SER  80   4.720  -2.560  -9.530
  177    HG   SER  80           HG       SER  80   8.770  -1.430  -7.730
  178    H    ILE  81           H        ILE  81   5.670  -4.780  -5.930
  179    H    THR  82           H        THR  82   5.330  -2.600  -2.160
  180    HG1  THR  82           HG1      THR  82   8.500  -3.010  -2.710
  181    H    ASP  83           H        ASP  83   6.750  -5.730  -0.070
  182    H    CYS  84           H        CYS  84   4.650  -4.730   3.720
  183    NH1  ARG  85           NH2      ARG  85   2.950 -12.120   7.470
  184    NH2  ARG  85           NH1      ARG  85   2.960 -11.770   9.720
  185    H    ARG  85           H        ARG  85   7.250  -6.140   6.930
  186    HE   ARG  85           HE       ARG  85   4.360  -9.790   9.130
  187   1HH1  ARG  85           HH2      ARG  85   3.270 -11.830   6.570
  188   2HH1  ARG  85           HH2      ARG  85   2.390 -12.940   7.580
  189   1HH2  ARG  85           HH1      ARG  85   3.180 -11.200  10.510
  190   2HH2  ARG  85           HH1      ARG  85   2.510 -12.650   9.840
  191    H    GLU  86           H        GLU  86   4.970  -5.640  10.610
  192    H    THR  87           H        THR  87   9.030  -5.370  12.680
  193    HG1  THR  87           HG1      THR  87  11.070  -4.920  13.560
  194    H    GLY  88           H        GLY  88  10.090  -9.060  15.390
  195    H    SER  89           H        SER  89  11.520  -6.950  16.600
  196    HG   SER  89           HG       SER  89  13.570  -5.090  15.930
  197    H    SER  90           H        SER  90   9.720  -4.860  17.110
  198    HG   SER  90           HG       SER  90   7.520  -1.810  15.190
  199    H    LYS  91           H        LYS  91  10.510  -0.730  17.760
  200   1HZ   LYS  91           HZ1      LYS  91  11.520  -4.000  21.290
  201   2HZ   LYS  91           HZ2      LYS  91  11.180  -5.120  22.430
  202   3HZ   LYS  91           HZ3      LYS  91  10.040  -4.700  21.320
  203    OH   TYR  92           OH       TYR  92   5.810   9.380  18.650
  204    H    TYR  92           H        TYR  92   7.630   1.710  20.140
  205    HH   TYR  92           HH       TYR  92   5.340   9.480  17.760
  206    H    ASN  94           H        ASN  94  11.330   3.230  18.190
  207   1HD2  ASN  94           HD2      ASN  94  13.090  -0.010  19.600
  208   2HD2  ASN  94           HD2      ASN  94  13.300  -0.170  17.880
  209    H    CYS  95           H        CYS  95  10.540   2.890  14.650
  210    H    ALA  96           H        ALA  96  10.210  -1.480  14.060
  211    OH   TYR  97           OH       TYR  97   5.540  -0.280  11.500
  212    H    TYR  97           H        TYR  97  11.860  -2.450  10.120
  213    HH   TYR  97           HH       TYR  97   4.690  -0.840  11.400
  214    H    LYS  98           H        LYS  98   9.460  -5.990   8.980
  215   1HZ   LYS  98           HZ2      LYS  98  12.510  -9.430   4.470
  216   2HZ   LYS  98           HZ3      LYS  98  13.020 -10.970   4.170
  217   3HZ   LYS  98           HZ1      LYS  98  11.440 -10.660   4.490
  218    H    THR  99           H        THR  99  12.000  -6.390   5.400
  219    HG1  THR  99           HG1      THR  99  11.680  -3.960   5.740
  220    H    THR 100           H        THR 100   9.130  -6.190   2.110
  221    HG1  THR 100           HG1      THR 100  10.690  -9.050   2.100
  222    H    GLN 101           H        GLN 101  11.550  -6.900  -1.470
  223   1HE2  GLN 101           HE2      GLN 101   8.440  -4.090  -6.420
  224   2HE2  GLN 101           HE2      GLN 101   9.440  -5.500  -6.570
  225    H    ALA 102           H        ALA 102   8.030  -6.360  -4.070
  226    H    ASN 103           H        ASN 103   7.740  -8.970  -7.500
  227   1HD2  ASN 103           HD2      ASN 103   8.250  -4.900 -10.630
  228   2HD2  ASN 103           HD2      ASN 103   6.770  -5.670 -11.140
  229    H    LYS 104           H        LYS 104   3.880  -7.350  -7.640
  230   1HZ   LYS 104           HZ3      LYS 104   2.910 -12.470  -2.160
  231   2HZ   LYS 104           HZ1      LYS 104   4.470 -12.800  -1.800
  232   3HZ   LYS 104           HZ2      LYS 104   3.880 -11.290  -1.560
  233    H    HIS 105           H        HIS 105   0.360  -9.890  -7.820
  234    HD1  HIS 105           HD1      HIS 105  -2.190  -9.050 -12.100
  235    HE2  HIS 105           HE2      HIS 105   0.160 -12.340 -12.120
  236    H    ILE 106           H        ILE 106  -2.390  -6.290  -8.740
  237    H    ILE 107           H        ILE 107  -4.220  -6.060  -4.740
  238    H    VAL 108           H        VAL 108  -7.290  -3.530  -6.010
  239    H    ALA 109           H        ALA 109  -8.860  -1.110  -2.590
  240    H    CYS 110           H        CYS 110 -12.830  -0.320  -4.680
  241    H    GLU 111           H        GLU 111 -12.630   4.110  -5.600
  242    H    GLY 112           H        GLY 112 -16.370   6.360  -5.630
  243    H    ASN 113           H        ASN 113 -15.180  10.300  -7.380
  244   1HD2  ASN 113           HD2      ASN 113 -17.880  12.570 -12.190
  245   2HD2  ASN 113           HD2      ASN 113 -18.210  12.580 -10.470
  246    OH   TYR 115           OH       TYR 115 -16.010   0.810  -8.070
  247    H    TYR 115           H        TYR 115 -13.450   7.420 -11.560
  248    HH   TYR 115           HH       TYR 115 -15.800  -0.030  -8.620
  249    H    VAL 116           H        VAL 116 -11.990   6.150  -7.670
  250    H    VAL 118           H        VAL 118  -9.650   2.810  -3.210
  251    H    HIS 119           H        HIS 119  -9.010   1.700  -1.520
  252    HD1  HIS 119           HD1      HIS 119  -8.980   2.600   2.970
  253    HE2  HIS 119           HE2      HIS 119 -12.970   2.280   2.420
  254    H    PHE 120           H        PHE 120  -5.680   0.240   0.830
  255    H    ASP 121           H        ASP 121  -5.530  -3.760  -1.210
  256    H    ALA 122           H        ALA 122  -5.510  -6.280  -1.630
  257    H    SER 123           H        SER 123  -1.460  -8.010  -1.270
  258    HG   SER 123           HG       SER 123   1.510  -8.080  -1.510
  259    H    VAL 124           H        VAL 124  -1.560  -9.520  -5.280
   
  Start of MODEL          12
 Raw file had 259 H/Q atoms
  Start of MODEL   12
    1   1H    LYS   1           H3       LYS   1  -8.220  17.820   2.300
    2   2H    LYS   1           H1       LYS   1  -9.660  17.800   1.530
    3   3H    LYS   1           H2       LYS   1  -9.430  18.840   2.770
    4   1HZ   LYS   1           HZ1      LYS   1 -11.810  14.240   5.790
    5   2HZ   LYS   1           HZ2      LYS   1 -10.850  14.740   7.000
    6   3HZ   LYS   1           HZ3      LYS   1 -12.300  14.040   7.330
    7    H    GLU   2           H        GLU   2  -8.840  15.300   4.970
    8    H    THR   3           H        THR   3  -9.200  12.790   1.830
    9    HG1  THR   3           HG1      THR   3 -10.190  12.550  -0.840
   10    H    ALA   4           H        ALA   4 -11.850   9.200   1.690
   11    H    ALA   5           H        ALA   5 -10.230   8.630  -0.800
   12    H    ALA   6           H        ALA   6  -7.940  10.120  -0.020
   13    H    LYS   7           H        LYS   7  -7.010   8.560   2.030
   14   1HZ   LYS   7           HZ1      LYS   7  -7.100   2.900   5.300
   15   2HZ   LYS   7           HZ2      LYS   7  -7.990   2.590   3.980
   16   3HZ   LYS   7           HZ3      LYS   7  -6.700   3.610   3.890
   17    H    PHE   8           H        PHE   8  -6.250   6.020   0.860
   18    H    GLU   9           H        GLU   9  -4.090   7.260  -0.870
   19    NH1  ARG  10           NH1      ARG  10  -1.830   7.960   8.200
   20    NH2  ARG  10           NH2      ARG  10  -4.080   7.760   7.960
   21    H    ARG  10           H        ARG  10  -2.340   8.210   1.450
   22    HE   ARG  10           HE       ARG  10  -3.800   8.890   5.860
   23   1HH1  ARG  10           HH1      ARG  10  -0.950   8.260   7.830
   24   2HH1  ARG  10           HH1      ARG  10  -1.860   7.470   9.070
   25   1HH2  ARG  10           HH2      ARG  10  -4.930   8.050   7.520
   26   2HH2  ARG  10           HH2      ARG  10  -4.120   7.240   8.810
   27    H    GLN  11           H        GLN  11  -1.650   5.720   2.750
   28   1HE2  GLN  11           HE2      GLN  11  -4.890   3.310   6.690
   29   2HE2  GLN  11           HE2      GLN  11  -3.740   4.620   6.870
   30    H    HIS  12           H        HIS  12  -0.570   4.370   0.830
   31    HD1  HIS  12           HD1      HIS  12  -0.080  -0.170   0.680
   32    HE2  HIS  12           HE2      HIS  12  -3.350   0.740   2.790
   33    H    MET  13           H        MET  13   0.700   5.390  -1.030
   34    H    ASP  14           H        ASP  14   3.910   4.470  -4.120
   35    H    SER  15           H        SER  15   5.060   6.950  -4.870
   36    HG   SER  15           HG       SER  15   4.820   9.580  -6.750
   37    H    SER  16           H        SER  16   7.480   8.150  -5.090
   38    HG   SER  16           HG       SER  16  11.560   9.280  -5.180
   39    H    THR  17           H        THR  17   9.390   6.000  -4.770
   40    HG1  THR  17           HG1      THR  17  10.440   3.850  -2.310
   41    H    SER  18           H        SER  18  12.160   3.560  -7.250
   42    HG   SER  18           HG       SER  18  13.510   1.110  -9.200
   43    H    ALA  19           H        ALA  19  12.040   1.310  -5.850
   44    H    ALA  20           H        ALA  20  11.050  -2.030  -3.280
   45    H    SER  21           H        SER  21  14.630  -0.160  -1.840
   46    HG   SER  21           HG       SER  21  17.210   1.670  -1.460
   47    H    SER  22           H        SER  22  15.230  -2.330  -0.080
   48    HG   SER  22           HG       SER  22  18.570  -2.740   3.470
   49    H    SER  23           H        SER  23  17.010  -5.480   2.070
   50    HG   SER  23           HG       SER  23  17.210  -6.390   5.400
   51    H    ASN  24           H        ASN  24  16.130  -3.770   4.230
   52   1HD2  ASN  24           HD2      ASN  24  15.250  -5.660   8.960
   53   2HD2  ASN  24           HD2      ASN  24  14.320  -4.270   8.510
   54    OH   TYR  25           OH       TYR  25  10.100   3.080  -0.760
   55    H    TYR  25           H        TYR  25  14.180  -2.430   3.430
   56    HH   TYR  25           HH       TYR  25   9.100   2.940  -0.590
   57    H    CYS  26           H        CYS  26  11.440  -1.660   4.430
   58    H    ASN  27           H        ASN  27  12.160  -0.630   7.020
   59   1HD2  ASN  27           HD2      ASN  27  14.350  -2.500  10.730
   60   2HD2  ASN  27           HD2      ASN  27  14.530  -0.780  10.970
   61    H    GLN  28           H        GLN  28  13.070   2.250   7.030
   62   1HE2  GLN  28           HE2      GLN  28  13.000   8.670   7.520
   63   2HE2  GLN  28           HE2      GLN  28  13.930   7.820   8.720
   64    H    MET  29           H        MET  29  11.360   3.240   5.620
   65    H    MET  30           H        MET  30   8.800   2.990   6.340
   66    H    LYS  31           H        LYS  31   8.950   5.010   8.310
   67   1HZ   LYS  31           HZ2      LYS  31  10.060   9.680  11.340
   68   2HZ   LYS  31           HZ3      LYS  31  10.680  10.540  12.600
   69   3HZ   LYS  31           HZ1      LYS  31  11.420  10.550  11.130
   70    H    SER  32           H        SER  32   9.640   7.490   7.580
   71    HG   SER  32           HG       SER  32  11.700   8.210   5.840
   72    NH1  ARG  33           NH2      ARG  33   4.130   9.580   0.300
   73    NH2  ARG  33           NH1      ARG  33   2.330   8.250   0.700
   74    H    ARG  33           H        ARG  33   7.310   7.880   5.710
   75    HE   ARG  33           HE       ARG  33   3.550   7.690   2.790
   76   1HH1  ARG  33           HH2      ARG  33   5.040   9.860   0.630
   77   2HH1  ARG  33           HH2      ARG  33   3.750   9.920  -0.550
   78   1HH2  ARG  33           HH1      ARG  33   1.880   7.560   1.260
   79   2HH2  ARG  33           HH1      ARG  33   1.930   8.540  -0.160
   80    H    ASN  34           H        ASN  34   5.030  10.440   7.430
   81   1HD2  ASN  34           HD2      ASN  34   0.250  10.980   7.790
   82   2HD2  ASN  34           HD2      ASN  34   0.820  10.670   9.420
   83    H    LEU  35           H        LEU  35   3.670   7.330   8.410
   84    H    THR  36           H        THR  36   4.730   5.600  10.360
   85    HG1  THR  36           HG1      THR  36   7.660   5.150  12.420
   86    H    LYS  37           H        LYS  37   4.850   7.660  11.960
   87   1HZ   LYS  37           HZ2      LYS  37   8.820  11.430  12.920
   88   2HZ   LYS  37           HZ3      LYS  37   8.830  13.050  13.200
   89   3HZ   LYS  37           HZ1      LYS  37   7.930  12.050  14.130
   90    H    ASP  38           H        ASP  38   2.840   7.400  13.740
   91    NH1  ARG  39           NH2      ARG  39  -2.980   3.420  13.890
   92    NH2  ARG  39           NH1      ARG  39  -1.190   3.240  12.480
   93    H    ARG  39           H        ARG  39   1.580   5.510  14.530
   94    HE   ARG  39           HE       ARG  39   0.130   2.830  14.410
   95   1HH1  ARG  39           HH2      ARG  39  -3.350   3.310  14.810
   96   2HH1  ARG  39           HH2      ARG  39  -3.570   3.660  13.130
   97   1HH2  ARG  39           HH1      ARG  39  -0.210   3.070  12.360
   98   2HH2  ARG  39           HH1      ARG  39  -1.790   3.460  11.720
   99    H    CYS  40           H        CYS  40   3.390   2.200  16.600
  100    H    LYS  41           H        LYS  41   3.170   1.090  12.380
  101   1HZ   LYS  41           HZ3      LYS  41  -2.450   1.030   8.660
  102   2HZ   LYS  41           HZ1      LYS  41  -2.720  -0.210   7.630
  103   3HZ   LYS  41           HZ2      LYS  41  -2.070  -0.510   9.090
  104    H    VAL  43           H        VAL  43   0.500  -3.490  10.010
  105    H    ASN  44           H        ASN  44   2.660  -4.200   6.480
  106   1HD2  ASN  44           HD2      ASN  44   1.970   1.460   4.350
  107   2HD2  ASN  44           HD2      ASN  44   1.240   0.820   5.800
  108    H    THR  45           H        THR  45   1.180  -1.680   3.270
  109    HG1  THR  45           HG1      THR  45   1.530  -4.790   2.540
  110    H    PHE  46           H        PHE  46   4.430  -1.560   0.900
  111    H    VAL  47           H        VAL  47   3.090   1.430  -2.040
  112    H    HIS  48           H        HIS  48   4.910  -0.050  -5.490
  113    HD1  HIS  48           HD1      HIS  48   8.900   2.670  -4.550
  114    HE2  HIS  48           HE2      HIS  48   8.900  -0.630  -2.220
  115    H    GLU  49           H        GLU  49   3.640   2.870  -6.640
  116    H    SER  50           H        SER  50   3.250   5.070 -10.420
  117    HG   SER  50           HG       SER  50   1.770   5.410 -11.890
  118    H    LEU  51           H        LEU  51   0.110   8.070  -8.530
  119    H    ALA  52           H        ALA  52  -1.640   8.320 -10.840
  120    H    ASP  53           H        ASP  53  -0.690   5.800 -12.260
  121    H    VAL  54           H        VAL  54  -1.840   4.030 -10.430
  122    H    GLN  55           H        GLN  55  -4.380   4.580 -10.370
  123   1HE2  GLN  55           HE2      GLN  55  -8.450   9.040 -10.660
  124   2HE2  GLN  55           HE2      GLN  55  -8.860   7.390 -10.290
  125    H    ALA  56           H        ALA  56  -4.880   3.370 -12.920
  126    H    VAL  57           H        VAL  57  -5.680   0.750 -11.700
  127    H    CYS  58           H        CYS  58  -7.900   0.620 -10.840
  128    H    SER  59           H        SER  59  -9.230   0.280 -13.250
  129    HG   SER  59           HG       SER  59 -11.320   2.160 -14.070
  130    H    GLN  60           H        GLN  60  -9.900  -2.130 -13.470
  131   1HE2  GLN  60           HE2      GLN  60  -4.400  -2.510 -15.440
  132   2HE2  GLN  60           HE2      GLN  60  -5.830  -1.540 -15.710
  133    H    LYS  61           H        LYS  61  -9.700  -6.190 -14.160
  134   1HZ   LYS  61           HZ3      LYS  61 -14.580 -10.520 -14.470
  135   2HZ   LYS  61           HZ1      LYS  61 -14.930  -8.990 -14.930
  136   3HZ   LYS  61           HZ2      LYS  61 -15.350 -10.240 -15.920
  137    H    ASN  62           H        ASN  62 -13.780  -6.830 -12.510
  138   1HD2  ASN  62           HD2      ASN  62 -15.860  -6.090  -7.210
  139   2HD2  ASN  62           HD2      ASN  62 -14.590  -5.380  -8.180
  140    H    VAL  63           H        VAL  63 -13.040  -7.240  -8.080
  141    H    ALA  64           H        ALA  64 -12.480 -10.840  -5.640
  142    H    CYS  65           H        CYS  65 -13.160  -8.060  -2.180
  143    H    LYS  66           H        LYS  66  -9.230  -8.210   0.130
  144   1HZ   LYS  66           HZ3      LYS  66  -4.250 -10.120   3.260
  145   2HZ   LYS  66           HZ1      LYS  66  -3.140 -11.030   2.430
  146   3HZ   LYS  66           HZ2      LYS  66  -3.770  -9.660   1.770
  147    H    ASN  67           H        ASN  67 -10.870  -8.380   2.490
  148   1HD2  ASN  67           HD2      ASN  67 -13.230  -5.090   3.610
  149   2HD2  ASN  67           HD2      ASN  67 -12.840  -5.840   5.130
  150    H    GLY  68           H        GLY  68 -12.810  -9.960   1.440
  151    H    GLN  69           H        GLN  69 -14.340  -7.950   1.100
  152   1HE2  GLN  69           HE2      GLN  69 -16.050  -6.410   4.290
  153   2HE2  GLN  69           HE2      GLN  69 -17.130  -6.900   2.990
  154    H    THR  70           H        THR  70 -17.750  -6.920  -1.790
  155    HG1  THR  70           HG1      THR  70 -19.830  -6.060  -4.110
  156    H    ASN  71           H        ASN  71 -15.620  -5.150  -2.880
  157   1HD2  ASN  71           HD2      ASN  71 -15.893  -1.017  -1.169
  158   2HD2  ASN  71           HD2      ASN  71 -16.750  -0.689  -2.652
  159    H    CYS  72           H        CYS  72 -13.540  -5.680  -5.390
  160    OH   TYR  73           OH       TYR  73 -15.600  -2.030  -8.410
  161    H    TYR  73           H        TYR  73  -9.700  -4.320  -6.810
  162    HH   TYR  73           HH       TYR  73 -15.620  -1.410  -7.610
  163    H    GLN  74           H        GLN  74  -9.130  -6.590 -10.420
  164   1HE2  GLN  74           HE2      GLN  74  -4.900 -11.850 -10.400
  165   2HE2  GLN  74           HE2      GLN  74  -4.450 -10.290 -11.030
  166    H    SER  75           H        SER  75  -4.950  -5.580 -10.530
  167    HG   SER  75           HG       SER  75  -1.660  -5.710 -11.690
  168    OH   TYR  76           OH       TYR  76  -8.300  -7.020 -14.190
  169    H    TYR  76           H        TYR  76  -4.820  -6.580 -14.990
  170    HH   TYR  76           HH       TYR  76  -7.800  -7.450 -13.410
  171    H    SER  77           H        SER  77  -2.060  -6.550 -14.870
  172    HG   SER  77           HG       SER  77   2.300  -5.440 -16.080
  173    H    THR  78           H        THR  78   2.170  -7.660 -13.900
  174    HG1  THR  78           HG1      THR  78   4.970  -8.780 -12.600
  175    H    MET  79           H        MET  79   2.250  -6.120  -9.590
  176    H    SER  80           H        SER  80   4.920  -2.550  -9.420
  177    HG   SER  80           HG       SER  80   8.820  -1.470  -7.310
  178    H    ILE  81           H        ILE  81   5.760  -4.800  -5.750
  179    H    THR  82           H        THR  82   5.240  -2.650  -2.040
  180    HG1  THR  82           HG1      THR  82   8.360  -3.040  -2.530
  181    H    ASP  83           H        ASP  83   6.500  -5.810   0.040
  182    H    CYS  84           H        CYS  84   4.380  -4.970   3.870
  183    NH1  ARG  85           NH2      ARG  85   1.730  -8.780  12.010
  184    NH2  ARG  85           NH1      ARG  85   3.310  -8.640  13.650
  185    H    ARG  85           H        ARG  85   7.060  -6.420   7.040
  186    HE   ARG  85           HE       ARG  85   4.930  -8.730  11.780
  187   1HH1  ARG  85           HH2      ARG  85   1.530  -8.850  11.030
  188   2HH1  ARG  85           HH2      ARG  85   1.010  -8.740  12.690
  189   1HH2  ARG  85           HH1      ARG  85   4.270  -8.630  13.940
  190   2HH2  ARG  85           HH1      ARG  85   2.580  -8.570  14.330
  191    H    GLU  86           H        GLU  86   4.750  -5.890  10.600
  192    H    THR  87           H        THR  87   8.740  -5.430  12.660
  193    HG1  THR  87           HG1      THR  87  10.490  -4.950  13.610
  194    H    GLY  88           H        GLY  88   9.870  -8.670  15.840
  195    H    SER  89           H        SER  89  11.280  -6.410  16.710
  196    HG   SER  89           HG       SER  89  13.350  -4.830  15.780
  197    H    SER  90           H        SER  90   9.360  -4.070  17.430
  198    HG   SER  90           HG       SER  90   7.090  -2.440  17.790
  199    H    LYS  91           H        LYS  91  11.050  -0.230  17.130
  200   1HZ   LYS  91           HZ1      LYS  91  16.650   1.760  18.970
  201   2HZ   LYS  91           HZ2      LYS  91  16.500   0.150  19.190
  202   3HZ   LYS  91           HZ3      LYS  91  17.290   0.730  17.880
  203    OH   TYR  92           OH       TYR  92   4.570   9.520  18.390
  204    H    TYR  92           H        TYR  92   8.350   2.540  19.270
  205    HH   TYR  92           HH       TYR  92   4.140   9.560  17.470
  206    H    ASN  94           H        ASN  94  10.870   4.930  16.020
  207   1HD2  ASN  94           HD2      ASN  94  14.420   4.180  16.960
  208   2HD2  ASN  94           HD2      ASN  94  14.040   3.250  15.520
  209    H    CYS  95           H        CYS  95   9.440   2.970  13.600
  210    H    ALA  96           H        ALA  96  10.210  -1.510  14.270
  211    OH   TYR  97           OH       TYR  97   5.450  -0.660  11.710
  212    H    TYR  97           H        TYR  97  11.670  -2.740  10.250
  213    HH   TYR  97           HH       TYR  97   4.620  -1.230  11.710
  214    H    LYS  98           H        LYS  98   9.270  -6.260   8.990
  215   1HZ   LYS  98           HZ1      LYS  98  11.130 -12.610   7.910
  216   2HZ   LYS  98           HZ2      LYS  98  11.380 -13.260   6.430
  217   3HZ   LYS  98           HZ3      LYS  98  11.850 -11.710   6.760
  218    H    THR  99           H        THR  99  11.870  -6.750   5.380
  219    HG1  THR  99           HG1      THR  99  11.690  -4.230   5.790
  220    H    THR 100           H        THR 100   8.850  -6.410   2.260
  221    HG1  THR 100           HG1      THR 100   9.500  -9.130   2.600
  222    H    GLN 101           H        GLN 101  11.270  -7.110  -1.130
  223   1HE2  GLN 101           HE2      GLN 101   8.710  -4.120  -6.250
  224   2HE2  GLN 101           HE2      GLN 101   9.640  -5.580  -6.340
  225    H    ALA 102           H        ALA 102   7.910  -6.430  -3.830
  226    H    ASN 103           H        ASN 103   7.690  -8.960  -7.410
  227   1HD2  ASN 103           HD2      ASN 103   7.890  -4.970 -10.960
  228   2HD2  ASN 103           HD2      ASN 103   6.570  -6.030 -11.370
  229    H    LYS 104           H        LYS 104   3.860  -7.300  -7.700
  230   1HZ   LYS 104           HZ3      LYS 104   2.650 -11.910  -2.230
  231   2HZ   LYS 104           HZ1      LYS 104   3.530 -13.280  -2.350
  232   3HZ   LYS 104           HZ2      LYS 104   4.210 -11.940  -1.700
  233    H    HIS 105           H        HIS 105   0.340  -9.810  -8.010
  234    HD1  HIS 105           HD1      HIS 105  -1.810  -8.940 -12.500
  235    HE2  HIS 105           HE2      HIS 105   0.360 -12.350 -12.190
  236    H    ILE 106           H        ILE 106  -2.520  -6.310  -8.900
  237    H    ILE 107           H        ILE 107  -4.230  -6.140  -4.860
  238    H    VAL 108           H        VAL 108  -6.930  -3.570  -6.300
  239    H    ALA 109           H        ALA 109  -8.660  -1.140  -2.990
  240    H    CYS 110           H        CYS 110 -12.630  -0.360  -5.020
  241    H    GLU 111           H        GLU 111 -12.490   4.080  -5.790
  242    H    GLY 112           H        GLY 112 -16.350   6.170  -6.210
  243    H    ASN 113           H        ASN 113 -14.750  10.190  -7.570
  244   1HD2  ASN 113           HD2      ASN 113 -17.680  12.220 -12.550
  245   2HD2  ASN 113           HD2      ASN 113 -18.230  12.050 -10.890
  246    OH   TYR 115           OH       TYR 115 -15.810   0.620  -8.970
  247    H    TYR 115           H        TYR 115 -13.340   7.420 -11.570
  248    HH   TYR 115           HH       TYR 115 -15.430  -0.170  -9.480
  249    H    VAL 116           H        VAL 116 -11.800   6.220  -7.780
  250    H    VAL 118           H        VAL 118  -9.710   2.940  -3.460
  251    H    HIS 119           H        HIS 119  -9.000   1.730  -1.800
  252    HD1  HIS 119           HD1      HIS 119  -9.160   2.810   2.450
  253    HE2  HIS 119           HE2      HIS 119 -13.110   2.200   1.960
  254    H    PHE 120           H        PHE 120  -5.830   0.110   0.670
  255    H    ASP 121           H        ASP 121  -5.640  -3.840  -1.380
  256    H    ALA 122           H        ALA 122  -5.440  -6.320  -1.740
  257    H    SER 123           H        SER 123  -1.570  -8.380  -1.430
  258    HG   SER 123           HG       SER 123   0.300  -6.470  -4.930
  259    H    VAL 124           H        VAL 124  -1.580  -9.760  -5.580
   
  Start of MODEL          13
 Raw file had 259 H/Q atoms
  Start of MODEL   13
    1   1H    LYS   1           H3       LYS   1  -9.960  18.390   2.800
    2   2H    LYS   1           H1       LYS   1 -10.760  18.970   4.110
    3   3H    LYS   1           H2       LYS   1  -9.250  18.350   4.290
    4   1HZ   LYS   1           HZ2      LYS   1 -14.160  15.400   7.280
    5   2HZ   LYS   1           HZ3      LYS   1 -14.560  13.800   7.310
    6   3HZ   LYS   1           HZ1      LYS   1 -12.990  14.270   7.260
    7    H    GLU   2           H        GLU   2 -10.100  14.840   5.180
    8    H    THR   3           H        THR   3  -9.640  12.970   1.540
    9    HG1  THR   3           HG1      THR   3  -9.970  12.560  -1.070
   10    H    ALA   4           H        ALA   4 -11.980   9.030   1.520
   11    H    ALA   5           H        ALA   5 -10.400   8.420  -0.960
   12    H    ALA   6           H        ALA   6  -8.100  10.090  -0.270
   13    H    LYS   7           H        LYS   7  -7.090   8.640   1.780
   14   1HZ   LYS   7           HZ2      LYS   7  -7.110   3.000   5.180
   15   2HZ   LYS   7           HZ3      LYS   7  -8.100   2.630   3.930
   16   3HZ   LYS   7           HZ1      LYS   7  -6.780   3.580   3.710
   17    H    PHE   8           H        PHE   8  -6.350   6.050   0.710
   18    H    GLU   9           H        GLU   9  -4.150   7.200  -0.960
   19    NH1  ARG  10           NH1      ARG  10  -1.690   8.240   7.970
   20    NH2  ARG  10           NH2      ARG  10  -3.930   7.920   7.770
   21    H    ARG  10           H        ARG  10  -2.380   8.280   1.280
   22    HE   ARG  10           HE       ARG  10  -3.790   9.260   5.770
   23   1HH1  ARG  10           HH1      ARG  10  -0.820   8.570   7.600
   24   2HH1  ARG  10           HH1      ARG  10  -1.710   7.710   8.810
   25   1HH2  ARG  10           HH2      ARG  10  -4.800   8.050   7.290
   26   2HH2  ARG  10           HH2      ARG  10  -3.900   7.390   8.610
   27    H    GLN  11           H        GLN  11  -1.710   5.830   2.580
   28   1HE2  GLN  11           HE2      GLN  11  -4.380   1.880   6.360
   29   2HE2  GLN  11           HE2      GLN  11  -2.800   2.440   6.850
   30    H    HIS  12           H        HIS  12  -0.540   4.470   0.640
   31    HD1  HIS  12           HD1      HIS  12  -0.120  -0.080   0.670
   32    HE2  HIS  12           HE2      HIS  12  -3.460   1.090   2.560
   33    H    MET  13           H        MET  13   0.720   5.480  -1.200
   34    H    ASP  14           H        ASP  14   3.910   4.530  -4.250
   35    H    SER  15           H        SER  15   4.890   6.770  -5.340
   36    HG   SER  15           HG       SER  15   4.890   9.560  -7.390
   37    H    SER  16           H        SER  16   7.460   8.250  -5.510
   38    HG   SER  16           HG       SER  16  11.510   9.520  -5.730
   39    H    THR  17           H        THR  17   9.300   6.020  -5.340
   40    HG1  THR  17           HG1      THR  17  10.550   3.890  -2.700
   41    H    SER  18           H        SER  18  11.960   3.580  -7.710
   42    HG   SER  18           HG       SER  18  13.210   1.160  -9.670
   43    H    ALA  19           H        ALA  19  11.870   1.360  -6.270
   44    H    ALA  20           H        ALA  20  11.000  -1.910  -3.610
   45    H    SER  21           H        SER  21  14.670  -0.080  -2.280
   46    HG   SER  21           HG       SER  21  17.360   1.560  -1.550
   47    H    SER  22           H        SER  22  15.340  -2.400  -0.740
   48    HG   SER  22           HG       SER  22  18.710  -2.380   2.900
   49    H    SER  23           H        SER  23  17.190  -5.400   1.560
   50    HG   SER  23           HG       SER  23  17.430  -6.510   4.610
   51    H    ASN  24           H        ASN  24  16.260  -3.770   3.590
   52   1HD2  ASN  24           HD2      ASN  24  15.950  -5.510   8.540
   53   2HD2  ASN  24           HD2      ASN  24  15.100  -4.000   8.360
   54    OH   TYR  25           OH       TYR  25  10.070   3.230  -1.060
   55    H    TYR  25           H        TYR  25  14.310  -2.360   2.870
   56    HH   TYR  25           HH       TYR  25   9.090   3.010  -0.970
   57    H    CYS  26           H        CYS  26  11.620  -1.510   4.000
   58    H    ASN  27           H        ASN  27  12.520  -0.500   6.490
   59   1HD2  ASN  27           HD2      ASN  27  14.150   0.260  11.780
   60   2HD2  ASN  27           HD2      ASN  27  13.440   1.390  10.680
   61    H    GLN  28           H        GLN  28  13.760   2.170   6.760
   62   1HE2  GLN  28           HE2      GLN  28  17.390   7.040   4.400
   63   2HE2  GLN  28           HE2      GLN  28  16.200   7.710   5.490
   64    H    MET  29           H        MET  29  11.800   3.220   5.250
   65    H    MET  30           H        MET  30   9.220   2.950   6.240
   66    H    LYS  31           H        LYS  31   9.680   4.500   8.460
   67   1HZ   LYS  31           HZ1      LYS  31  11.750   6.660  13.220
   68   2HZ   LYS  31           HZ2      LYS  31  12.920   6.500  14.350
   69   3HZ   LYS  31           HZ3      LYS  31  13.270   7.140  12.870
   70    H    SER  32           H        SER  32  10.300   7.210   7.720
   71    HG   SER  32           HG       SER  32   9.690  11.060   6.110
   72    NH1  ARG  33           NH2      ARG  33   5.240   7.890   0.430
   73    NH2  ARG  33           NH1      ARG  33   3.190   7.120   0.970
   74    H    ARG  33           H        ARG  33   7.850   7.600   6.580
   75    HE   ARG  33           HE       ARG  33   3.840   7.570   3.310
   76   1HH1  ARG  33           HH2      ARG  33   6.120   8.290   0.670
   77   2HH1  ARG  33           HH2      ARG  33   5.020   7.670  -0.520
   78   1HH2  ARG  33           HH1      ARG  33   2.470   6.910   1.630
   79   2HH2  ARG  33           HH1      ARG  33   3.060   6.930  -0.010
   80    H    ASN  34           H        ASN  34   4.840  10.380   7.540
   81   1HD2  ASN  34           HD2      ASN  34  -0.060  10.800   7.050
   82   2HD2  ASN  34           HD2      ASN  34   0.260  11.480   8.620
   83    H    LEU  35           H        LEU  35   3.190   7.640   8.120
   84    H    THR  36           H        THR  36   4.380   6.480  10.560
   85    HG1  THR  36           HG1      THR  36   6.570   5.580  10.490
   86    H    LYS  37           H        LYS  37   3.590   7.910  12.450
   87   1HZ   LYS  37           HZ1      LYS  37   4.870  12.870  14.990
   88   2HZ   LYS  37           HZ2      LYS  37   5.580  14.150  14.280
   89   3HZ   LYS  37           HZ3      LYS  37   4.020  14.250  14.790
   90    H    ASP  38           H        ASP  38   2.950   7.190  15.130
   91    NH1  ARG  39           NH2      ARG  39  -2.440   0.560  18.230
   92    NH2  ARG  39           NH1      ARG  39  -0.950  -0.920  17.330
   93    H    ARG  39           H        ARG  39   1.600   5.560  16.050
   94    HE   ARG  39           HE       ARG  39   0.520   1.100  17.200
   95   1HH1  ARG  39           HH2      ARG  39  -2.620   1.520  18.460
   96   2HH1  ARG  39           HH2      ARG  39  -3.130  -0.140  18.360
   97   1HH2  ARG  39           HH1      ARG  39  -0.120  -1.090  16.800
   98   2HH2  ARG  39           HH1      ARG  39  -1.590  -1.660  17.500
   99    H    CYS  40           H        CYS  40   4.190   2.190  16.830
  100    H    LYS  41           H        LYS  41   3.520   1.540  12.440
  101   1HZ   LYS  41           HZ3      LYS  41  -0.300   2.680   7.420
  102   2HZ   LYS  41           HZ1      LYS  41  -1.120   3.640   8.480
  103   3HZ   LYS  41           HZ2      LYS  41   0.460   3.350   8.710
  104    H    VAL  43           H        VAL  43   0.530  -3.280  10.200
  105    H    ASN  44           H        ASN  44   2.850  -3.660   6.620
  106   1HD2  ASN  44           HD2      ASN  44   2.170   1.850   3.930
  107   2HD2  ASN  44           HD2      ASN  44   2.880   1.740   5.520
  108    H    THR  45           H        THR  45   0.930  -1.770   3.180
  109    HG1  THR  45           HG1      THR  45   1.730  -4.870   2.220
  110    H    PHE  46           H        PHE  46   4.370  -1.560   0.830
  111    H    VAL  47           H        VAL  47   3.120   1.530  -2.090
  112    H    HIS  48           H        HIS  48   4.950   0.020  -5.420
  113    HD1  HIS  48           HD1      HIS  48   8.830   2.730  -4.630
  114    HE2  HIS  48           HE2      HIS  48   8.820  -0.590  -2.310
  115    H    GLU  49           H        GLU  49   3.590   2.810  -6.780
  116    H    SER  50           H        SER  50   3.170   5.050 -10.560
  117    HG   SER  50           HG       SER  50   1.660   5.340 -11.950
  118    H    LEU  51           H        LEU  51   0.000   7.990  -8.630
  119    H    ALA  52           H        ALA  52  -1.760   8.190 -11.020
  120    H    ASP  53           H        ASP  53  -0.800   5.610 -12.430
  121    H    VAL  54           H        VAL  54  -2.030   3.930 -10.580
  122    H    GLN  55           H        GLN  55  -4.490   4.440 -10.360
  123   1HE2  GLN  55           HE2      GLN  55  -8.510   8.870 -10.860
  124   2HE2  GLN  55           HE2      GLN  55  -8.900   7.200 -10.540
  125    H    ALA  56           H        ALA  56  -5.030   3.150 -12.900
  126    H    VAL  57           H        VAL  57  -5.910   0.580 -11.660
  127    H    CYS  58           H        CYS  58  -8.250   0.570 -10.980
  128    H    SER  59           H        SER  59  -9.480   0.070 -13.300
  129    HG   SER  59           HG       SER  59 -11.550   2.210 -14.820
  130    H    GLN  60           H        GLN  60 -10.050  -2.400 -13.460
  131   1HE2  GLN  60           HE2      GLN  60  -4.450  -2.750 -15.380
  132   2HE2  GLN  60           HE2      GLN  60  -5.920  -1.830 -15.560
  133    H    LYS  61           H        LYS  61  -9.690  -6.490 -13.830
  134   1HZ   LYS  61           HZ2      LYS  61 -14.930  -7.690 -17.390
  135   2HZ   LYS  61           HZ3      LYS  61 -14.770  -8.540 -18.790
  136   3HZ   LYS  61           HZ1      LYS  61 -15.110  -9.310 -17.390
  137    H    ASN  62           H        ASN  62 -13.850  -7.180 -12.510
  138   1HD2  ASN  62           HD2      ASN  62 -15.950  -6.190  -7.240
  139   2HD2  ASN  62           HD2      ASN  62 -14.610  -5.530  -8.160
  140    H    VAL  63           H        VAL  63 -13.230  -7.370  -8.010
  141    H    ALA  64           H        ALA  64 -12.850 -10.890  -5.460
  142    H    CYS  65           H        CYS  65 -13.630  -8.070  -2.060
  143    H    LYS  66           H        LYS  66  -9.750  -8.670   0.380
  144   1HZ   LYS  66           HZ3      LYS  66  -4.510  -9.890   1.940
  145   2HZ   LYS  66           HZ1      LYS  66  -4.050 -10.860   0.700
  146   3HZ   LYS  66           HZ2      LYS  66  -5.310  -9.830   0.510
  147    H    ASN  67           H        ASN  67 -11.760  -8.470   2.780
  148   1HD2  ASN  67           HD2      ASN  67 -14.090  -4.970   3.610
  149   2HD2  ASN  67           HD2      ASN  67 -13.680  -5.620   5.160
  150    H    GLY  68           H        GLY  68 -13.830  -9.950   1.550
  151    H    GLN  69           H        GLN  69 -15.050  -7.840   1.200
  152   1HE2  GLN  69           HE2      GLN  69 -16.140  -1.760   1.930
  153   2HE2  GLN  69           HE2      GLN  69 -17.300  -2.630   0.960
  154    H    THR  70           H        THR  70 -18.210  -6.820  -1.860
  155    HG1  THR  70           HG1      THR  70 -20.290  -6.160  -4.420
  156    H    ASN  71           H        ASN  71 -16.080  -5.160  -3.030
  157   1HD2  ASN  71           HD2      ASN  71 -15.452  -0.178  -2.436
  158   2HD2  ASN  71           HD2      ASN  71 -16.760  -0.345  -3.522
  159    H    CYS  72           H        CYS  72 -13.710  -5.820  -5.320
  160    OH   TYR  73           OH       TYR  73 -15.750  -1.550  -9.680
  161    H    TYR  73           H        TYR  73  -9.970  -4.170  -6.780
  162    HH   TYR  73           HH       TYR  73 -16.220  -1.960 -10.470
  163    H    GLN  74           H        GLN  74  -9.320  -6.650 -10.310
  164   1HE2  GLN  74           HE2      GLN  74  -4.920 -11.890 -10.900
  165   2HE2  GLN  74           HE2      GLN  74  -4.250 -10.300 -11.160
  166    H    SER  75           H        SER  75  -4.820  -5.970 -10.280
  167    HG   SER  75           HG       SER  75  -1.620  -5.740 -11.760
  168    OH   TYR  76           OH       TYR  76  -8.620  -8.080 -12.830
  169    H    TYR  76           H        TYR  76  -4.770  -6.610 -14.770
  170    HH   TYR  76           HH       TYR  76  -8.600  -8.820 -12.150
  171    H    SER  77           H        SER  77  -2.080  -6.520 -15.160
  172    HG   SER  77           HG       SER  77   2.370  -5.520 -15.900
  173    H    THR  78           H        THR  78   2.120  -7.780 -13.920
  174    HG1  THR  78           HG1      THR  78   4.990  -8.860 -12.610
  175    H    MET  79           H        MET  79   2.210  -6.160  -9.630
  176    H    SER  80           H        SER  80   4.860  -2.570  -9.560
  177    HG   SER  80           HG       SER  80   8.790  -1.460  -7.570
  178    H    ILE  81           H        ILE  81   5.560  -4.790  -5.910
  179    H    THR  82           H        THR  82   5.230  -2.570  -2.150
  180    HG1  THR  82           HG1      THR  82   8.390  -3.090  -2.630
  181    H    ASP  83           H        ASP  83   6.600  -5.780  -0.030
  182    H    CYS  84           H        CYS  84   4.480  -4.810   3.800
  183    NH1  ARG  85           NH2      ARG  85   1.750  -7.900  12.080
  184    NH2  ARG  85           NH1      ARG  85   3.260  -7.610  13.770
  185    H    ARG  85           H        ARG  85   7.290  -5.850   7.090
  186    HE   ARG  85           HE       ARG  85   4.970  -7.870  12.010
  187   1HH1  ARG  85           HH2      ARG  85   1.590  -8.120  11.120
  188   2HH1  ARG  85           HH2      ARG  85   1.000  -7.790  12.720
  189   1HH2  ARG  85           HH1      ARG  85   4.210  -7.600  14.090
  190   2HH2  ARG  85           HH1      ARG  85   2.510  -7.500  14.410
  191    H    GLU  86           H        GLU  86   5.160  -5.260  10.670
  192    H    THR  87           H        THR  87   9.210  -4.870  12.690
  193    HG1  THR  87           HG1      THR  87  11.110  -4.500  13.300
  194    H    GLY  88           H        GLY  88  10.550  -8.340  15.500
  195    H    SER  89           H        SER  89  11.730  -5.990  16.500
  196    HG   SER  89           HG       SER  89  13.700  -4.240  15.730
  197    H    SER  90           H        SER  90   9.700  -3.960  17.070
  198    HG   SER  90           HG       SER  90   7.330  -2.570  17.220
  199    H    LYS  91           H        LYS  91  10.950  -0.290  17.930
  200   1HZ   LYS  91           HZ3      LYS  91  15.190  -0.490  22.580
  201   2HZ   LYS  91           HZ1      LYS  91  15.270  -1.920  21.800
  202   3HZ   LYS  91           HZ2      LYS  91  16.380  -0.750  21.470
  203    OH   TYR  92           OH       TYR  92   5.390   9.480  18.670
  204    H    TYR  92           H        TYR  92   7.880   1.910  19.210
  205    HH   TYR  92           HH       TYR  92   4.970   9.620  17.760
  206    H    ASN  94           H        ASN  94  11.450   4.110  18.070
  207   1HD2  ASN  94           HD2      ASN  94  16.210   4.290  17.890
  208   2HD2  ASN  94           HD2      ASN  94  15.840   2.680  17.290
  209    H    CYS  95           H        CYS  95  10.580   3.380  14.390
  210    H    ALA  96           H        ALA  96  10.410  -0.950  14.190
  211    OH   TYR  97           OH       TYR  97   5.700   0.020  11.610
  212    H    TYR  97           H        TYR  97  12.150  -2.230  10.250
  213    HH   TYR  97           HH       TYR  97   4.920  -0.630  11.610
  214    H    LYS  98           H        LYS  98   9.610  -5.550   8.870
  215   1HZ   LYS  98           HZ3      LYS  98   8.920  -9.080   4.790
  216   2HZ   LYS  98           HZ1      LYS  98   8.460 -10.620   4.630
  217   3HZ   LYS  98           HZ2      LYS  98   7.820  -9.710   5.830
  218    H    THR  99           H        THR  99  12.060  -6.430   5.240
  219    HG1  THR  99           HG1      THR  99  11.960  -3.900   5.320
  220    H    THR 100           H        THR 100   9.000  -6.200   2.100
  221    HG1  THR 100           HG1      THR 100  10.130  -9.190   2.230
  222    H    GLN 101           H        GLN 101  11.300  -7.240  -1.390
  223   1HE2  GLN 101           HE2      GLN 101   8.570  -4.070  -6.290
  224   2HE2  GLN 101           HE2      GLN 101   9.440  -5.560  -6.440
  225    H    ALA 102           H        ALA 102   7.860  -6.410  -3.940
  226    H    ASN 103           H        ASN 103   7.620  -9.080  -7.400
  227   1HD2  ASN 103           HD2      ASN 103   8.020  -4.980 -10.770
  228   2HD2  ASN 103           HD2      ASN 103   6.900  -6.130 -11.470
  229    H    LYS 104           H        LYS 104   3.880  -7.440  -7.800
  230   1HZ   LYS 104           HZ1      LYS 104   3.360 -11.210  -1.820
  231   2HZ   LYS 104           HZ2      LYS 104   2.710 -12.570  -2.470
  232   3HZ   LYS 104           HZ3      LYS 104   4.230 -12.590  -1.830
  233    H    HIS 105           H        HIS 105   0.310  -9.880  -8.080
  234    HD1  HIS 105           HD1      HIS 105  -1.900  -8.920 -12.450
  235    HE2  HIS 105           HE2      HIS 105   0.190 -12.380 -12.250
  236    H    ILE 106           H        ILE 106  -2.400  -6.280  -8.950
  237    H    ILE 107           H        ILE 107  -4.300  -6.100  -4.990
  238    H    VAL 108           H        VAL 108  -7.390  -3.570  -6.360
  239    H    ALA 109           H        ALA 109  -8.920  -1.220  -2.950
  240    H    CYS 110           H        CYS 110 -12.890  -0.370  -5.010
  241    H    GLU 111           H        GLU 111 -12.600   4.060  -5.910
  242    H    GLY 112           H        GLY 112 -16.300   6.400  -5.960
  243    H    ASN 113           H        ASN 113 -14.980  10.350  -7.580
  244   1HD2  ASN 113           HD2      ASN 113 -17.080  12.890 -12.440
  245   2HD2  ASN 113           HD2      ASN 113 -17.280  13.040 -10.710
  246    OH   TYR 115           OH       TYR 115 -15.920   0.770  -8.350
  247    H    TYR 115           H        TYR 115 -13.130   7.390 -11.820
  248    HH   TYR 115           HH       TYR 115 -15.730  -0.100  -8.860
  249    H    VAL 116           H        VAL 116 -11.920   6.180  -7.900
  250    H    VAL 118           H        VAL 118  -9.740   2.730  -3.450
  251    H    HIS 119           H        HIS 119  -9.040   1.590  -1.830
  252    HD1  HIS 119           HD1      HIS 119  -9.200   2.730   2.230
  253    HE2  HIS 119           HE2      HIS 119 -13.160   1.990   2.140
  254    H    PHE 120           H        PHE 120  -5.820   0.070   0.610
  255    H    ASP 121           H        ASP 121  -5.600  -3.860  -1.510
  256    H    ALA 122           H        ALA 122  -5.590  -6.340  -2.020
  257    H    SER 123           H        SER 123  -1.660  -8.250  -1.470
  258    HG   SER 123           HG       SER 123   1.500  -7.350  -1.340
  259    H    VAL 124           H        VAL 124  -1.430  -9.550  -5.530
   
  Start of MODEL          14
 Raw file had 259 H/Q atoms
  Start of MODEL   14
    1   1H    LYS   1           H2       LYS   1  -9.110  17.810   2.590
    2   2H    LYS   1           H3       LYS   1 -10.020  18.710   3.640
    3   3H    LYS   1           H1       LYS   1  -8.680  17.910   4.170
    4   1HZ   LYS   1           HZ2      LYS   1 -16.060  16.210   2.970
    5   2HZ   LYS   1           HZ3      LYS   1 -16.290  14.930   1.960
    6   3HZ   LYS   1           HZ1      LYS   1 -16.380  14.730   3.590
    7    H    GLU   2           H        GLU   2 -10.240  14.630   5.150
    8    H    THR   3           H        THR   3  -9.910  12.520   1.660
    9    HG1  THR   3           HG1      THR   3 -10.440  12.160  -1.200
   10    H    ALA   4           H        ALA   4 -12.520   8.800   1.270
   11    H    ALA   5           H        ALA   5 -10.680   8.280  -0.920
   12    H    ALA   6           H        ALA   6  -8.450   9.830  -0.160
   13    H    LYS   7           H        LYS   7  -7.590   8.210   1.930
   14   1HZ   LYS   7           HZ3      LYS   7  -9.620   3.830   7.150
   15   2HZ   LYS   7           HZ1      LYS   7 -10.390   5.180   7.660
   16   3HZ   LYS   7           HZ2      LYS   7 -10.620   4.640   6.130
   17    H    PHE   8           H        PHE   8  -6.760   5.670   0.810
   18    H    GLU   9           H        GLU   9  -4.490   7.030  -0.800
   19    NH1  ARG  10           NH1      ARG  10  -3.860   9.180   7.650
   20    NH2  ARG  10           NH2      ARG  10  -5.380   7.520   7.360
   21    H    ARG  10           H        ARG  10  -2.920   7.980   1.510
   22    HE   ARG  10           HE       ARG  10  -3.640   6.380   6.070
   23   1HH1  ARG  10           HH1      ARG  10  -2.940   9.540   7.520
   24   2HH1  ARG  10           HH1      ARG  10  -4.530   9.670   8.210
   25   1HH2  ARG  10           HH2      ARG  10  -5.630   6.610   7.040
   26   2HH2  ARG  10           HH2      ARG  10  -6.020   8.060   7.910
   27    H    GLN  11           H        GLN  11  -2.260   5.520   2.870
   28   1HE2  GLN  11           HE2      GLN  11  -3.890   0.460   5.760
   29   2HE2  GLN  11           HE2      GLN  11  -2.230   0.940   5.460
   30    H    HIS  12           H        HIS  12  -1.020   4.180   0.900
   31    HD1  HIS  12           HD1      HIS  12  -0.240  -0.120   1.100
   32    HE2  HIS  12           HE2      HIS  12  -3.840   0.580   2.690
   33    H    MET  13           H        MET  13   0.490   5.280  -0.800
   34    H    ASP  14           H        ASP  14   3.700   4.460  -3.940
   35    H    SER  15           H        SER  15   4.740   6.800  -4.570
   36    HG   SER  15           HG       SER  15   3.170   6.410  -6.840
   37    H    SER  16           H        SER  16   7.180   8.220  -5.080
   38    HG   SER  16           HG       SER  16   8.440  10.850  -4.250
   39    H    THR  17           H        THR  17   8.980   5.860  -5.120
   40    HG1  THR  17           HG1      THR  17  10.350   3.920  -2.450
   41    H    SER  18           H        SER  18  11.880   3.420  -7.330
   42    HG   SER  18           HG       SER  18  10.850   3.130 -10.220
   43    H    ALA  19           H        ALA  19  11.680   1.260  -5.600
   44    H    ALA  20           H        ALA  20  11.090  -2.120  -3.110
   45    H    SER  21           H        SER  21  14.690  -0.230  -1.840
   46    HG   SER  21           HG       SER  21  17.350   1.500  -1.520
   47    H    SER  22           H        SER  22  15.310  -2.320   0.060
   48    HG   SER  22           HG       SER  22  18.810  -2.490   3.440
   49    H    SER  23           H        SER  23  17.120  -5.140   2.560
   50    HG   SER  23           HG       SER  23  17.520  -5.750   5.820
   51    H    ASN  24           H        ASN  24  16.280  -3.280   4.560
   52   1HD2  ASN  24           HD2      ASN  24  15.560  -4.600   9.370
   53   2HD2  ASN  24           HD2      ASN  24  14.540  -3.380   8.680
   54    OH   TYR  25           OH       TYR  25  10.120   3.240  -0.830
   55    H    TYR  25           H        TYR  25  14.230  -2.020   3.630
   56    HH   TYR  25           HH       TYR  25   9.140   3.060  -0.650
   57    H    CYS  26           H        CYS  26  11.550  -1.120   4.430
   58    H    ASN  27           H        ASN  27  12.330   0.270   6.880
   59   1HD2  ASN  27           HD2      ASN  27  14.970  -1.420  10.280
   60   2HD2  ASN  27           HD2      ASN  27  15.090   0.300  10.530
   61    H    GLN  28           H        GLN  28  13.070   3.230   7.030
   62   1HE2  GLN  28           HE2      GLN  28  12.240   9.490   7.170
   63   2HE2  GLN  28           HE2      GLN  28  12.480   8.350   8.470
   64    H    MET  29           H        MET  29  11.300   4.010   5.340
   65    H    MET  30           H        MET  30   8.680   3.460   6.240
   66    H    LYS  31           H        LYS  31   8.550   5.580   8.250
   67   1HZ   LYS  31           HZ1      LYS  31  12.660   8.640  12.220
   68   2HZ   LYS  31           HZ2      LYS  31  12.740   7.110  12.800
   69   3HZ   LYS  31           HZ3      LYS  31  13.680   7.570  11.530
   70    H    SER  32           H        SER  32   8.670   7.910   6.870
   71    HG   SER  32           HG       SER  32   8.110  11.090   4.150
   72    NH1  ARG  33           NH2      ARG  33   5.940  10.100   1.640
   73    NH2  ARG  33           NH1      ARG  33   6.680   8.700   0.020
   74    H    ARG  33           H        ARG  33   6.290   7.730   5.190
   75    HE   ARG  33           HE       ARG  33   4.550   7.490   0.380
   76   1HH1  ARG  33           HH2      ARG  33   5.250  10.360   2.320
   77   2HH1  ARG  33           HH2      ARG  33   6.770  10.630   1.530
   78   1HH2  ARG  33           HH1      ARG  33   6.550   7.910  -0.580
   79   2HH2  ARG  33           HH1      ARG  33   7.510   9.250  -0.030
   80    H    ASN  34           H        ASN  34   4.670   9.580   7.070
   81   1HD2  ASN  34           HD2      ASN  34   1.660  12.290   5.190
   82   2HD2  ASN  34           HD2      ASN  34   1.250  10.600   5.360
   83    H    LEU  35           H        LEU  35   3.030   7.080   7.670
   84    H    THR  36           H        THR  36   4.490   6.160  10.140
   85    HG1  THR  36           HG1      THR  36   7.520   5.270  11.890
   86    H    LYS  37           H        LYS  37   3.890   7.980  11.850
   87   1HZ   LYS  37           HZ1      LYS  37   5.340  13.500   9.350
   88   2HZ   LYS  37           HZ2      LYS  37   6.610  14.360   9.920
   89   3HZ   LYS  37           HZ3      LYS  37   6.800  13.350   8.630
   90    H    ASP  38           H        ASP  38   3.500   7.600  14.710
   91    NH1  ARG  39           NH2      ARG  39  -2.010   2.900  19.780
   92    NH2  ARG  39           NH1      ARG  39  -3.230   4.650  18.980
   93    H    ARG  39           H        ARG  39   2.210   6.080  16.060
   94    HE   ARG  39           HE       ARG  39  -0.910   5.500  18.300
   95   1HH1  ARG  39           HH2      ARG  39  -1.110   2.470  19.790
   96   2HH1  ARG  39           HH2      ARG  39  -2.810   2.460  20.170
   97   1HH2  ARG  39           HH1      ARG  39  -3.330   5.400  18.330
   98   2HH2  ARG  39           HH1      ARG  39  -4.020   4.240  19.420
   99    H    CYS  40           H        CYS  40   4.920   2.840  16.860
  100    H    LYS  41           H        LYS  41   3.770   1.690  12.660
  101   1HZ   LYS  41           HZ2      LYS  41  -0.840   1.610   7.540
  102   2HZ   LYS  41           HZ3      LYS  41  -2.360   1.000   7.720
  103   3HZ   LYS  41           HZ1      LYS  41  -1.820   2.190   8.690
  104    H    VAL  43           H        VAL  43   0.820  -3.160  10.660
  105    H    ASN  44           H        ASN  44   2.710  -3.470   6.840
  106   1HD2  ASN  44           HD2      ASN  44   1.710   1.530   3.770
  107   2HD2  ASN  44           HD2      ASN  44   2.930   0.860   4.810
  108    H    THR  45           H        THR  45   0.570  -1.880   3.480
  109    HG1  THR  45           HG1      THR  45   0.710  -5.410   1.550
  110    H    PHE  46           H        PHE  46   4.200  -1.630   1.070
  111    H    VAL  47           H        VAL  47   2.980   1.380  -1.910
  112    H    HIS  48           H        HIS  48   4.720  -0.140  -5.450
  113    HD1  HIS  48           HD1      HIS  48   8.680   2.650  -4.370
  114    HE2  HIS  48           HE2      HIS  48   8.780  -0.640  -2.020
  115    H    GLU  49           H        GLU  49   3.600   2.720  -6.760
  116    H    SER  50           H        SER  50   3.150   4.830 -10.590
  117    HG   SER  50           HG       SER  50   1.930   5.480 -12.280
  118    H    LEU  51           H        LEU  51   0.190   7.780  -8.400
  119    H    ALA  52           H        ALA  52  -1.380   7.910 -10.940
  120    H    ASP  53           H        ASP  53  -0.490   5.270 -12.200
  121    H    VAL  54           H        VAL  54  -2.060   3.790 -10.370
  122    H    GLN  55           H        GLN  55  -4.400   4.310 -10.250
  123   1HE2  GLN  55           HE2      GLN  55  -8.400   8.750 -10.880
  124   2HE2  GLN  55           HE2      GLN  55  -8.810   7.070 -10.620
  125    H    ALA  56           H        ALA  56  -4.710   2.960 -12.760
  126    H    VAL  57           H        VAL  57  -5.640   0.480 -11.580
  127    H    CYS  58           H        CYS  58  -7.920   0.450 -10.990
  128    H    SER  59           H        SER  59  -9.140   0.080 -13.330
  129    HG   SER  59           HG       SER  59  -8.550  -0.030 -16.220
  130    H    GLN  60           H        GLN  60  -9.760  -2.570 -13.480
  131   1HE2  GLN  60           HE2      GLN  60  -4.030  -2.850 -15.540
  132   2HE2  GLN  60           HE2      GLN  60  -5.510  -1.920 -15.560
  133    H    LYS  61           H        LYS  61  -9.250  -6.640 -13.920
  134   1HZ   LYS  61           HZ2      LYS  61 -14.800 -10.450 -12.880
  135   2HZ   LYS  61           HZ3      LYS  61 -15.000 -12.050 -13.160
  136   3HZ   LYS  61           HZ1      LYS  61 -13.590 -11.470 -12.570
  137    H    ASN  62           H        ASN  62 -13.430  -7.040 -12.830
  138   1HD2  ASN  62           HD2      ASN  62 -15.930  -6.510  -7.720
  139   2HD2  ASN  62           HD2      ASN  62 -14.590  -5.760  -8.560
  140    H    VAL  63           H        VAL  63 -13.090  -7.580  -8.330
  141    H    ALA  64           H        ALA  64 -12.530 -11.070  -5.770
  142    H    CYS  65           H        CYS  65 -13.770  -8.270  -2.560
  143    H    LYS  66           H        LYS  66 -10.340  -7.740   0.540
  144   1HZ   LYS  66           HZ3      LYS  66  -6.100 -11.990   1.400
  145   2HZ   LYS  66           HZ1      LYS  66  -4.600 -11.350   1.410
  146   3HZ   LYS  66           HZ2      LYS  66  -5.400 -11.570   2.820
  147    H    ASN  67           H        ASN  67 -12.530  -8.240   2.460
  148   1HD2  ASN  67           HD2      ASN  67 -15.250  -5.300   3.580
  149   2HD2  ASN  67           HD2      ASN  67 -15.260  -6.300   5.000
  150    H    GLY  68           H        GLY  68 -13.800 -10.220   0.990
  151    H    GLN  69           H        GLN  69 -15.630  -8.290   0.420
  152   1HE2  GLN  69           HE2      GLN  69 -18.510  -3.280  -2.690
  153   2HE2  GLN  69           HE2      GLN  69 -18.360  -3.200  -0.950
  154    H    THR  70           H        THR  70 -18.150  -7.040  -3.310
  155    HG1  THR  70           HG1      THR  70 -17.480  -8.390  -7.790
  156    H    ASN  71           H        ASN  71 -15.540  -5.560  -3.880
  157   1HD2  ASN  71           HD2      ASN  71 -15.265  -1.523  -1.292
  158   2HD2  ASN  71           HD2      ASN  71 -16.043  -0.778  -2.664
  159    H    CYS  72           H        CYS  72 -13.620  -5.750  -5.790
  160    OH   TYR  73           OH       TYR  73 -15.660  -1.940  -8.840
  161    H    TYR  73           H        TYR  73  -9.800  -4.410  -6.930
  162    HH   TYR  73           HH       TYR  73 -15.690  -0.920  -8.840
  163    H    GLN  74           H        GLN  74  -9.040  -6.780 -10.440
  164   1HE2  GLN  74           HE2      GLN  74  -4.860 -11.850 -11.200
  165   2HE2  GLN  74           HE2      GLN  74  -4.100 -10.290 -11.380
  166    H    SER  75           H        SER  75  -4.540  -6.040 -10.310
  167    HG   SER  75           HG       SER  75  -1.300  -6.000 -11.690
  168    OH   TYR  76           OH       TYR  76  -8.120  -8.430 -12.890
  169    H    TYR  76           H        TYR  76  -4.270  -6.670 -14.800
  170    HH   TYR  76           HH       TYR  76  -7.980  -9.200 -12.270
  171    H    SER  77           H        SER  77  -1.620  -6.680 -15.020
  172    HG   SER  77           HG       SER  77   0.550  -4.340 -14.890
  173    H    THR  78           H        THR  78   2.470  -8.170 -13.690
  174    HG1  THR  78           HG1      THR  78   5.350  -7.930 -12.150
  175    H    MET  79           H        MET  79   2.440  -6.440  -9.410
  176    H    SER  80           H        SER  80   5.040  -2.880  -9.360
  177    HG   SER  80           HG       SER  80   8.790  -1.590  -7.240
  178    H    ILE  81           H        ILE  81   5.570  -4.930  -5.530
  179    H    THR  82           H        THR  82   5.100  -2.650  -1.810
  180    HG1  THR  82           HG1      THR  82   8.140  -3.210  -2.310
  181    H    ASP  83           H        ASP  83   6.470  -5.750   0.400
  182    H    CYS  84           H        CYS  84   4.530  -4.520   4.220
  183    NH1  ARG  85           NH2      ARG  85   5.590 -11.390  11.570
  184    NH2  ARG  85           NH1      ARG  85   7.240 -11.940  10.110
  185    H    ARG  85           H        ARG  85   7.270  -6.030   7.270
  186    HE   ARG  85           HE       ARG  85   6.030 -10.460   8.530
  187   1HH1  ARG  85           HH2      ARG  85   4.740 -10.910  11.770
  188   2HH1  ARG  85           HH2      ARG  85   6.030 -11.960  12.260
  189   1HH2  ARG  85           HH1      ARG  85   7.690 -11.850   9.220
  190   2HH2  ARG  85           HH1      ARG  85   7.620 -12.530  10.810
  191    H    GLU  86           H        GLU  86   5.270  -5.510  11.060
  192    H    THR  87           H        THR  87   9.390  -4.840  12.720
  193    HG1  THR  87           HG1      THR  87  12.360  -8.590  13.210
  194    H    GLY  88           H        GLY  88  11.380  -7.560  15.820
  195    H    SER  89           H        SER  89  12.850  -5.100  16.160
  196    HG   SER  89           HG       SER  89  15.330  -3.480  14.640
  197    H    SER  90           H        SER  90  10.910  -2.990  16.960
  198    HG   SER  90           HG       SER  90   8.250  -1.900  17.670
  199    H    LYS  91           H        LYS  91  12.150   0.760  17.310
  200   1HZ   LYS  91           HZ2      LYS  91  14.500  -2.600  20.320
  201   2HZ   LYS  91           HZ3      LYS  91  13.990  -3.370  21.670
  202   3HZ   LYS  91           HZ1      LYS  91  12.940  -2.490  20.780
  203    OH   TYR  92           OH       TYR  92   6.360  10.280  17.590
  204    H    TYR  92           H        TYR  92   9.300   2.950  18.850
  205    HH   TYR  92           HH       TYR  92   5.800  10.320  16.750
  206    H    ASN  94           H        ASN  94  12.430   5.150  16.790
  207   1HD2  ASN  94           HD2      ASN  94  15.870   1.400  14.360
  208   2HD2  ASN  94           HD2      ASN  94  14.700   1.650  15.630
  209    H    CYS  95           H        CYS  95  10.890   3.890  13.510
  210    H    ALA  96           H        ALA  96  10.290  -0.670  13.640
  211    OH   TYR  97           OH       TYR  97   6.050   0.020  11.820
  212    H    TYR  97           H        TYR  97  11.920  -2.160   9.950
  213    HH   TYR  97           HH       TYR  97   5.250  -0.590  11.990
  214    H    LYS  98           H        LYS  98   9.680  -5.910   9.210
  215   1HZ   LYS  98           HZ2      LYS  98   8.200  -9.500  10.790
  216   2HZ   LYS  98           HZ3      LYS  98   8.220 -10.090  12.310
  217   3HZ   LYS  98           HZ1      LYS  98   8.920  -8.660  11.970
  218    H    THR  99           H        THR  99  12.160  -5.960   5.720
  219    HG1  THR  99           HG1      THR  99  11.790  -3.700   5.990
  220    H    THR 100           H        THR 100   9.000  -6.060   2.590
  221    HG1  THR 100           HG1      THR 100   9.780  -8.730   3.010
  222    H    GLN 101           H        GLN 101  11.330  -6.750  -0.930
  223   1HE2  GLN 101           HE2      GLN 101   8.810  -5.640  -6.710
  224   2HE2  GLN 101           HE2      GLN 101   8.420  -4.760  -5.270
  225    H    ALA 102           H        ALA 102   7.740  -6.560  -3.340
  226    H    ASN 103           H        ASN 103   7.770  -9.210  -6.830
  227   1HD2  ASN 103           HD2      ASN 103  10.250  -6.320  -8.480
  228   2HD2  ASN 103           HD2      ASN 103   9.960  -8.010  -8.740
  229    H    LYS 104           H        LYS 104   4.080  -7.510  -7.520
  230   1HZ   LYS 104           HZ1      LYS 104   2.520 -12.930  -2.570
  231   2HZ   LYS 104           HZ2      LYS 104   3.960 -13.510  -2.090
  232   3HZ   LYS 104           HZ3      LYS 104   3.480 -12.010  -1.620
  233    H    HIS 105           H        HIS 105   0.590 -10.070  -7.940
  234    HD1  HIS 105           HD1      HIS 105  -1.670  -9.180 -12.340
  235    HE2  HIS 105           HE2      HIS 105   0.440 -12.620 -12.220
  236    H    ILE 106           H        ILE 106  -2.120  -6.460  -8.910
  237    H    ILE 107           H        ILE 107  -4.180  -6.400  -5.000
  238    H    VAL 108           H        VAL 108  -7.060  -3.750  -6.400
  239    H    ALA 109           H        ALA 109  -8.750  -1.380  -3.040
  240    H    CYS 110           H        CYS 110 -12.570  -0.760  -5.270
  241    H    GLU 111           H        GLU 111 -12.500   3.720  -5.930
  242    H    GLY 112           H        GLY 112 -16.240   5.930  -6.420
  243    H    ASN 113           H        ASN 113 -14.800  10.040  -7.500
  244   1HD2  ASN 113           HD2      ASN 113 -17.580  12.590 -12.280
  245   2HD2  ASN 113           HD2      ASN 113 -17.880  12.720 -10.560
  246    OH   TYR 115           OH       TYR 115 -15.960   0.650  -8.700
  247    H    TYR 115           H        TYR 115 -12.810   7.240 -11.950
  248    HH   TYR 115           HH       TYR 115 -16.740   1.040  -8.200
  249    H    VAL 116           H        VAL 116 -11.830   5.790  -7.970
  250    H    VAL 118           H        VAL 118  -9.830   2.560  -3.560
  251    H    HIS 119           H        HIS 119  -9.130   1.380  -1.880
  252    HD1  HIS 119           HD1      HIS 119  -8.930   2.250   2.540
  253    HE2  HIS 119           HE2      HIS 119 -12.950   2.130   2.180
  254    H    PHE 120           H        PHE 120  -6.010  -0.270   0.710
  255    H    ASP 121           H        ASP 121  -5.720  -4.150  -1.510
  256    H    ALA 122           H        ALA 122  -5.570  -6.730  -2.070
  257    H    SER 123           H        SER 123  -1.610  -8.460  -1.490
  258    HG   SER 123           HG       SER 123   1.180  -8.930  -1.850
  259    H    VAL 124           H        VAL 124  -1.580  -9.830  -5.560
   
  Start of MODEL          15
 Raw file had 259 H/Q atoms
  Start of MODEL   15
    1   1H    LYS   1          1H        LYS   1  -9.270  17.560   0.820
    2   2H    LYS   1          2H        LYS   1  -9.410  18.710   1.980
    3   3H    LYS   1          3H        LYS   1  -7.970  17.970   1.760
    4   1HZ   LYS   1          3HZ       LYS   1 -14.840  19.400   3.550
    5   2HZ   LYS   1          1HZ       LYS   1 -14.620  18.800   5.060
    6   3HZ   LYS   1          2HZ       LYS   1 -14.610  20.430   4.830
    7    H    GLU   2           H        GLU   2  -8.470  15.370   4.490
    8    H    THR   3           H        THR   3  -9.200  12.670   1.770
    9    HG1  THR   3           HG1      THR   3 -10.790  12.610  -0.220
   10    H    ALA   4           H        ALA   4 -11.520   8.850   2.020
   11    H    ALA   5           H        ALA   5 -10.110   8.510  -0.840
   12    H    ALA   6           H        ALA   6  -7.810  10.020  -0.280
   13    H    LYS   7           H        LYS   7  -6.690   8.770   1.740
   14   1HZ   LYS   7          2HZ       LYS   7  -6.500   6.560   6.260
   15   2HZ   LYS   7          3HZ       LYS   7  -6.870   6.760   7.870
   16   3HZ   LYS   7          1HZ       LYS   7  -7.830   5.860   6.900
   17    H    PHE   8           H        PHE   8  -5.970   6.260   0.430
   18    H    GLU   9           H        GLU   9  -3.940   7.260  -1.360
   19    NH1  ARG  10           NH1      ARG  10  -2.220   9.940   6.950
   20    NH2  ARG  10           NH2      ARG  10  -3.850   8.390   7.050
   21    H    ARG  10           H        ARG  10  -2.120   8.260   0.780
   22    HE   ARG  10           HE       ARG  10  -2.430   7.080   5.500
   23   1HH1  ARG  10          2HH1      ARG  10  -1.320  10.230   6.640
   24   2HH1  ARG  10          1HH1      ARG  10  -2.750  10.500   7.590
   25   1HH2  ARG  10          2HH2      ARG  10  -4.210   7.470   6.860
   26   2HH2  ARG  10          1HH2      ARG  10  -4.330   9.000   7.680
   27    H    GLN  11           H        GLN  11  -1.460   6.010   2.480
   28   1HE2  GLN  11          1HE2      GLN  11  -3.360   1.090   5.430
   29   2HE2  GLN  11          2HE2      GLN  11  -1.690   1.410   5.070
   30    H    HIS  12           H        HIS  12  -0.240   4.590   0.350
   31    HD1  HIS  12           HD1      HIS  12   0.180   0.230   0.850
   32    HE2  HIS  12           HE2      HIS  12  -3.310   1.320   2.410
   33    H    MET  13           H        MET  13   0.690   5.350  -1.730
   34    H    ASP  14           H        ASP  14   4.080   4.430  -4.620
   35    H    SER  15           H        SER  15   5.060   6.700  -5.780
   36    HG   SER  15           HG       SER  15   5.040   9.270  -7.940
   37    H    SER  16           H        SER  16   7.610   8.190  -5.820
   38    HG   SER  16           HG       SER  16  11.670   9.440  -5.770
   39    H    THR  17           H        THR  17   9.450   5.970  -5.500
   40    HG1  THR  17           HG1      THR  17  10.670   4.030  -2.660
   41    H    SER  18           H        SER  18  12.350   3.410  -7.500
   42    HG   SER  18           HG       SER  18  13.620   0.940  -9.250
   43    H    ALA  19           H        ALA  19  11.750   1.440  -5.820
   44    H    ALA  20           H        ALA  20  11.060  -1.790  -3.150
   45    H    SER  21           H        SER  21  14.650   0.290  -2.010
   46    HG   SER  21           HG       SER  21  17.320   2.120  -1.840
   47    H    SER  22           H        SER  22  15.480  -1.780  -0.290
   48    HG   SER  22           HG       SER  22  18.120  -1.260   3.780
   49    H    SER  23           H        SER  23  17.410  -4.540   2.210
   50    HG   SER  23           HG       SER  23  18.100  -6.970   4.340
   51    H    ASN  24           H        ASN  24  16.490  -2.970   4.270
   52   1HD2  ASN  24          1HD2      ASN  24  17.010   1.300   6.580
   53   2HD2  ASN  24          2HD2      ASN  24  16.060   0.380   7.690
   54    OH   TYR  25           OH       TYR  25  10.120   3.400  -1.000
   55    H    TYR  25           H        TYR  25  14.610  -1.610   3.460
   56    HH   TYR  25           HH       TYR  25   9.120   3.250  -0.890
   57    H    CYS  26           H        CYS  26  11.400  -1.010   4.490
   58    H    ASN  27           H        ASN  27  12.060   0.070   7.010
   59   1HD2  ASN  27          1HD2      ASN  27  13.490   1.960  12.140
   60   2HD2  ASN  27          2HD2      ASN  27  12.050   1.560  11.250
   61    H    GLN  28           H        GLN  28  13.010   2.900   6.870
   62   1HE2  GLN  28          1HE2      GLN  28  15.750   3.370   9.880
   63   2HE2  GLN  28          2HE2      GLN  28  15.310   5.070   9.860
   64    H    MET  29           H        MET  29  11.380   3.900   5.260
   65    H    MET  30           H        MET  30   8.700   3.570   6.220
   66    H    LYS  31           H        LYS  31   8.760   5.390   8.310
   67   1HZ   LYS  31          2HZ       LYS  31  11.650   7.460  13.120
   68   2HZ   LYS  31          3HZ       LYS  31  10.850   6.140  13.680
   69   3HZ   LYS  31          1HZ       LYS  31  12.430   6.340  14.040
   70    H    SER  32           H        SER  32   9.000   8.060   7.170
   71    HG   SER  32           HG       SER  32   7.920  11.380   4.760
   72    NH1  ARG  33           NH2      ARG  33   3.540   7.610   0.110
   73    NH2  ARG  33           NH1      ARG  33   5.460   8.130  -0.960
   74    H    ARG  33           H        ARG  33   6.320   8.100   6.000
   75    HE   ARG  33           HE       ARG  33   6.140   9.150   1.200
   76   1HH1  ARG  33          2HH2      ARG  33   2.990   7.550   0.960
   77   2HH1  ARG  33          1HH2      ARG  33   3.190   7.220  -0.740
   78   1HH2  ARG  33          2HH1      ARG  33   6.400   8.470  -0.990
   79   2HH2  ARG  33          1HH1      ARG  33   5.040   7.720  -1.770
   80    H    ASN  34           H        ASN  34   4.900   9.700   8.080
   81   1HD2  ASN  34          1HD2      ASN  34   3.890  13.400   8.020
   82   2HD2  ASN  34          2HD2      ASN  34   3.150  12.040   7.210
   83    H    LEU  35           H        LEU  35   3.280   7.300   8.290
   84    H    THR  36           H        THR  36   4.220   6.380  10.830
   85    HG1  THR  36           HG1      THR  36   7.110   5.880  12.500
   86    H    LYS  37           H        LYS  37   3.300   7.710  12.660
   87   1HZ   LYS  37          3HZ       LYS  37   8.350  10.490  14.210
   88   2HZ   LYS  37          1HZ       LYS  37   9.330  10.560  12.870
   89   3HZ   LYS  37          2HZ       LYS  37   8.110  11.640  13.060
   90    H    ASP  38           H        ASP  38   2.290   6.930  15.240
   91    NH1  ARG  39           NH2      ARG  39  -0.840  -0.950  19.090
   92    NH2  ARG  39           NH1      ARG  39   0.630  -1.740  17.530
   93    H    ARG  39           H        ARG  39   0.930   5.180  16.050
   94    HE   ARG  39           HE       ARG  39   0.430   0.470  16.510
   95   1HH1  ARG  39          2HH2      ARG  39  -1.370  -0.190  19.460
   96   2HH1  ARG  39          1HH2      ARG  39  -0.800  -1.830  19.560
   97   1HH2  ARG  39          2HH1      ARG  39   1.240  -1.570  16.760
   98   2HH2  ARG  39          1HH1      ARG  39   0.630  -2.620  18.000
   99    H    CYS  40           H        CYS  40   3.890   2.240  17.020
  100    H    LYS  41           H        LYS  41   3.280   1.430  12.590
  101   1HZ   LYS  41          2HZ       LYS  41  -1.450   2.250   7.280
  102   2HZ   LYS  41          3HZ       LYS  41  -2.070   3.460   8.200
  103   3HZ   LYS  41          1HZ       LYS  41  -0.470   3.380   7.910
  104    H    VAL  43           H        VAL  43   0.530  -3.090  10.230
  105    H    ASN  44           H        ASN  44   2.710  -3.460   6.630
  106   1HD2  ASN  44          1HD2      ASN  44   1.920   1.930   3.850
  107   2HD2  ASN  44          2HD2      ASN  44   3.190   1.330   4.870
  108    H    THR  45           H        THR  45   1.150  -1.150   3.260
  109    HG1  THR  45           HG1      THR  45   1.520  -4.400   2.630
  110    H    PHE  46           H        PHE  46   4.490  -1.370   0.750
  111    H    VAL  47           H        VAL  47   3.230   1.550  -2.290
  112    H    HIS  48           H        HIS  48   5.090  -0.070  -5.620
  113    HD1  HIS  48           HD1      HIS  48   8.950   2.790  -4.650
  114    HE2  HIS  48           HE2      HIS  48   8.910  -0.400  -2.170
  115    H    GLU  49           H        GLU  49   3.870   2.740  -6.950
  116    H    SER  50           H        SER  50   3.040   4.570 -10.860
  117    HG   SER  50           HG       SER  50   1.790   4.900 -12.310
  118    H    LEU  51           H        LEU  51   0.060   7.770  -9.190
  119    H    ALA  52           H        ALA  52  -1.770   7.950 -11.430
  120    H    ASP  53           H        ASP  53  -0.820   5.350 -12.820
  121    H    VAL  54           H        VAL  54  -1.960   3.680 -10.900
  122    H    GLN  55           H        GLN  55  -4.430   4.170 -10.690
  123   1HE2  GLN  55          1HE2      GLN  55  -8.530   8.520 -11.220
  124   2HE2  GLN  55          2HE2      GLN  55  -8.930   6.870 -10.830
  125    H    ALA  56           H        ALA  56  -5.040   2.710 -13.090
  126    H    VAL  57           H        VAL  57  -5.760   0.210 -11.640
  127    H    CYS  58           H        CYS  58  -8.070   0.000 -11.010
  128    H    SER  59           H        SER  59  -9.400  -1.240 -13.260
  129    HG   SER  59           HG       SER  59 -12.110  -1.800 -16.500
  130    H    GLN  60           H        GLN  60  -9.570  -3.590 -13.360
  131   1HE2  GLN  60          1HE2      GLN  60  -3.930  -3.180 -15.460
  132   2HE2  GLN  60          2HE2      GLN  60  -5.450  -2.310 -15.540
  133    H    LYS  61           H        LYS  61  -9.060  -6.550 -12.750
  134   1HZ   LYS  61          2HZ       LYS  61  -8.190 -13.800 -12.720
  135   2HZ   LYS  61          3HZ       LYS  61  -8.370 -13.750 -11.080
  136   3HZ   LYS  61          1HZ       LYS  61  -9.270 -14.780 -11.980
  137    H    ASN  62           H        ASN  62 -13.060  -8.370 -12.180
  138   1HD2  ASN  62          2HD2      ASN  62 -15.760  -6.300  -7.400
  139   2HD2  ASN  62          1HD2      ASN  62 -14.230  -6.030  -8.190
  140    H    VAL  63           H        VAL  63 -13.000  -7.680  -7.700
  141    H    ALA  64           H        ALA  64 -12.790 -10.960  -4.780
  142    H    CYS  65           H        CYS  65 -14.180  -7.910  -1.780
  143    H    LYS  66           H        LYS  66 -10.770  -7.420   1.350
  144   1HZ   LYS  66          2HZ       LYS  66 -10.340  -4.290   5.500
  145   2HZ   LYS  66          3HZ       LYS  66  -9.090  -3.460   4.830
  146   3HZ   LYS  66          1HZ       LYS  66 -10.600  -2.820   4.830
  147    H    ASN  67           H        ASN  67 -13.260  -7.120   3.140
  148   1HD2  ASN  67          1HD2      ASN  67 -15.810  -3.870   2.620
  149   2HD2  ASN  67          2HD2      ASN  67 -15.820  -4.140   4.320
  150    H    GLY  68           H        GLY  68 -14.750  -9.090   1.910
  151    H    GLN  69           H        GLN  69 -16.260  -7.460   0.790
  152   1HE2  GLN  69          1HE2      GLN  69 -18.900  -7.010   3.670
  153   2HE2  GLN  69          2HE2      GLN  69 -19.230  -7.810   2.160
  154    H    THR  70           H        THR  70 -18.540  -7.000  -3.120
  155    HG1  THR  70           HG1      THR  70 -17.080  -8.290  -7.300
  156    H    ASN  71           H        ASN  71 -15.720  -5.460  -3.440
  157   1HD2  ASN  71          1HD2      ASN  71 -15.850   0.100  -5.270
  158   2HD2  ASN  71          2HD2      ASN  71 -16.180  -1.480  -5.950
  159    H    CYS  72           H        CYS  72 -13.560  -5.730  -5.310
  160    OH   TYR  73           OH       TYR  73 -15.660  -2.180  -8.620
  161    H    TYR  73           H        TYR  73  -9.750  -4.350  -6.350
  162    HH   TYR  73           HH       TYR  73 -15.630  -1.160  -8.480
  163    H    GLN  74           H        GLN  74  -9.060  -7.050  -9.660
  164   1HE2  GLN  74          1HE2      GLN  74  -4.470 -11.660 -11.470
  165   2HE2  GLN  74          2HE2      GLN  74  -4.180 -11.430  -9.760
  166    H    SER  75           H        SER  75  -4.710  -6.240 -10.140
  167    HG   SER  75           HG       SER  75  -1.750  -6.060 -11.440
  168    OH   TYR  76           OH       TYR  76  -9.890  -9.530 -16.270
  169    H    TYR  76           H        TYR  76  -4.820  -7.110 -14.580
  170    HH   TYR  76           HH       TYR  76 -10.280  -8.590 -16.250
  171    H    SER  77           H        SER  77  -2.110  -6.830 -14.700
  172    HG   SER  77           HG       SER  77  -0.250  -4.580 -14.270
  173    H    THR  78           H        THR  78   2.050  -8.270 -13.570
  174    HG1  THR  78           HG1      THR  78   4.650  -7.490 -12.570
  175    H    MET  79           H        MET  79   2.360  -6.470  -9.300
  176    H    SER  80           H        SER  80   4.910  -2.790  -9.330
  177    HG   SER  80           HG       SER  80   6.940  -0.320  -8.780
  178    H    ILE  81           H        ILE  81   5.760  -4.870  -5.640
  179    H    THR  82           H        THR  82   5.410  -2.480  -2.040
  180    HG1  THR  82           HG1      THR  82   8.400  -2.730  -2.580
  181    H    ASP  83           H        ASP  83   6.580  -5.630   0.110
  182    H    CYS  84           H        CYS  84   4.510  -4.540   4.000
  183    NH1  ARG  85           NH2      ARG  85   6.790 -11.120   6.380
  184    NH2  ARG  85           NH1      ARG  85   7.870 -10.060   4.690
  185    H    ARG  85           H        ARG  85   7.080  -5.940   6.970
  186    HE   ARG  85           HE       ARG  85   5.760  -8.670   4.620
  187   1HH1  ARG  85          2HH2      ARG  85   6.010 -11.150   7.000
  188   2HH1  ARG  85          1HH2      ARG  85   7.540 -11.770   6.440
  189   1HH2  ARG  85          1HH1      ARG  85   7.950  -9.360   3.980
  190   2HH2  ARG  85          2HH1      ARG  85   8.600 -10.730   4.790
  191    H    GLU  86           H        GLU  86   4.800  -5.630  10.670
  192    H    THR  87           H        THR  87   8.940  -5.260  12.550
  193    HG1  THR  87           HG1      THR  87  12.190  -8.860  12.680
  194    H    GLY  88           H        GLY  88  10.800  -8.380  15.340
  195    H    SER  89           H        SER  89  12.090  -5.940  16.240
  196    HG   SER  89           HG       SER  89  14.250  -3.920  15.180
  197    H    SER  90           H        SER  90  10.060  -4.020  16.990
  198    HG   SER  90           HG       SER  90   7.660  -2.920  17.610
  199    H    LYS  91           H        LYS  91  10.730   0.230  17.560
  200   1HZ   LYS  91          2HZ       LYS  91  14.070   1.550  22.460
  201   2HZ   LYS  91          3HZ       LYS  91  14.570   0.000  22.670
  202   3HZ   LYS  91          1HZ       LYS  91  15.320   0.970  21.580
  203    OH   TYR  92           OH       TYR  92   4.720   9.770  18.720
  204    H    TYR  92           H        TYR  92   8.300   2.800  20.350
  205    HH   TYR  92           HH       TYR  92   4.170   9.770  17.870
  206    H    ASN  94           H        ASN  94  10.810   4.430  17.340
  207   1HD2  ASN  94          2HD2      ASN  94  13.700   1.890  18.900
  208   2HD2  ASN  94          1HD2      ASN  94  13.990   1.680  17.200
  209    H    CYS  95           H        CYS  95   9.860   3.270  14.110
  210    H    ALA  96           H        ALA  96  10.120  -1.190  14.170
  211    OH   TYR  97           OH       TYR  97   5.400  -0.130  11.620
  212    H    TYR  97           H        TYR  97  11.630  -2.220  10.090
  213    HH   TYR  97           HH       TYR  97   4.610  -0.760  11.730
  214    H    LYS  98           H        LYS  98   9.310  -5.790   9.100
  215   1HZ   LYS  98          3HZ       LYS  98  14.030 -10.290   7.330
  216   2HZ   LYS  98          1HZ       LYS  98  13.420 -11.790   7.540
  217   3HZ   LYS  98          2HZ       LYS  98  14.010 -11.350   6.080
  218    H    THR  99           H        THR  99  11.920  -6.020   5.720
  219    HG1  THR  99           HG1      THR  99  12.060  -3.710   5.910
  220    H    THR 100           H        THR 100   9.000  -5.970   2.400
  221    HG1  THR 100           HG1      THR 100  10.310  -8.750   2.730
  222    H    GLN 101           H        GLN 101  11.440  -6.750  -0.990
  223   1HE2  GLN 101          2HE2      GLN 101   8.310  -4.790  -5.930
  224   2HE2  GLN 101          1HE2      GLN 101   9.740  -5.760  -6.040
  225    H    ALA 102           H        ALA 102   7.980  -6.340  -3.580
  226    H    ASN 103           H        ASN 103   7.870  -9.070  -7.040
  227   1HD2  ASN 103          1HD2      ASN 103   8.550  -5.230 -10.520
  228   2HD2  ASN 103          2HD2      ASN 103   7.300  -6.250 -11.180
  229    H    LYS 104           H        LYS 104   4.040  -7.530  -7.500
  230   1HZ   LYS 104          3HZ       LYS 104   4.110 -12.360  -3.460
  231   2HZ   LYS 104          1HZ       LYS 104   3.630 -13.760  -4.140
  232   3HZ   LYS 104          2HZ       LYS 104   5.100 -13.660  -3.440
  233    H    HIS 105           H        HIS 105   0.560 -10.140  -7.820
  234    HD1  HIS 105           HD1      HIS 105  -1.950  -9.440 -12.100
  235    HE2  HIS 105           HE2      HIS 105   0.390 -12.740 -11.990
  236    H    ILE 106           H        ILE 106  -2.280  -6.590  -8.650
  237    H    ILE 107           H        ILE 107  -4.010  -6.350  -4.600
  238    H    VAL 108           H        VAL 108  -6.990  -3.840  -6.000
  239    H    ALA 109           H        ALA 109  -8.700  -1.330  -2.720
  240    H    CYS 110           H        CYS 110 -12.560  -0.680  -5.020
  241    H    GLU 111           H        GLU 111 -12.440   3.790  -5.900
  242    H    GLY 112           H        GLY 112 -16.170   6.130  -5.970
  243    H    ASN 113           H        ASN 113 -14.950  10.030  -7.810
  244   1HD2  ASN 113          1HD2      ASN 113 -17.780  12.260 -12.630
  245   2HD2  ASN 113          2HD2      ASN 113 -17.960  12.360 -10.900
  246    OH   TYR 115           OH       TYR 115 -15.800   0.440  -8.180
  247    H    TYR 115           H        TYR 115 -13.060   6.910 -11.910
  248    HH   TYR 115           HH       TYR 115 -16.330   0.860  -7.440
  249    H    VAL 116           H        VAL 116 -11.750   5.870  -7.960
  250    H    VAL 118           H        VAL 118  -9.720   2.690  -3.490
  251    H    HIS 119           H        HIS 119  -8.890   1.550  -1.830
  252    HD1  HIS 119           HD1      HIS 119  -8.620   2.620   2.590
  253    HE2  HIS 119           HE2      HIS 119 -12.650   2.620   2.320
  254    H    PHE 120           H        PHE 120  -5.720   0.080   0.730
  255    H    ASP 121           H        ASP 121  -5.550  -3.940  -1.270
  256    H    ALA 122           H        ALA 122  -5.190  -6.480  -1.610
  257    H    SER 123           H        SER 123  -1.410  -8.530  -1.110
  258    HG   SER 123           HG       SER 123   0.510  -6.420  -2.230
  259    H    VAL 124           H        VAL 124  -1.310  -9.840  -5.360
   
  Start of MODEL          16
 Raw file had 259 H/Q atoms
  Start of MODEL   16
    1   1H    LYS   1           H2       LYS   1  -9.450  17.390   3.950
    2   2H    LYS   1           H3       LYS   1  -9.960  18.120   5.330
    3   3H    LYS   1           H1       LYS   1  -8.370  17.800   5.100
    4   1HZ   LYS   1           HZ1      LYS   1 -14.460  16.820   4.840
    5   2HZ   LYS   1           HZ2      LYS   1 -15.080  18.070   5.710
    6   3HZ   LYS   1           HZ3      LYS   1 -14.290  18.350   4.280
    7    H    GLU   2           H        GLU   2  -8.820  14.000   6.450
    8    H    THR   3           H        THR   3  -9.300  12.570   2.700
    9    HG1  THR   3           HG1      THR   3 -10.210  12.490  -0.190
   10    H    ALA   4           H        ALA   4 -11.820   8.890   1.860
   11    H    ALA   5           H        ALA   5 -10.270   8.370  -0.740
   12    H    ALA   6           H        ALA   6  -8.010   9.760   0.300
   13    H    LYS   7           H        LYS   7  -6.990   8.200   2.160
   14   1HZ   LYS   7           HZ1      LYS   7  -9.830   6.700   7.300
   15   2HZ   LYS   7           HZ2      LYS   7 -10.580   8.140   7.000
   16   3HZ   LYS   7           HZ3      LYS   7 -10.700   6.880   5.930
   17    H    PHE   8           H        PHE   8  -6.230   5.730   0.830
   18    H    GLU   9           H        GLU   9  -4.180   7.140  -0.770
   19    NH1  ARG  10           NH1      ARG  10  -1.140   8.140   8.430
   20    NH2  ARG  10           NH2      ARG  10  -3.120   7.040   8.170
   21    H    ARG  10           H        ARG  10  -2.350   8.010   1.470
   22    HE   ARG  10           HE       ARG  10  -3.400   8.380   6.180
   23   1HH1  ARG  10           HH1      ARG  10  -0.410   8.660   8.000
   24   2HH1  ARG  10           HH1      ARG  10  -1.020   7.740   9.330
   25   1HH2  ARG  10           HH2      ARG  10  -3.830   6.720   7.550
   26   2HH2  ARG  10           HH2      ARG  10  -3.020   6.640   9.070
   27    H    GLN  11           H        GLN  11  -1.680   5.630   2.770
   28   1HE2  GLN  11           HE2      GLN  11  -3.450   0.530   5.510
   29   2HE2  GLN  11           HE2      GLN  11  -1.790   0.980   5.190
   30    H    HIS  12           H        HIS  12  -0.520   4.290   0.660
   31    HD1  HIS  12           HD1      HIS  12  -0.120  -0.140   0.740
   32    HE2  HIS  12           HE2      HIS  12  -3.470   0.970   2.590
   33    H    MET  13           H        MET  13   0.690   5.210  -1.130
   34    H    ASP  14           H        ASP  14   3.930   4.340  -4.120
   35    H    SER  15           H        SER  15   4.920   6.770  -4.920
   36    HG   SER  15           HG       SER  15   3.280   6.140  -7.150
   37    H    SER  16           H        SER  16   7.460   7.860  -5.510
   38    HG   SER  16           HG       SER  16   9.950   8.510  -3.620
   39    H    THR  17           H        THR  17   9.150   5.770  -5.350
   40    HG1  THR  17           HG1      THR  17  10.240   3.950  -2.560
   41    H    SER  18           H        SER  18  12.030   3.180  -7.430
   42    HG   SER  18           HG       SER  18  13.660   1.080  -9.300
   43    H    ALA  19           H        ALA  19  11.960   0.970  -5.830
   44    H    ALA  20           H        ALA  20  11.110  -2.230  -3.140
   45    H    SER  21           H        SER  21  14.730  -0.330  -2.100
   46    HG   SER  21           HG       SER  21  17.310   1.490  -1.740
   47    H    SER  22           H        SER  22  15.420  -2.300  -0.170
   48    HG   SER  22           HG       SER  22  17.760  -1.210   3.620
   49    H    SER  23           H        SER  23  17.200  -5.100   2.470
   50    HG   SER  23           HG       SER  23  18.280  -6.920   4.720
   51    H    ASN  24           H        ASN  24  16.290  -3.180   4.270
   52   1HD2  ASN  24           HD2      ASN  24  19.380  -2.890   5.700
   53   2HD2  ASN  24           HD2      ASN  24  18.200  -3.890   6.500
   54    OH   TYR  25           OH       TYR  25   9.990   3.110  -1.000
   55    H    TYR  25           H        TYR  25  14.470  -1.940   3.470
   56    HH   TYR  25           HH       TYR  25   9.010   2.880  -0.830
   57    H    CYS  26           H        CYS  26  11.670  -1.100   4.340
   58    H    ASN  27           H        ASN  27  12.460   0.230   6.810
   59   1HD2  ASN  27           HD2      ASN  27  14.760  -1.210  10.680
   60   2HD2  ASN  27           HD2      ASN  27  14.970   0.520  10.660
   61    H    GLN  28           H        GLN  28  13.270   3.190   6.780
   62   1HE2  GLN  28           HE2      GLN  28  12.460   8.680   4.280
   63   2HE2  GLN  28           HE2      GLN  28  12.010   8.120   5.850
   64    H    MET  29           H        MET  29  11.410   3.870   5.170
   65    H    MET  30           H        MET  30   8.740   3.370   6.160
   66    H    LYS  31           H        LYS  31   8.720   5.470   8.150
   67   1HZ   LYS  31           HZ2      LYS  31  13.350   8.360  11.430
   68   2HZ   LYS  31           HZ3      LYS  31  12.820   9.060  12.810
   69   3HZ   LYS  31           HZ1      LYS  31  13.050   7.450  12.750
   70    H    SER  32           H        SER  32   8.900   7.840   6.670
   71    HG   SER  32           HG       SER  32  10.420  10.270   5.300
   72    NH1  ARG  33           NH2      ARG  33   2.690   9.740  -0.250
   73    NH2  ARG  33           NH1      ARG  33   2.900  11.400   1.290
   74    H    ARG  33           H        ARG  33   6.310   7.670   5.340
   75    HE   ARG  33           HE       ARG  33   3.810   9.600   2.740
   76   1HH1  ARG  33           HH2      ARG  33   2.750   8.760  -0.460
   77   2HH1  ARG  33           HH2      ARG  33   2.300  10.390  -0.890
   78   1HH2  ARG  33           HH1      ARG  33   3.100  11.700   2.230
   79   2HH2  ARG  33           HH1      ARG  33   2.490  12.030   0.640
   80    H    ASN  34           H        ASN  34   4.850   9.710   7.080
   81   1HD2  ASN  34           HD2      ASN  34   2.260  13.780   8.600
   82   2HD2  ASN  34           HD2      ASN  34   1.270  12.540   9.340
   83    H    LEU  35           H        LEU  35   3.400   7.060   7.860
   84    H    THR  36           H        THR  36   4.660   6.110  10.270
   85    HG1  THR  36           HG1      THR  36   7.560   6.030  12.310
   86    H    LYS  37           H        LYS  37   3.620   7.920  11.960
   87   1HZ   LYS  37           HZ1      LYS  37   8.860  11.090  13.380
   88   2HZ   LYS  37           HZ2      LYS  37   9.570  11.690  12.040
   89   3HZ   LYS  37           HZ3      LYS  37   8.430  12.560  12.830
   90    H    ASP  38           H        ASP  38   2.500   7.360  14.330
   91    NH1  ARG  39           NH2      ARG  39  -1.050   0.120  17.730
   92    NH2  ARG  39           NH1      ARG  39  -2.240   0.760  15.960
   93    H    ARG  39           H        ARG  39   1.380   5.500  15.320
   94    HE   ARG  39           HE       ARG  39  -1.740   3.120  16.800
   95   1HH1  ARG  39           HH2      ARG  39  -0.530   0.300  18.560
   96   2HH1  ARG  39           HH2      ARG  39  -1.190  -0.810  17.400
   97   1HH2  ARG  39           HH1      ARG  39  -2.560   1.430  15.290
   98   2HH2  ARG  39           HH1      ARG  39  -2.360  -0.210  15.800
   99    H    CYS  40           H        CYS  40   4.230   2.700  16.910
  100    H    LYS  41           H        LYS  41   3.560   1.710  12.610
  101   1HZ   LYS  41           HZ2      LYS  41  -1.200   1.760   7.280
  102   2HZ   LYS  41           HZ3      LYS  41  -2.480   2.310   8.130
  103   3HZ   LYS  41           HZ1      LYS  41  -1.030   3.090   8.210
  104    H    VAL  43           H        VAL  43   0.830  -3.150  10.470
  105    H    ASN  44           H        ASN  44   2.800  -3.620   6.740
  106   1HD2  ASN  44           HD2      ASN  44   2.020   1.500   3.680
  107   2HD2  ASN  44           HD2      ASN  44   3.300   0.840   4.670
  108    H    THR  45           H        THR  45   0.720  -2.040   3.370
  109    HG1  THR  45           HG1      THR  45   1.120  -5.480   1.350
  110    H    PHE  46           H        PHE  46   4.330  -1.680   1.010
  111    H    VAL  47           H        VAL  47   3.180   1.340  -2.050
  112    H    HIS  48           H        HIS  48   4.920  -0.270  -5.520
  113    HD1  HIS  48           HD1      HIS  48   8.850   2.510  -4.440
  114    HE2  HIS  48           HE2      HIS  48   8.980  -0.810  -2.130
  115    H    GLU  49           H        GLU  49   3.830   2.580  -6.940
  116    H    SER  50           H        SER  50   3.620   4.590 -10.830
  117    HG   SER  50           HG       SER  50   1.890   4.830 -12.160
  118    H    LEU  51           H        LEU  51   0.490   7.640  -8.980
  119    H    ALA  52           H        ALA  52  -1.320   7.820 -11.370
  120    H    ASP  53           H        ASP  53  -0.460   5.140 -12.650
  121    H    VAL  54           H        VAL  54  -1.870   3.700 -10.770
  122    H    GLN  55           H        GLN  55  -4.240   4.220 -10.440
  123   1HE2  GLN  55           HE2      GLN  55  -8.050   8.810 -10.920
  124   2HE2  GLN  55           HE2      GLN  55  -8.570   7.170 -10.610
  125    H    ALA  56           H        ALA  56  -4.780   2.950 -12.960
  126    H    VAL  57           H        VAL  57  -5.620   0.360 -11.720
  127    H    CYS  58           H        CYS  58  -7.940   0.070 -11.020
  128    H    SER  59           H        SER  59  -9.080  -0.570 -13.640
  129    HG   SER  59           HG       SER  59  -8.760  -0.370 -16.610
  130    H    GLN  60           H        GLN  60  -9.410  -3.200 -13.820
  131   1HE2  GLN  60           HE2      GLN  60  -3.660  -2.770 -15.630
  132   2HE2  GLN  60           HE2      GLN  60  -5.200  -1.940 -15.650
  133    H    LYS  61           H        LYS  61  -9.080  -6.230 -13.290
  134   1HZ   LYS  61           HZ1      LYS  61  -9.690 -10.590 -11.090
  135   2HZ   LYS  61           HZ2      LYS  61  -9.970 -12.190 -10.970
  136   3HZ   LYS  61           HZ3      LYS  61  -8.440 -11.610 -10.800
  137    H    ASN  62           H        ASN  62 -13.210  -7.490 -12.800
  138   1HD2  ASN  62           HD2      ASN  62 -15.750  -5.870  -7.830
  139   2HD2  ASN  62           HD2      ASN  62 -14.340  -5.350  -8.730
  140    H    VAL  63           H        VAL  63 -13.100  -7.420  -8.220
  141    H    ALA  64           H        ALA  64 -12.910 -11.000  -5.690
  142    H    CYS  65           H        CYS  65 -13.960  -8.150  -2.420
  143    H    LYS  66           H        LYS  66 -10.380  -8.620   0.490
  144   1HZ   LYS  66           HZ3      LYS  66  -6.850 -13.380   2.640
  145   2HZ   LYS  66           HZ1      LYS  66  -7.200 -13.430   1.050
  146   3HZ   LYS  66           HZ2      LYS  66  -5.650 -13.260   1.520
  147    H    ASN  67           H        ASN  67 -12.860  -8.560   2.600
  148   1HD2  ASN  67           HD2      ASN  67 -15.470  -5.310   3.450
  149   2HD2  ASN  67           HD2      ASN  67 -15.560  -6.170   4.950
  150    H    GLY  68           H        GLY  68 -14.490 -10.140   1.160
  151    H    GLN  69           H        GLN  69 -15.790  -8.230   0.360
  152   1HE2  GLN  69           HE2      GLN  69 -19.040  -6.210   3.450
  153   2HE2  GLN  69           HE2      GLN  69 -19.770  -6.820   1.980
  154    H    THR  70           H        THR  70 -18.450  -7.290  -3.140
  155    HG1  THR  70           HG1      THR  70 -17.550  -7.870  -7.470
  156    H    ASN  71           H        ASN  71 -15.900  -5.480  -3.670
  157   1HD2  ASN  71           HD2      ASN  71 -16.113  -1.597  -1.346
  158   2HD2  ASN  71           HD2      ASN  71 -17.501  -1.918  -2.323
  159    H    CYS  72           H        CYS  72 -13.700  -5.710  -5.730
  160    OH   TYR  73           OH       TYR  73 -15.510  -1.830  -8.880
  161    H    TYR  73           H        TYR  73  -9.750  -4.520  -6.630
  162    HH   TYR  73           HH       TYR  73 -15.660  -1.620  -7.880
  163    H    GLN  74           H        GLN  74  -9.080  -6.850 -10.160
  164   1HE2  GLN  74           HE2      GLN  74  -4.860 -11.970 -11.000
  165   2HE2  GLN  74           HE2      GLN  74  -4.310 -10.350 -11.360
  166    H    SER  75           H        SER  75  -4.670  -6.300 -10.470
  167    HG   SER  75           HG       SER  75  -1.670  -5.890 -11.630
  168    OH   TYR  76           OH       TYR  76  -9.690  -8.590 -17.350
  169    H    TYR  76           H        TYR  76  -4.550  -6.700 -15.000
  170    HH   TYR  76           HH       TYR  76 -10.040  -7.640 -17.310
  171    H    SER  77           H        SER  77  -1.880  -6.650 -15.030
  172    HG   SER  77           HG       SER  77   0.310  -4.390 -14.700
  173    H    THR  78           H        THR  78   2.180  -8.170 -13.680
  174    HG1  THR  78           HG1      THR  78   5.070  -7.870 -12.220
  175    H    MET  79           H        MET  79   2.390  -6.530  -9.380
  176    H    SER  80           H        SER  80   4.820  -2.870  -9.270
  177    HG   SER  80           HG       SER  80   8.760  -1.720  -7.370
  178    H    ILE  81           H        ILE  81   5.650  -5.040  -5.530
  179    H    THR  82           H        THR  82   5.230  -2.720  -1.830
  180    HG1  THR  82           HG1      THR  82   8.520  -3.580  -2.070
  181    H    ASP  83           H        ASP  83   6.610  -5.800   0.470
  182    H    CYS  84           H        CYS  84   4.630  -4.640   4.330
  183    NH1  ARG  85           NH2      ARG  85   1.600  -8.230  11.720
  184    NH2  ARG  85           NH1      ARG  85   2.710  -9.050  13.520
  185    H    ARG  85           H        ARG  85   7.450  -5.860   7.490
  186    HE   ARG  85           HE       ARG  85   4.720  -8.950  12.070
  187   1HH1  ARG  85           HH2      ARG  85   1.610  -7.890  10.780
  188   2HH1  ARG  85           HH2      ARG  85   0.760  -8.270  12.240
  189   1HH2  ARG  85           HH1      ARG  85   3.560  -9.320  13.970
  190   2HH2  ARG  85           HH1      ARG  85   1.830  -9.090  13.990
  191    H    GLU  86           H        GLU  86   5.310  -5.420  11.250
  192    H    THR  87           H        THR  87   9.380  -4.490  13.150
  193    HG1  THR  87           HG1      THR  87  11.270  -3.800  13.840
  194    H    GLY  88           H        GLY  88  10.450  -7.690  16.400
  195    H    SER  89           H        SER  89  12.170  -5.610  17.270
  196    HG   SER  89           HG       SER  89  14.070  -4.130  16.070
  197    H    SER  90           H        SER  90  10.310  -2.950  18.010
  198    HG   SER  90           HG       SER  90   9.520  -3.210  15.420
  199    H    LYS  91           H        LYS  91  11.470   1.190  17.200
  200   1HZ   LYS  91           HZ3      LYS  91  10.710   2.770  24.230
  201   2HZ   LYS  91           HZ1      LYS  91  10.300   4.300  24.630
  202   3HZ   LYS  91           HZ2      LYS  91   9.410   3.500  23.530
  203    OH   TYR  92           OH       TYR  92   4.560  10.290  17.900
  204    H    TYR  92           H        TYR  92   9.010   3.940  19.730
  205    HH   TYR  92           HH       TYR  92   4.030  10.210  17.040
  206    H    ASN  94           H        ASN  94  11.030   5.770  16.180
  207   1HD2  ASN  94           HD2      ASN  94  13.990   4.720  17.880
  208   2HD2  ASN  94           HD2      ASN  94  13.820   3.790  16.400
  209    H    CYS  95           H        CYS  95  10.050   3.760  13.360
  210    H    ALA  96           H        ALA  96  10.570  -0.790  13.920
  211    OH   TYR  97           OH       TYR  97   5.820   0.050  11.760
  212    H    TYR  97           H        TYR  97  12.110  -1.990   9.980
  213    HH   TYR  97           HH       TYR  97   4.980  -0.520  11.750
  214    H    LYS  98           H        LYS  98   9.780  -5.630   9.370
  215   1HZ   LYS  98           HZ3      LYS  98   9.110 -11.450  11.730
  216   2HZ   LYS  98           HZ1      LYS  98   9.460 -10.910  13.240
  217   3HZ   LYS  98           HZ2      LYS  98   8.310 -10.150  12.350
  218    H    THR  99           H        THR  99  12.160  -5.930   5.840
  219    HG1  THR  99           HG1      THR  99  12.120  -3.630   5.900
  220    H    THR 100           H        THR 100   9.090  -6.190   2.670
  221    HG1  THR 100           HG1      THR 100  10.040  -8.900   3.080
  222    H    GLN 101           H        GLN 101  11.400  -7.260  -0.910
  223   1HE2  GLN 101           HE2      GLN 101   8.420  -5.190  -6.070
  224   2HE2  GLN 101           HE2      GLN 101   8.640  -4.240  -4.650
  225    H    ALA 102           H        ALA 102   7.830  -6.640  -3.430
  226    H    ASN 103           H        ASN 103   7.650  -9.370  -6.810
  227   1HD2  ASN 103           HD2      ASN 103   8.330  -5.270  -9.940
  228   2HD2  ASN 103           HD2      ASN 103   8.990  -6.450  -8.840
  229    H    LYS 104           H        LYS 104   3.930  -7.590  -7.560
  230   1HZ   LYS 104           HZ1      LYS 104   2.940 -12.460  -2.200
  231   2HZ   LYS 104           HZ2      LYS 104   2.370 -13.650  -3.180
  232   3HZ   LYS 104           HZ3      LYS 104   3.820 -13.820  -2.400
  233    H    HIS 105           H        HIS 105   0.360 -10.060  -7.950
  234    HD1  HIS 105           HD1      HIS 105  -1.890  -9.190 -12.400
  235    HE2  HIS 105           HE2      HIS 105  -0.140 -12.820 -12.120
  236    H    ILE 106           H        ILE 106  -2.270  -6.390  -8.770
  237    H    ILE 107           H        ILE 107  -4.280  -6.250  -4.780
  238    H    VAL 108           H        VAL 108  -7.200  -3.750  -6.310
  239    H    ALA 109           H        ALA 109  -8.710  -1.160  -2.980
  240    H    CYS 110           H        CYS 110 -12.630  -0.530  -5.070
  241    H    GLU 111           H        GLU 111 -12.380   3.860  -6.150
  242    H    GLY 112           H        GLY 112 -16.120   6.160  -6.570
  243    H    ASN 113           H        ASN 113 -14.730  10.230  -7.780
  244   1HD2  ASN 113           HD2      ASN 113 -16.960  13.160 -12.470
  245   2HD2  ASN 113           HD2      ASN 113 -17.540  12.980 -10.830
  246    OH   TYR 115           OH       TYR 115 -16.090   0.780  -8.960
  247    H    TYR 115           H        TYR 115 -12.890   7.330 -11.790
  248    HH   TYR 115           HH       TYR 115 -15.680  -0.120  -9.220
  249    H    VAL 116           H        VAL 116 -11.590   6.130  -7.900
  250    H    VAL 118           H        VAL 118  -9.700   2.840  -3.510
  251    H    HIS 119           H        HIS 119  -8.930   1.650  -1.840
  252    HD1  HIS 119           HD1      HIS 119  -8.880   2.630   2.590
  253    HE2  HIS 119           HE2      HIS 119 -12.890   2.300   2.280
  254    H    PHE 120           H        PHE 120  -5.850  -0.040   0.710
  255    H    ASP 121           H        ASP 121  -5.690  -3.980  -1.370
  256    H    ALA 122           H        ALA 122  -5.780  -6.430  -1.750
  257    H    SER 123           H        SER 123  -2.020  -8.810  -1.410
  258    HG   SER 123           HG       SER 123   0.020  -7.300  -5.230
  259    H    VAL 124           H        VAL 124  -1.740 -10.000  -5.580
   
  Start of MODEL          17
 Raw file had 259 H/Q atoms
  Start of MODEL   17
    1   1H    LYS   1           H1       LYS   1 -10.800  16.260   5.560
    2   2H    LYS   1           H2       LYS   1 -10.870  16.540   7.170
    3   3H    LYS   1           H3       LYS   1  -9.420  16.550   6.390
    4   1HZ   LYS   1           HZ3      LYS   1 -15.370  13.040   9.230
    5   2HZ   LYS   1           HZ1      LYS   1 -15.400  13.500  10.790
    6   3HZ   LYS   1           HZ2      LYS   1 -16.100  14.450   9.650
    7    H    GLU   2           H        GLU   2  -8.500  12.900   6.930
    8    H    THR   3           H        THR   3  -9.710  11.920   3.260
    9    HG1  THR   3           HG1      THR   3 -12.080  12.550   1.900
   10    H    ALA   4           H        ALA   4 -11.530   7.800   2.890
   11    H    ALA   5           H        ALA   5 -10.360   8.380  -0.870
   12    H    ALA   6           H        ALA   6  -8.250   9.850  -0.290
   13    H    LYS   7           H        LYS   7  -7.210   8.290   1.690
   14   1HZ   LYS   7           HZ2      LYS   7  -7.030   2.780   4.590
   15   2HZ   LYS   7           HZ3      LYS   7  -8.180   2.380   3.470
   16   3HZ   LYS   7           HZ1      LYS   7  -7.030   3.480   3.130
   17    H    PHE   8           H        PHE   8  -6.380   5.830   0.510
   18    H    GLU   9           H        GLU   9  -4.260   7.070  -1.120
   19    NH1  ARG  10           NH2      ARG  10  -1.220   6.970   8.230
   20    NH2  ARG  10           NH1      ARG  10  -3.370   7.680   8.370
   21    H    ARG  10           H        ARG  10  -2.540   8.050   1.080
   22    HE   ARG  10           HE       ARG  10  -3.170   8.050   5.940
   23   1HH1  ARG  10           HH2      ARG  10  -0.430   6.750   7.670
   24   2HH1  ARG  10           HH2      ARG  10  -1.250   6.730   9.200
   25   1HH2  ARG  10           HH1      ARG  10  -4.210   7.980   7.930
   26   2HH2  ARG  10           HH1      ARG  10  -3.360   7.460   9.350
   27    H    GLN  11           H        GLN  11  -1.870   5.700   2.580
   28   1HE2  GLN  11           HE2      GLN  11  -3.690   0.530   5.160
   29   2HE2  GLN  11           HE2      GLN  11  -2.020   0.990   5.000
   30    H    HIS  12           H        HIS  12  -0.510   4.530   0.470
   31    HD1  HIS  12           HD1      HIS  12   0.180   0.140   0.570
   32    HE2  HIS  12           HE2      HIS  12  -3.410   0.930   2.150
   33    H    MET  13           H        MET  13   0.710   5.580  -1.430
   34    H    ASP  14           H        ASP  14   3.930   4.660  -4.490
   35    H    SER  15           H        SER  15   4.800   6.900  -5.820
   36    HG   SER  15           HG       SER  15   6.400   7.210  -9.760
   37    H    SER  16           H        SER  16   7.520   8.220  -5.960
   38    HG   SER  16           HG       SER  16   9.670   8.960  -3.720
   39    H    THR  17           H        THR  17   9.360   6.310  -5.700
   40    HG1  THR  17           HG1      THR  17   9.600   4.620  -4.150
   41    H    SER  18           H        SER  18  11.910   3.890  -8.200
   42    HG   SER  18           HG       SER  18  10.360   3.720 -10.690
   43    H    ALA  19           H        ALA  19  11.650   1.830  -6.310
   44    H    ALA  20           H        ALA  20  11.240  -1.330  -3.530
   45    H    SER  21           H        SER  21  14.510   1.220  -2.470
   46    HG   SER  21           HG       SER  21  17.070   3.320  -1.960
   47    H    SER  22           H        SER  22  15.610  -0.580  -0.560
   48    HG   SER  22           HG       SER  22  18.130   0.490   3.500
   49    H    SER  23           H        SER  23  17.990  -3.160   1.770
   50    HG   SER  23           HG       SER  23  19.200  -5.060   4.200
   51    H    ASN  24           H        ASN  24  16.820  -1.680   3.860
   52   1HD2  ASN  24           HD2      ASN  24  19.650  -0.750   5.640
   53   2HD2  ASN  24           HD2      ASN  24  18.680  -2.020   6.340
   54    OH   TYR  25           OH       TYR  25   9.260   3.650  -1.130
   55    H    TYR  25           H        TYR  25  14.570  -0.790   3.020
   56    HH   TYR  25           HH       TYR  25   9.740   4.330  -1.690
   57    H    CYS  26           H        CYS  26  11.790  -0.550   3.950
   58    H    ASN  27           H        ASN  27  12.290   0.750   6.520
   59   1HD2  ASN  27           HD2      ASN  27  14.270  -1.520   9.870
   60   2HD2  ASN  27           HD2      ASN  27  14.090   0.020  10.670
   61    H    GLN  28           H        GLN  28  12.940   3.600   7.040
   62   1HE2  GLN  28           HE2      GLN  28  15.160   5.360  10.550
   63   2HE2  GLN  28           HE2      GLN  28  14.330   6.850  10.180
   64    H    MET  29           H        MET  29  11.060   4.330   5.250
   65    H    MET  30           H        MET  30   8.470   3.600   6.100
   66    H    LYS  31           H        LYS  31   8.370   5.660   8.170
   67   1HZ   LYS  31           HZ2      LYS  31  10.960   4.220  10.860
   68   2HZ   LYS  31           HZ3      LYS  31  12.400   4.990  10.730
   69   3HZ   LYS  31           HZ1      LYS  31  12.170   3.850  11.880
   70    H    SER  32           H        SER  32   8.330   8.100   7.000
   71    HG   SER  32           HG       SER  32   7.960   8.610   4.080
   72    NH1  ARG  33           NH2      ARG  33   5.790  10.240   0.640
   73    NH2  ARG  33           NH1      ARG  33   5.950  11.820   2.270
   74    H    ARG  33           H        ARG  33   5.770   8.000   5.790
   75    HE   ARG  33           HE       ARG  33   4.230  10.480   3.430
   76   1HH1  ARG  33           HH2      ARG  33   5.370   9.410   0.290
   77   2HH1  ARG  33           HH2      ARG  33   6.470  10.730   0.100
   78   1HH2  ARG  33           HH1      ARG  33   5.660  12.200   3.150
   79   2HH2  ARG  33           HH1      ARG  33   6.640  12.290   1.720
   80    H    ASN  34           H        ASN  34   4.210   9.730   7.740
   81   1HD2  ASN  34           HD2      ASN  34  -1.290   9.930   7.850
   82   2HD2  ASN  34           HD2      ASN  34  -0.420   8.940   8.950
   83    H    LEU  35           H        LEU  35   2.980   6.870   8.190
   84    H    THR  36           H        THR  36   3.920   6.210  10.690
   85    HG1  THR  36           HG1      THR  36   6.550   6.570  12.580
   86    H    LYS  37           H        LYS  37   1.870   6.960  12.780
   87   1HZ   LYS  37           HZ1      LYS  37  -0.510  12.180  12.720
   88   2HZ   LYS  37           HZ2      LYS  37   0.180  13.600  13.110
   89   3HZ   LYS  37           HZ3      LYS  37   0.040  13.150  11.530
   90    H    ASP  38           H        ASP  38   1.340   6.680  15.500
   91    NH1  ARG  39           NH2      ARG  39  -1.430   5.930  15.500
   92    NH2  ARG  39           NH1      ARG  39   0.000   5.620  13.770
   93    H    ARG  39           H        ARG  39   0.940   4.690  16.660
   94    HE   ARG  39           HE       ARG  39   0.330   3.370  14.670
   95   1HH1  ARG  39           HH2      ARG  39  -2.010   5.530  16.200
   96   2HH1  ARG  39           HH2      ARG  39  -1.570   6.870  15.200
   97   1HH2  ARG  39           HH1      ARG  39   0.520   5.010  13.160
   98   2HH2  ARG  39           HH1      ARG  39  -0.220   6.550  13.470
   99    H    CYS  40           H        CYS  40   4.230   1.770  16.740
  100    H    LYS  41           H        LYS  41   3.310   1.570  12.360
  101   1HZ   LYS  41           HZ2      LYS  41  -1.100   2.120   7.570
  102   2HZ   LYS  41           HZ3      LYS  41  -2.360   1.080   7.420
  103   3HZ   LYS  41           HZ1      LYS  41  -2.520   2.430   8.320
  104    H    VAL  43           H        VAL  43   1.200  -3.480  10.210
  105    H    ASN  44           H        ASN  44   2.940  -3.560   6.370
  106   1HD2  ASN  44           HD2      ASN  44   1.630   1.640   3.650
  107   2HD2  ASN  44           HD2      ASN  44   2.940   1.030   4.600
  108    H    THR  45           H        THR  45   0.900  -1.690   3.100
  109    HG1  THR  45           HG1      THR  45   1.690  -4.720   2.200
  110    H    PHE  46           H        PHE  46   4.560  -1.180   0.780
  111    H    VAL  47           H        VAL  47   3.220   1.710  -2.260
  112    H    HIS  48           H        HIS  48   4.940   0.090  -5.780
  113    HD1  HIS  48           HD1      HIS  48   8.650   3.070  -5.070
  114    HE2  HIS  48           HE2      HIS  48   9.050  -0.050  -2.520
  115    H    GLU  49           H        GLU  49   3.540   2.720  -7.130
  116    H    SER  50           H        SER  50   3.300   5.110 -10.800
  117    HG   SER  50           HG       SER  50   2.030   5.470 -12.570
  118    H    LEU  51           H        LEU  51  -0.160   7.750  -9.000
  119    H    ALA  52           H        ALA  52  -1.740   7.720 -11.460
  120    H    ASP  53           H        ASP  53  -0.650   5.000 -12.560
  121    H    VAL  54           H        VAL  54  -1.840   3.370 -10.670
  122    H    GLN  55           H        GLN  55  -4.340   3.900 -10.800
  123   1HE2  GLN  55           HE2      GLN  55  -8.610   8.360 -11.150
  124   2HE2  GLN  55           HE2      GLN  55  -9.020   6.700 -10.820
  125    H    ALA  56           H        ALA  56  -4.800   2.420 -13.140
  126    H    VAL  57           H        VAL  57  -5.640   0.010 -11.830
  127    H    CYS  58           H        CYS  58  -7.960  -0.100 -11.280
  128    H    SER  59           H        SER  59  -9.260  -1.090 -13.570
  129    HG   SER  59           HG       SER  59 -12.260  -0.130 -14.160
  130    H    GLN  60           H        GLN  60  -9.490  -3.760 -13.520
  131   1HE2  GLN  60           HE2      GLN  60  -3.680  -3.280 -15.600
  132   2HE2  GLN  60           HE2      GLN  60  -5.210  -2.420 -15.610
  133    H    LYS  61           H        LYS  61  -9.020  -6.780 -12.950
  134   1HZ   LYS  61           HZ2      LYS  61 -10.250 -13.120 -11.720
  135   2HZ   LYS  61           HZ3      LYS  61 -10.930 -11.660 -11.400
  136   3HZ   LYS  61           HZ1      LYS  61 -11.880 -12.930 -11.810
  137    H    ASN  62           H        ASN  62 -13.070  -8.380 -12.550
  138   1HD2  ASN  62           HD2      ASN  62 -15.960  -6.680  -7.830
  139   2HD2  ASN  62           HD2      ASN  62 -14.720  -5.960  -8.810
  140    H    VAL  63           H        VAL  63 -13.130  -7.760  -8.060
  141    H    ALA  64           H        ALA  64 -12.980 -10.920  -5.050
  142    H    CYS  65           H        CYS  65 -14.100  -7.740  -2.080
  143    H    LYS  66           H        LYS  66 -10.530  -8.010   0.890
  144   1HZ   LYS  66           HZ1      LYS  66  -6.290  -6.630   4.970
  145   2HZ   LYS  66           HZ2      LYS  66  -6.500  -5.370   3.960
  146   3HZ   LYS  66           HZ3      LYS  66  -6.780  -5.200   5.570
  147    H    ASN  67           H        ASN  67 -12.790  -7.770   2.790
  148   1HD2  ASN  67           HD2      ASN  67 -15.330  -4.280   3.140
  149   2HD2  ASN  67           HD2      ASN  67 -15.350  -4.810   4.800
  150    H    GLY  68           H        GLY  68 -14.600  -9.220   1.700
  151    H    GLN  69           H        GLN  69 -15.870  -7.300   0.890
  152   1HE2  GLN  69           HE2      GLN  69 -20.130  -2.950  -1.870
  153   2HE2  GLN  69           HE2      GLN  69 -20.200  -3.280  -0.150
  154    H    THR  70           H        THR  70 -18.520  -5.920  -2.670
  155    HG1  THR  70           HG1      THR  70 -19.940  -5.220  -5.580
  156    H    ASN  71           H        ASN  71 -16.410  -4.500  -3.460
  157   1HD2  ASN  71           HD2      ASN  71 -14.890  -0.330  -2.080
  158   2HD2  ASN  71           HD2      ASN  71 -15.180   0.050  -3.770
  159    H    CYS  72           H        CYS  72 -14.120  -5.540  -5.720
  160    OH   TYR  73           OH       TYR  73 -15.590  -2.250  -9.420
  161    H    TYR  73           H        TYR  73 -10.020  -4.560  -6.570
  162    HH   TYR  73           HH       TYR  73 -15.570  -1.280  -9.120
  163    H    GLN  74           H        GLN  74  -9.070  -7.190  -9.870
  164   1HE2  GLN  74           HE2      GLN  74  -5.350 -12.600  -9.950
  165   2HE2  GLN  74           HE2      GLN  74  -4.950 -11.160 -10.840
  166    H    SER  75           H        SER  75  -4.720  -6.450 -10.220
  167    HG   SER  75           HG       SER  75  -1.530  -6.380 -11.630
  168    OH   TYR  76           OH       TYR  76  -9.720  -9.110 -17.120
  169    H    TYR  76           H        TYR  76  -4.420  -7.150 -14.780
  170    HH   TYR  76           HH       TYR  76 -10.060  -8.170 -16.990
  171    H    SER  77           H        SER  77  -1.860  -7.620 -14.190
  172    HG   SER  77           HG       SER  77   2.290  -9.080 -16.250
  173    H    THR  78           H        THR  78   2.350  -8.320 -13.540
  174    HG1  THR  78           HG1      THR  78   4.390  -7.080 -12.900
  175    H    MET  79           H        MET  79   2.580  -6.170  -9.530
  176    H    SER  80           H        SER  80   5.060  -2.520  -9.480
  177    HG   SER  80           HG       SER  80   8.980  -1.250  -7.680
  178    H    ILE  81           H        ILE  81   6.100  -4.610  -5.700
  179    H    THR  82           H        THR  82   5.540  -2.250  -2.090
  180    HG1  THR  82           HG1      THR  82   8.710  -2.550  -2.610
  181    H    ASP  83           H        ASP  83   7.020  -5.180   0.240
  182    H    CYS  84           H        CYS  84   5.070  -3.760   4.000
  183    NH1  ARG  85           NH2      ARG  85   3.170  -9.190  11.740
  184    NH2  ARG  85           NH1      ARG  85   4.840  -9.180  13.290
  185    H    ARG  85           H        ARG  85   7.820  -5.310   6.750
  186    HE   ARG  85           HE       ARG  85   6.250  -8.300  11.460
  187   1HH1  ARG  85           HH2      ARG  85   2.880  -9.020  10.800
  188   2HH1  ARG  85           HH2      ARG  85   2.540  -9.540  12.420
  189   1HH2  ARG  85           HH1      ARG  85   5.800  -9.050  13.540
  190   2HH2  ARG  85           HH1      ARG  85   4.190  -9.520  13.960
  191    H    GLU  86           H        GLU  86   5.880  -5.090  10.600
  192    H    THR  87           H        THR  87  10.080  -4.760  12.260
  193    HG1  THR  87           HG1      THR  87  12.740  -8.930  11.640
  194    H    GLY  88           H        GLY  88  12.280  -7.860  14.790
  195    H    SER  89           H        SER  89  11.070  -6.480  17.050
  196    HG   SER  89           HG       SER  89  12.840  -4.040  18.930
  197    H    SER  90           H        SER  90   9.110  -3.850  16.450
  198    HG   SER  90           HG       SER  90   6.750  -2.290  16.190
  199    H    LYS  91           H        LYS  91  10.400  -0.270  17.920
  200   1HZ   LYS  91           HZ2      LYS  91  12.840  -2.620  21.280
  201   2HZ   LYS  91           HZ3      LYS  91  12.340  -1.820  19.960
  202   3HZ   LYS  91           HZ1      LYS  91  13.900  -1.740  20.430
  203    OH   TYR  92           OH       TYR  92   4.600   9.890  18.220
  204    H    TYR  92           H        TYR  92   7.400   2.530  19.930
  205    HH   TYR  92           HH       TYR  92   3.990   9.830  17.410
  206    H    ASN  94           H        ASN  94  10.990   4.350  18.080
  207   1HD2  ASN  94           HD2      ASN  94  13.040   1.280  19.930
  208   2HD2  ASN  94           HD2      ASN  94  13.840   1.230  18.380
  209    H    CYS  95           H        CYS  95  10.580   3.780  14.630
  210    H    ALA  96           H        ALA  96  10.650  -0.630  14.330
  211    OH   TYR  97           OH       TYR  97   5.650   0.060  11.550
  212    H    TYR  97           H        TYR  97  12.310  -1.570  10.400
  213    HH   TYR  97           HH       TYR  97   4.850  -0.530  11.330
  214    H    LYS  98           H        LYS  98  10.200  -5.190   8.800
  215   1HZ   LYS  98           HZ3      LYS  98  15.650  -9.700   7.210
  216   2HZ   LYS  98           HZ1      LYS  98  15.750 -10.320   5.700
  217   3HZ   LYS  98           HZ2      LYS  98  15.820  -8.710   5.910
  218    H    THR  99           H        THR  99  12.750  -5.440   5.190
  219    HG1  THR  99           HG1      THR  99  12.770  -2.910   5.260
  220    H    THR 100           H        THR 100   9.510  -5.450   2.310
  221    HG1  THR 100           HG1      THR 100  10.130  -8.600   2.590
  222    H    GLN 101           H        GLN 101  11.790  -6.570  -1.170
  223   1HE2  GLN 101           HE2      GLN 101   8.800  -3.800  -6.130
  224   2HE2  GLN 101           HE2      GLN 101   9.810  -5.210  -6.270
  225    H    ALA 102           H        ALA 102   8.390  -6.010  -3.830
  226    H    ASN 103           H        ASN 103   8.190  -8.700  -7.230
  227   1HD2  ASN 103           HD2      ASN 103   8.310  -4.820 -10.820
  228   2HD2  ASN 103           HD2      ASN 103   7.140  -6.010 -11.360
  229    H    LYS 104           H        LYS 104   4.220  -7.280  -7.570
  230   1HZ   LYS 104           HZ2      LYS 104   5.060 -10.440  -2.760
  231   2HZ   LYS 104           HZ3      LYS 104   4.430 -11.670  -1.890
  232   3HZ   LYS 104           HZ1      LYS 104   5.920 -11.820  -2.540
  233    H    HIS 105           H        HIS 105   0.900 -10.150  -8.020
  234    HD1  HIS 105           HD1      HIS 105  -3.290 -10.370 -11.170
  235    HE2  HIS 105           HE2      HIS 105  -0.110 -12.200 -12.820
  236    H    ILE 106           H        ILE 106  -2.110  -6.750  -8.750
  237    H    ILE 107           H        ILE 107  -3.870  -6.300  -4.770
  238    H    VAL 108           H        VAL 108  -7.050  -3.970  -6.230
  239    H    ALA 109           H        ALA 109  -8.710  -1.380  -2.970
  240    H    CYS 110           H        CYS 110 -12.480  -0.870  -5.310
  241    H    GLU 111           H        GLU 111 -12.760   3.510  -6.190
  242    H    GLY 112           H        GLY 112 -16.550   5.520  -6.840
  243    H    ASN 113           H        ASN 113 -15.030   9.620  -7.780
  244   1HD2  ASN 113           HD2      ASN 113 -17.220  12.600 -12.390
  245   2HD2  ASN 113           HD2      ASN 113 -17.370  12.650 -10.640
  246    OH   TYR 115           OH       TYR 115 -15.650   0.220  -8.690
  247    H    TYR 115           H        TYR 115 -13.750   6.960 -11.820
  248    HH   TYR 115           HH       TYR 115 -16.310   0.570  -8.020
  249    H    VAL 116           H        VAL 116 -12.150   5.770  -8.060
  250    H    VAL 118           H        VAL 118  -9.740   2.550  -3.680
  251    H    HIS 119           H        HIS 119  -8.850   1.500  -2.100
  252    HD1  HIS 119           HD1      HIS 119  -8.190  -0.370   3.010
  253    HE2  HIS 119           HE2      HIS 119  -8.940  -4.110   1.690
  254    H    PHE 120           H        PHE 120  -5.820  -0.100   0.580
  255    H    ASP 121           H        ASP 121  -5.410  -3.940  -1.550
  256    H    ALA 122           H        ALA 122  -5.140  -6.360  -1.870
  257    H    SER 123           H        SER 123  -1.230  -8.230  -1.240
  258    HG   SER 123           HG       SER 123   1.230  -8.890  -1.750
  259    H    VAL 124           H        VAL 124  -1.020  -9.940  -5.290
   
  Start of MODEL          18
 Raw file had 259 H/Q atoms
  Start of MODEL   18
    1   1H    LYS   1           H2       LYS   1 -10.800  16.260   4.160
    2   2H    LYS   1           H3       LYS   1 -10.890  16.880   5.700
    3   3H    LYS   1           H1       LYS   1  -9.440  16.620   5.000
    4   1HZ   LYS   1           HZ3      LYS   1 -13.270  16.230   6.570
    5   2HZ   LYS   1           HZ1      LYS   1 -13.360  16.440   4.950
    6   3HZ   LYS   1           HZ2      LYS   1 -14.620  16.920   5.920
    7    H    GLU   2           H        GLU   2  -9.140  13.290   6.380
    8    H    THR   3           H        THR   3 -10.050  11.890   3.020
    9    HG1  THR   3           HG1      THR   3 -11.310  12.210   0.630
   10    H    ALA   4           H        ALA   4 -12.130   7.940   2.410
   11    H    ALA   5           H        ALA   5 -10.670   7.920  -0.570
   12    H    ALA   6           H        ALA   6  -8.500   9.540   0.200
   13    H    LYS   7           H        LYS   7  -7.380   8.030   2.190
   14   1HZ   LYS   7           HZ1      LYS   7 -10.000   6.090   7.520
   15   2HZ   LYS   7           HZ2      LYS   7 -11.320   6.260   6.570
   16   3HZ   LYS   7           HZ3      LYS   7 -10.250   5.040   6.290
   17    H    PHE   8           H        PHE   8  -6.510   5.560   0.830
   18    H    GLU   9           H        GLU   9  -4.470   6.980  -0.970
   19    NH1  ARG  10           NH2      ARG  10  -0.890   8.120   8.420
   20    NH2  ARG  10           NH1      ARG  10  -3.130   8.210   8.830
   21    H    ARG  10           H        ARG  10  -2.730   7.880   1.270
   22    HE   ARG  10           HE       ARG  10  -3.350   8.000   6.360
   23   1HH1  ARG  10           HH2      ARG  10  -0.150   8.140   7.760
   24   2HH1  ARG  10           HH2      ARG  10  -0.700   8.180   9.400
   25   1HH2  ARG  10           HH1      ARG  10  -4.070   8.260   8.510
   26   2HH2  ARG  10           HH1      ARG  10  -2.910   8.290   9.800
   27    H    GLN  11           H        GLN  11  -1.970   5.620   2.840
   28   1HE2  GLN  11           HE2      GLN  11  -3.450   0.360   5.320
   29   2HE2  GLN  11           HE2      GLN  11  -1.820   0.970   5.160
   30    H    HIS  12           H        HIS  12  -0.800   4.300   0.630
   31    HD1  HIS  12           HD1      HIS  12  -0.020  -0.010   0.670
   32    HE2  HIS  12           HE2      HIS  12  -3.500   0.680   2.500
   33    H    MET  13           H        MET  13   0.380   5.370  -1.270
   34    H    ASP  14           H        ASP  14   3.710   4.720  -4.230
   35    H    SER  15           H        SER  15   4.430   7.260  -4.960
   36    HG   SER  15           HG       SER  15   2.950   6.730  -7.180
   37    H    SER  16           H        SER  16   6.970   8.660  -5.430
   38    HG   SER  16           HG       SER  16   9.450   9.210  -3.480
   39    H    THR  17           H        THR  17   8.800   6.560  -5.460
   40    HG1  THR  17           HG1      THR  17  10.080   4.690  -2.840
   41    H    SER  18           H        SER  18  11.690   4.350  -7.870
   42    HG   SER  18           HG       SER  18  10.370   0.970  -9.980
   43    H    ALA  19           H        ALA  19  11.670   2.120  -6.170
   44    H    ALA  20           H        ALA  20  11.360  -1.280  -3.670
   45    H    SER  21           H        SER  21  14.700   0.990  -2.370
   46    HG   SER  21           HG       SER  21  16.920   3.070  -1.580
   47    H    SER  22           H        SER  22  15.870  -0.720  -0.360
   48    HG   SER  22           HG       SER  22  17.280   1.180   1.820
   49    H    SER  23           H        SER  23  18.140  -3.530   2.010
   50    HG   SER  23           HG       SER  23  18.510  -3.880   5.320
   51    H    ASN  24           H        ASN  24  16.730  -1.660   3.770
   52   1HD2  ASN  24           HD2      ASN  24  16.210  -3.340   8.610
   53   2HD2  ASN  24           HD2      ASN  24  15.140  -2.020   8.230
   54    OH   TYR  25           OH       TYR  25   9.740   3.960  -1.320
   55    H    TYR  25           H        TYR  25  14.690  -0.730   2.950
   56    HH   TYR  25           HH       TYR  25   8.800   3.590  -1.210
   57    H    CYS  26           H        CYS  26  11.830  -0.420   3.700
   58    H    ASN  27           H        ASN  27  12.500   0.850   6.440
   59   1HD2  ASN  27           HD2      ASN  27  14.200   0.090  11.100
   60   2HD2  ASN  27           HD2      ASN  27  13.800   1.760  10.920
   61    H    GLN  28           H        GLN  28  12.980   3.780   6.470
   62   1HE2  GLN  28           HE2      GLN  28  12.910   9.630   4.080
   63   2HE2  GLN  28           HE2      GLN  28  12.280   9.220   5.660
   64    H    MET  29           H        MET  29  11.050   4.430   4.880
   65    H    MET  30           H        MET  30   8.510   3.610   5.890
   66    H    LYS  31           H        LYS  31   8.490   5.730   7.860
   67   1HZ   LYS  31           HZ3      LYS  31  11.800   7.240  13.210
   68   2HZ   LYS  31           HZ1      LYS  31  10.250   6.860  13.540
   69   3HZ   LYS  31           HZ2      LYS  31  11.450   5.930  14.140
   70    H    SER  32           H        SER  32   8.440   8.140   6.560
   71    HG   SER  32           HG       SER  32   7.890   8.920   3.450
   72    NH1  ARG  33           NH2      ARG  33   5.400  10.570   0.980
   73    NH2  ARG  33           NH1      ARG  33   5.640   9.240  -0.860
   74    H    ARG  33           H        ARG  33   5.960   8.110   5.280
   75    HE   ARG  33           HE       ARG  33   4.360   7.580   0.400
   76   1HH1  ARG  33           HH2      ARG  33   5.030  10.710   1.900
   77   2HH1  ARG  33           HH2      ARG  33   5.920  11.300   0.540
   78   1HH2  ARG  33           HH1      ARG  33   5.420   8.390  -1.340
   79   2HH2  ARG  33           HH1      ARG  33   6.180   9.950  -1.300
   80    H    ASN  34           H        ASN  34   4.640   9.360   7.640
   81   1HD2  ASN  34           HD2      ASN  34   3.400  13.210   7.440
   82   2HD2  ASN  34           HD2      ASN  34   2.520  11.860   6.760
   83    H    LEU  35           H        LEU  35   3.080   6.930   8.120
   84    H    THR  36           H        THR  36   4.000   6.410  10.740
   85    HG1  THR  36           HG1      THR  36   6.720   6.600  12.440
   86    H    LYS  37           H        LYS  37   2.480   7.580  12.680
   87   1HZ   LYS  37           HZ1      LYS  37  -2.220  11.560  12.040
   88   2HZ   LYS  37           HZ2      LYS  37  -1.850  10.620  10.750
   89   3HZ   LYS  37           HZ3      LYS  37  -3.230  10.350  11.620
   90    H    ASP  38           H        ASP  38   2.070   6.800  15.490
   91    NH1  ARG  39           NH2      ARG  39  -1.830   2.600  20.830
   92    NH2  ARG  39           NH1      ARG  39  -0.160   3.680  21.980
   93    H    ARG  39           H        ARG  39   1.410   4.910  16.490
   94    HE   ARG  39           HE       ARG  39   1.230   2.880  20.090
   95   1HH1  ARG  39           HH2      ARG  39  -2.040   2.060  20.010
   96   2HH1  ARG  39           HH2      ARG  39  -2.510   2.810  21.520
   97   1HH2  ARG  39           HH1      ARG  39   0.780   3.980  22.060
   98   2HH2  ARG  39           HH1      ARG  39  -0.830   3.900  22.690
   99    H    CYS  40           H        CYS  40   4.500   1.850  16.750
  100    H    LYS  41           H        LYS  41   3.390   1.550  12.450
  101   1HZ   LYS  41           HZ3      LYS  41  -2.240   1.380   9.430
  102   2HZ   LYS  41           HZ1      LYS  41  -2.930   0.030   8.800
  103   3HZ   LYS  41           HZ2      LYS  41  -1.950  -0.100  10.090
  104    H    VAL  43           H        VAL  43   1.190  -3.520  10.010
  105    H    ASN  44           H        ASN  44   3.120  -3.570   6.320
  106   1HD2  ASN  44           HD2      ASN  44   2.040   1.600   3.580
  107   2HD2  ASN  44           HD2      ASN  44   3.370   0.670   4.200
  108    H    THR  45           H        THR  45   0.960  -1.670   3.090
  109    HG1  THR  45           HG1      THR  45   1.510  -5.370   1.480
  110    H    PHE  46           H        PHE  46   4.520  -1.220   0.810
  111    H    VAL  47           H        VAL  47   3.080   1.610  -2.250
  112    H    HIS  48           H        HIS  48   4.980   0.210  -5.710
  113    HD1  HIS  48           HD1      HIS  48   8.600   3.310  -4.750
  114    HE2  HIS  48           HE2      HIS  48   9.200  -0.060  -2.570
  115    H    GLU  49           H        GLU  49   3.610   3.010  -7.060
  116    H    SER  50           H        SER  50   2.910   5.060 -10.890
  117    HG   SER  50           HG       SER  50   1.770   5.650 -12.610
  118    H    LEU  51           H        LEU  51  -0.220   7.980  -8.910
  119    H    ALA  52           H        ALA  52  -1.810   7.930 -11.340
  120    H    ASP  53           H        ASP  53  -0.840   5.260 -12.380
  121    H    VAL  54           H        VAL  54  -2.140   3.660 -10.530
  122    H    GLN  55           H        GLN  55  -4.590   4.140 -10.650
  123   1HE2  GLN  55           HE2      GLN  55  -8.830   8.520 -10.510
  124   2HE2  GLN  55           HE2      GLN  55  -9.210   6.830 -10.350
  125    H    ALA  56           H        ALA  56  -4.990   2.700 -13.000
  126    H    VAL  57           H        VAL  57  -5.760   0.200 -11.680
  127    H    CYS  58           H        CYS  58  -8.040  -0.020 -11.190
  128    H    SER  59           H        SER  59  -9.250  -1.030 -13.390
  129    HG   SER  59           HG       SER  59 -12.470  -0.910 -15.500
  130    H    GLN  60           H        GLN  60  -9.530  -3.610 -13.510
  131   1HE2  GLN  60           HE2      GLN  60  -3.900  -2.920 -15.320
  132   2HE2  GLN  60           HE2      GLN  60  -5.470  -2.150 -15.410
  133    H    LYS  61           H        LYS  61  -8.820  -6.650 -13.060
  134   1HZ   LYS  61           HZ2      LYS  61  -7.430 -13.440 -11.120
  135   2HZ   LYS  61           HZ3      LYS  61  -8.280 -14.710 -11.720
  136   3HZ   LYS  61           HZ1      LYS  61  -7.290 -13.850 -12.700
  137    H    ASN  62           H        ASN  62 -12.760  -8.390 -12.660
  138   1HD2  ASN  62           HD2      ASN  62 -15.830  -6.760  -7.960
  139   2HD2  ASN  62           HD2      ASN  62 -14.350  -6.230  -8.700
  140    H    VAL  63           H        VAL  63 -12.910  -7.920  -8.120
  141    H    ALA  64           H        ALA  64 -12.700 -11.190  -5.190
  142    H    CYS  65           H        CYS  65 -14.100  -8.180  -2.220
  143    H    LYS  66           H        LYS  66 -10.700  -7.970   0.890
  144   1HZ   LYS  66           HZ3      LYS  66  -6.970  -8.730   5.610
  145   2HZ   LYS  66           HZ1      LYS  66  -6.840 -10.240   5.010
  146   3HZ   LYS  66           HZ2      LYS  66  -5.480  -9.350   5.300
  147    H    ASN  67           H        ASN  67 -13.130  -8.020   2.810
  148   1HD2  ASN  67           HD2      ASN  67 -15.870  -4.800   3.350
  149   2HD2  ASN  67           HD2      ASN  67 -15.930  -5.530   4.920
  150    H    GLY  68           H        GLY  68 -14.620  -9.740   1.490
  151    H    GLN  69           H        GLN  69 -16.060  -7.700   0.790
  152   1HE2  GLN  69           HE2      GLN  69 -20.610  -5.290  -2.650
  153   2HE2  GLN  69           HE2      GLN  69 -20.610  -5.920  -1.020
  154    H    THR  70           H        THR  70 -18.600  -6.550  -2.930
  155    HG1  THR  70           HG1      THR  70 -19.650  -5.650  -5.760
  156    H    ASN  71           H        ASN  71 -16.290  -5.000  -3.600
  157   1HD2  ASN  71           HD2      ASN  71 -14.820  -0.920  -2.080
  158   2HD2  ASN  71           HD2      ASN  71 -15.170  -0.440  -3.730
  159    H    CYS  72           H        CYS  72 -14.010  -5.870  -5.770
  160    OH   TYR  73           OH       TYR  73 -15.540  -2.350  -9.510
  161    H    TYR  73           H        TYR  73  -9.900  -4.740  -6.590
  162    HH   TYR  73           HH       TYR  73 -16.100  -2.980 -10.060
  163    H    GLN  74           H        GLN  74  -8.930  -7.250  -9.930
  164   1HE2  GLN  74           HE2      GLN  74  -4.740 -12.370 -10.540
  165   2HE2  GLN  74           HE2      GLN  74  -4.550 -10.790 -11.260
  166    H    SER  75           H        SER  75  -4.560  -6.350 -10.280
  167    HG   SER  75           HG       SER  75  -1.380  -6.030 -11.770
  168    OH   TYR  76           OH       TYR  76  -9.660  -9.290 -16.940
  169    H    TYR  76           H        TYR  76  -4.420  -6.790 -14.880
  170    HH   TYR  76           HH       TYR  76 -10.090  -8.390 -16.980
  171    H    SER  77           H        SER  77  -1.760  -7.140 -14.430
  172    HG   SER  77           HG       SER  77   2.460  -8.140 -16.690
  173    H    THR  78           H        THR  78   2.530  -7.690 -13.830
  174    HG1  THR  78           HG1      THR  78   4.760  -6.520 -12.860
  175    H    MET  79           H        MET  79   2.730  -5.870  -9.610
  176    H    SER  80           H        SER  80   5.140  -2.160  -9.470
  177    HG   SER  80           HG       SER  80   8.980  -0.990  -7.430
  178    H    ILE  81           H        ILE  81   6.150  -4.440  -5.760
  179    H    THR  82           H        THR  82   5.510  -2.230  -2.070
  180    HG1  THR  82           HG1      THR  82   8.700  -2.530  -2.640
  181    H    ASP  83           H        ASP  83   7.050  -5.160   0.230
  182    H    CYS  84           H        CYS  84   5.180  -3.660   3.980
  183    NH1  ARG  85           NH2      ARG  85   6.740 -10.030  11.520
  184    NH2  ARG  85           NH1      ARG  85   4.860 -11.320  11.420
  185    H    ARG  85           H        ARG  85   7.960  -5.080   6.730
  186    HE   ARG  85           HE       ARG  85   4.760 -10.660   9.070
  187   1HH1  ARG  85           HH2      ARG  85   7.320  -9.320  11.110
  188   2HH1  ARG  85           HH2      ARG  85   6.870 -10.280  12.480
  189   1HH2  ARG  85           HH1      ARG  85   4.080 -11.670  10.920
  190   2HH2  ARG  85           HH1      ARG  85   4.980 -11.530  12.390
  191    H    GLU  86           H        GLU  86   5.930  -5.070  10.680
  192    H    THR  87           H        THR  87  10.130  -4.510  12.350
  193    HG1  THR  87           HG1      THR  87  13.430  -7.960  11.650
  194    H    GLY  88           H        GLY  88  12.630  -7.660  14.530
  195    H    SER  89           H        SER  89  13.670  -5.220  15.790
  196    HG   SER  89           HG       SER  89  14.980  -1.650  17.600
  197    H    SER  90           H        SER  90  11.180  -3.720  16.910
  198    HG   SER  90           HG       SER  90   7.910  -1.350  15.290
  199    H    LYS  91           H        LYS  91  10.860   0.360  17.730
  200   1HZ   LYS  91           HZ1      LYS  91   8.880   3.690  23.380
  201   2HZ   LYS  91           HZ2      LYS  91   8.510   3.280  24.920
  202   3HZ   LYS  91           HZ3      LYS  91  10.070   3.240  24.390
  203    OH   TYR  92           OH       TYR  92   5.100   9.670  18.390
  204    H    TYR  92           H        TYR  92   7.490   2.080  19.400
  205    HH   TYR  92           HH       TYR  92   4.460   9.710  17.610
  206    H    ASN  94           H        ASN  94  11.440   4.290  18.410
  207   1HD2  ASN  94           HD2      ASN  94  13.860   1.510  19.740
  208   2HD2  ASN  94           HD2      ASN  94  13.870   1.230  18.020
  209    H    CYS  95           H        CYS  95  10.490   3.860  14.890
  210    H    ALA  96           H        ALA  96  10.520  -0.570  13.940
  211    OH   TYR  97           OH       TYR  97   5.790   0.080  11.620
  212    H    TYR  97           H        TYR  97  12.480  -1.260  10.090
  213    HH   TYR  97           HH       TYR  97   5.000  -0.530  11.410
  214    H    LYS  98           H        LYS  98  10.310  -4.820   8.780
  215   1HZ   LYS  98           HZ1      LYS  98  10.270 -11.620   9.270
  216   2HZ   LYS  98           HZ2      LYS  98  10.570 -11.110  10.780
  217   3HZ   LYS  98           HZ3      LYS  98   9.430 -10.370   9.880
  218    H    THR  99           H        THR  99  12.870  -5.140   5.310
  219    HG1  THR  99           HG1      THR  99  12.910  -2.870   5.170
  220    H    THR 100           H        THR 100   9.630  -5.400   2.310
  221    HG1  THR 100           HG1      THR 100  10.580  -8.520   2.400
  222    H    GLN 101           H        GLN 101  11.840  -6.440  -1.270
  223   1HE2  GLN 101           HE2      GLN 101   8.850  -3.550  -6.220
  224   2HE2  GLN 101           HE2      GLN 101   9.660  -5.070  -6.190
  225    H    ALA 102           H        ALA 102   8.340  -5.910  -3.810
  226    H    ASN 103           H        ASN 103   8.180  -8.590  -7.260
  227   1HD2  ASN 103           HD2      ASN 103   9.260  -4.780 -10.680
  228   2HD2  ASN 103           HD2      ASN 103   8.300  -5.990 -11.500
  229    H    LYS 104           H        LYS 104   4.330  -7.240  -7.700
  230   1HZ   LYS 104           HZ1      LYS 104   5.120 -13.400  -6.520
  231   2HZ   LYS 104           HZ2      LYS 104   5.660 -14.000  -5.080
  232   3HZ   LYS 104           HZ3      LYS 104   4.080 -13.550  -5.270
  233    H    HIS 105           H        HIS 105   1.040 -10.120  -8.410
  234    HD1  HIS 105           HD1      HIS 105  -3.060 -10.500 -11.420
  235    HE2  HIS 105           HE2      HIS 105   0.280 -11.730 -13.290
  236    H    ILE 106           H        ILE 106  -1.960  -6.650  -8.950
  237    H    ILE 107           H        ILE 107  -3.800  -6.410  -4.980
  238    H    VAL 108           H        VAL 108  -7.010  -4.010  -6.390
  239    H    ALA 109           H        ALA 109  -8.660  -1.700  -2.920
  240    H    CYS 110           H        CYS 110 -12.430  -1.150  -5.220
  241    H    GLU 111           H        GLU 111 -12.920   3.260  -6.000
  242    H    GLY 112           H        GLY 112 -16.830   5.080  -6.730
  243    H    ASN 113           H        ASN 113 -15.780   9.250  -7.840
  244   1HD2  ASN 113           HD2      ASN 113 -18.220  11.830 -12.630
  245   2HD2  ASN 113           HD2      ASN 113 -18.630  11.710 -10.940
  246    OH   TYR 115           OH       TYR 115 -16.290   0.120  -8.920
  247    H    TYR 115           H        TYR 115 -13.510   6.660 -11.970
  248    HH   TYR 115           HH       TYR 115 -15.830  -0.770  -9.100
  249    H    VAL 116           H        VAL 116 -12.330   5.440  -8.010
  250    H    VAL 118           H        VAL 118  -9.620   2.240  -3.490
  251    H    HIS 119           H        HIS 119  -8.750   1.290  -2.000
  252    HD1  HIS 119           HD1      HIS 119  -8.110  -0.710   3.130
  253    HE2  HIS 119           HE2      HIS 119  -8.620  -4.440   1.660
  254    H    PHE 120           H        PHE 120  -5.800  -0.330   0.610
  255    H    ASP 121           H        ASP 121  -5.320  -4.090  -1.680
  256    H    ALA 122           H        ALA 122  -4.930  -6.530  -2.130
  257    H    SER 123           H        SER 123  -1.060  -8.380  -1.590
  258    HG   SER 123           HG       SER 123   0.550  -6.580  -4.500
  259    H    VAL 124           H        VAL 124  -1.030 -10.020  -5.750
   
  Start of MODEL          19
 Raw file had 259 H/Q atoms
  Start of MODEL   19
    1   1H    LYS   1           H3       LYS   1  -9.030  17.100   4.970
    2   2H    LYS   1           H1       LYS   1 -10.370  17.220   4.030
    3   3H    LYS   1           H2       LYS   1 -10.450  17.650   5.620
    4   1HZ   LYS   1           HZ3      LYS   1 -14.450  13.950   7.610
    5   2HZ   LYS   1           HZ1      LYS   1 -13.490  12.850   6.920
    6   3HZ   LYS   1           HZ2      LYS   1 -14.160  12.510   8.380
    7    H    GLU   2           H        GLU   2  -9.430  13.730   6.130
    8    H    THR   3           H        THR   3  -9.960  12.130   2.360
    9    HG1  THR   3           HG1      THR   3 -11.000  11.900  -0.510
   10    H    ALA   4           H        ALA   4 -12.300   8.270   1.850
   11    H    ALA   5           H        ALA   5 -10.670   8.080  -0.730
   12    H    ALA   6           H        ALA   6  -8.410   9.510   0.110
   13    H    LYS   7           H        LYS   7  -7.400   8.000   2.040
   14   1HZ   LYS   7           HZ2      LYS   7  -6.650   2.730   4.250
   15   2HZ   LYS   7           HZ3      LYS   7  -7.290   1.480   5.100
   16   3HZ   LYS   7           HZ1      LYS   7  -8.230   2.360   4.080
   17    H    PHE   8           H        PHE   8  -6.580   5.490   0.720
   18    H    GLU   9           H        GLU   9  -4.510   6.960  -0.990
   19    NH1  ARG  10           NH2      ARG  10  -3.170   9.280   8.180
   20    NH2  ARG  10           NH1      ARG  10  -4.490   7.490   7.720
   21    H    ARG  10           H        ARG  10  -2.750   7.920   1.240
   22    HE   ARG  10           HE       ARG  10  -3.120   7.370   5.690
   23   1HH1  ARG  10           HH2      ARG  10  -2.380   9.830   7.900
   24   2HH1  ARG  10           HH2      ARG  10  -3.520   9.320   9.110
   25   1HH2  ARG  10           HH1      ARG  10  -4.640   6.660   7.190
   26   2HH2  ARG  10           HH1      ARG  10  -4.930   7.610   8.610
   27    H    GLN  11           H        GLN  11  -1.990   5.580   2.650
   28   1HE2  GLN  11           HE2      GLN  11  -3.560   0.170   4.950
   29   2HE2  GLN  11           HE2      GLN  11  -1.910   0.730   4.850
   30    H    HIS  12           H        HIS  12  -0.680   4.380   0.440
   31    HD1  HIS  12           HD1      HIS  12   0.160   0.040   0.370
   32    HE2  HIS  12           HE2      HIS  12  -3.330   0.740   2.130
   33    H    MET  13           H        MET  13   0.610   5.540  -1.350
   34    H    ASP  14           H        ASP  14   3.840   4.790  -4.410
   35    H    SER  15           H        SER  15   4.690   7.010  -5.420
   36    HG   SER  15           HG       SER  15   6.110   7.640  -9.350
   37    H    SER  16           H        SER  16   7.220   8.620  -5.570
   38    HG   SER  16           HG       SER  16   9.440   8.780  -3.320
   39    H    THR  17           H        THR  17   9.120   6.530  -5.450
   40    HG1  THR  17           HG1      THR  17  10.400   4.520  -2.800
   41    H    SER  18           H        SER  18  12.030   4.280  -7.730
   42    HG   SER  18           HG       SER  18  10.650   0.970  -9.990
   43    H    ALA  19           H        ALA  19  11.880   2.120  -6.060
   44    H    ALA  20           H        ALA  20  11.450  -1.200  -3.470
   45    H    SER  21           H        SER  21  14.920   1.000  -2.220
   46    HG   SER  21           HG       SER  21  17.660   2.740  -1.680
   47    H    SER  22           H        SER  22  15.700  -1.000  -0.300
   48    HG   SER  22           HG       SER  22  18.900  -0.160   3.360
   49    H    SER  23           H        SER  23  17.920  -3.500   2.270
   50    HG   SER  23           HG       SER  23  18.310  -4.240   5.560
   51    H    ASN  24           H        ASN  24  16.750  -1.840   4.220
   52   1HD2  ASN  24           HD2      ASN  24  15.720  -3.470   8.910
   53   2HD2  ASN  24           HD2      ASN  24  14.720  -2.200   8.280
   54    OH   TYR  25           OH       TYR  25   9.910   3.940  -1.180
   55    H    TYR  25           H        TYR  25  14.520  -0.880   3.290
   56    HH   TYR  25           HH       TYR  25   8.940   3.730  -0.960
   57    H    CYS  26           H        CYS  26  11.730  -0.450   4.090
   58    H    ASN  27           H        ASN  27  12.140   0.720   6.720
   59   1HD2  ASN  27           HD2      ASN  27  14.950  -0.710  10.000
   60   2HD2  ASN  27           HD2      ASN  27  14.780   0.970  10.400
   61    H    GLN  28           H        GLN  28  12.920   3.800   7.110
   62   1HE2  GLN  28           HE2      GLN  28  13.830   7.270  10.270
   63   2HE2  GLN  28           HE2      GLN  28  12.690   7.900   9.100
   64    H    MET  29           H        MET  29  11.000   4.470   5.250
   65    H    MET  30           H        MET  30   8.460   3.810   6.020
   66    H    LYS  31           H        LYS  31   8.250   5.830   8.090
   67   1HZ   LYS  31           HZ3      LYS  31   9.400   7.310  13.430
   68   2HZ   LYS  31           HZ1      LYS  31   8.830   5.790  13.290
   69   3HZ   LYS  31           HZ2      LYS  31  10.000   6.140  14.410
   70    H    SER  32           H        SER  32   8.210   8.200   6.660
   71    HG   SER  32           HG       SER  32   7.340  11.560   4.260
   72    NH1  ARG  33           NH2      ARG  33   6.490   9.930   0.840
   73    NH2  ARG  33           NH1      ARG  33   5.690   8.890  -1.030
   74    H    ARG  33           H        ARG  33   5.620   8.220   5.430
   75    HE   ARG  33           HE       ARG  33   4.630   7.320   0.540
   76   1HH1  ARG  33           HH2      ARG  33   6.570   9.990   1.830
   77   2HH1  ARG  33           HH2      ARG  33   6.940  10.600   0.250
   78   1HH2  ARG  33           HH1      ARG  33   5.050   8.260  -1.460
   79   2HH2  ARG  33           HH1      ARG  33   6.190   9.550  -1.590
   80    H    ASN  34           H        ASN  34   4.320   9.680   7.690
   81   1HD2  ASN  34           HD2      ASN  34   2.980  13.260   7.280
   82   2HD2  ASN  34           HD2      ASN  34   2.180  11.820   6.710
   83    H    LEU  35           H        LEU  35   3.080   7.120   8.100
   84    H    THR  36           H        THR  36   3.990   6.480  10.420
   85    HG1  THR  36           HG1      THR  36   5.890   7.270  12.250
   86    H    LYS  37           H        LYS  37   2.260   5.990  14.220
   87   1HZ   LYS  37           HZ1      LYS  37  -0.120  12.480  13.310
   88   2HZ   LYS  37           HZ2      LYS  37   0.490  13.960  13.610
   89   3HZ   LYS  37           HZ3      LYS  37   1.190  13.000  12.490
   90    H    ASP  38           H        ASP  38   3.270   7.990  16.620
   91    NH1  ARG  39           NH2      ARG  39  -0.620   0.630  20.580
   92    NH2  ARG  39           NH1      ARG  39  -0.330   2.360  22.040
   93    H    ARG  39           H        ARG  39   1.820   5.410  16.970
   94    HE   ARG  39           HE       ARG  39   0.050   3.650  19.960
   95   1HH1  ARG  39           HH2      ARG  39  -0.530   0.320  19.640
   96   2HH1  ARG  39           HH2      ARG  39  -0.760  -0.020  21.330
   97   1HH2  ARG  39           HH1      ARG  39  -0.040   3.300  22.190
   98   2HH2  ARG  39           HH1      ARG  39  -0.450   1.730  22.800
   99    H    CYS  40           H        CYS  40   4.470   1.930  16.890
  100    H    LYS  41           H        LYS  41   3.650   1.660  12.390
  101   1HZ   LYS  41           HZ3      LYS  41  -0.710   2.280   7.510
  102   2HZ   LYS  41           HZ1      LYS  41  -1.410   1.100   6.610
  103   3HZ   LYS  41           HZ2      LYS  41  -2.300   1.910   7.710
  104    H    VAL  43           H        VAL  43   0.900  -3.190  10.170
  105    H    ASN  44           H        ASN  44   2.910  -3.410   6.490
  106   1HD2  ASN  44           HD2      ASN  44   2.010   1.620   3.380
  107   2HD2  ASN  44           HD2      ASN  44   3.240   1.080   4.480
  108    H    THR  45           H        THR  45   0.990  -1.600   3.030
  109    HG1  THR  45           HG1      THR  45   1.780  -5.110   1.330
  110    H    PHE  46           H        PHE  46   4.600  -1.210   0.740
  111    H    VAL  47           H        VAL  47   3.220   1.740  -2.300
  112    H    HIS  48           H        HIS  48   5.080   0.310  -5.620
  113    HD1  HIS  48           HD1      HIS  48   8.780   3.260  -4.770
  114    HE2  HIS  48           HE2      HIS  48   9.140  -0.060  -2.490
  115    H    GLU  49           H        GLU  49   3.540   2.870  -6.990
  116    H    SER  50           H        SER  50   3.330   5.480 -10.580
  117    HG   SER  50           HG       SER  50   1.580   5.290 -12.220
  118    H    LEU  51           H        LEU  51  -0.260   7.930  -8.800
  119    H    ALA  52           H        ALA  52  -1.980   8.020 -11.210
  120    H    ASP  53           H        ASP  53  -0.900   5.490 -12.680
  121    H    VAL  54           H        VAL  54  -2.080   3.730 -10.720
  122    H    GLN  55           H        GLN  55  -4.510   4.080 -10.660
  123   1HE2  GLN  55           HE2      GLN  55  -8.250   8.730 -10.960
  124   2HE2  GLN  55           HE2      GLN  55  -8.830   7.160 -10.490
  125    H    ALA  56           H        ALA  56  -5.090   2.710 -13.070
  126    H    VAL  57           H        VAL  57  -5.780   0.140 -11.750
  127    H    CYS  58           H        CYS  58  -8.070  -0.090 -11.070
  128    H    SER  59           H        SER  59  -9.380  -1.000 -13.380
  129    HG   SER  59           HG       SER  59  -9.160  -0.830 -16.300
  130    H    GLN  60           H        GLN  60  -9.510  -3.640 -13.480
  131   1HE2  GLN  60           HE2      GLN  60  -3.880  -2.840 -15.690
  132   2HE2  GLN  60           HE2      GLN  60  -5.470  -2.110 -15.650
  133    H    LYS  61           H        LYS  61  -8.900  -6.600 -12.990
  134   1HZ   LYS  61           HZ2      LYS  61  -8.460 -13.150 -14.350
  135   2HZ   LYS  61           HZ3      LYS  61  -9.650 -14.230 -14.010
  136   3HZ   LYS  61           HZ1      LYS  61 -10.000 -12.660 -14.320
  137    H    ASN  62           H        ASN  62 -12.850  -8.410 -12.620
  138   1HD2  ASN  62           HD2      ASN  62 -15.690  -7.020  -7.730
  139   2HD2  ASN  62           HD2      ASN  62 -14.290  -6.410  -8.560
  140    H    VAL  63           H        VAL  63 -12.820  -7.960  -8.100
  141    H    ALA  64           H        ALA  64 -12.670 -11.240  -5.190
  142    H    CYS  65           H        CYS  65 -13.870  -8.240  -2.080
  143    H    LYS  66           H        LYS  66 -10.220  -8.320   0.710
  144   1HZ   LYS  66           HZ3      LYS  66  -6.600 -10.800  -0.100
  145   2HZ   LYS  66           HZ1      LYS  66  -5.870 -12.160   0.500
  146   3HZ   LYS  66           HZ2      LYS  66  -7.500 -12.040   0.470
  147    H    ASN  67           H        ASN  67 -12.570  -8.260   2.690
  148   1HD2  ASN  67           HD2      ASN  67 -15.400  -4.980   3.160
  149   2HD2  ASN  67           HD2      ASN  67 -15.210  -5.550   4.790
  150    H    GLY  68           H        GLY  68 -14.250  -9.850   1.630
  151    H    GLN  69           H        GLN  69 -15.700  -7.810   0.940
  152   1HE2  GLN  69           HE2      GLN  69 -16.530  -1.740   0.870
  153   2HE2  GLN  69           HE2      GLN  69 -16.390  -2.570  -0.680
  154    H    THR  70           H        THR  70 -18.440  -6.630  -2.580
  155    HG1  THR  70           HG1      THR  70 -19.690  -6.200  -5.760
  156    H    ASN  71           H        ASN  71 -16.120  -5.120  -3.400
  157   1HD2  ASN  71           HD2      ASN  71 -15.270  -0.810  -2.290
  158   2HD2  ASN  71           HD2      ASN  71 -15.310  -0.560  -4.010
  159    H    CYS  72           H        CYS  72 -13.910  -5.960  -5.700
  160    OH   TYR  73           OH       TYR  73 -15.520  -2.430  -9.500
  161    H    TYR  73           H        TYR  73  -9.840  -4.800  -6.600
  162    HH   TYR  73           HH       TYR  73 -16.030  -2.950 -10.190
  163    H    GLN  74           H        GLN  74  -8.910  -7.350  -9.930
  164   1HE2  GLN  74           HE2      GLN  74  -4.940 -12.510 -10.790
  165   2HE2  GLN  74           HE2      GLN  74  -4.910 -10.950 -11.570
  166    H    SER  75           H        SER  75  -4.560  -6.420 -10.300
  167    HG   SER  75           HG       SER  75  -1.400  -6.250 -11.950
  168    OH   TYR  76           OH       TYR  76  -9.590  -9.290 -16.760
  169    H    TYR  76           H        TYR  76  -4.190  -6.750 -14.910
  170    HH   TYR  76           HH       TYR  76 -10.000  -8.360 -16.760
  171    H    SER  77           H        SER  77  -1.640  -7.120 -14.450
  172    HG   SER  77           HG       SER  77   0.180  -5.990 -17.000
  173    H    THR  78           H        THR  78   2.720  -7.540 -13.980
  174    HG1  THR  78           HG1      THR  78   5.030  -6.370 -12.930
  175    H    MET  79           H        MET  79   2.840  -5.750  -9.820
  176    H    SER  80           H        SER  80   5.360  -2.090  -9.480
  177    HG   SER  80           HG       SER  80   9.330  -1.208  -7.605
  178    H    ILE  81           H        ILE  81   6.060  -4.450  -5.850
  179    H    THR  82           H        THR  82   5.580  -2.150  -2.180
  180    HG1  THR  82           HG1      THR  82   8.640  -2.500  -2.780
  181    H    ASP  83           H        ASP  83   6.980  -5.100   0.130
  182    H    CYS  84           H        CYS  84   5.040  -3.740   3.970
  183    NH1  ARG  85           NH2      ARG  85   4.640  -8.240  12.620
  184    NH2  ARG  85           NH1      ARG  85   2.940  -9.670  12.110
  185    H    ARG  85           H        ARG  85   7.670  -5.320   6.700
  186    HE   ARG  85           HE       ARG  85   3.960  -9.770   9.890
  187   1HH1  ARG  85           HH2      ARG  85   5.510  -7.820  12.360
  188   2HH1  ARG  85           HH2      ARG  85   4.280  -8.130  13.550
  189   1HH2  ARG  85           HH1      ARG  85   2.510 -10.320  11.480
  190   2HH2  ARG  85           HH1      ARG  85   2.580  -9.580  13.040
  191    H    GLU  86           H        GLU  86   5.490  -5.160  10.600
  192    H    THR  87           H        THR  87   9.580  -4.450  12.610
  193    HG1  THR  87           HG1      THR  87  11.430  -3.840  13.590
  194    H    GLY  88           H        GLY  88  10.800  -8.110  15.330
  195    H    SER  89           H        SER  89  12.300  -6.120  16.600
  196    HG   SER  89           HG       SER  89  14.260  -4.290  15.930
  197    H    SER  90           H        SER  90  10.320  -3.760  17.500
  198    HG   SER  90           HG       SER  90   8.280  -0.690  15.510
  199    H    LYS  91           H        LYS  91  10.860   0.550  17.540
  200   1HZ   LYS  91           HZ3      LYS  91  14.900  -0.710  19.690
  201   2HZ   LYS  91           HZ1      LYS  91  14.290  -2.110  20.290
  202   3HZ   LYS  91           HZ2      LYS  91  13.770  -1.550  18.840
  203    OH   TYR  92           OH       TYR  92   4.830   9.590  16.490
  204    H    TYR  92           H        TYR  92   8.100   3.020  20.050
  205    HH   TYR  92           HH       TYR  92   5.150  10.470  16.850
  206    H    ASN  94           H        ASN  94  11.060   4.460  17.660
  207   1HD2  ASN  94           HD2      ASN  94  15.390   6.590  18.120
  208   2HD2  ASN  94           HD2      ASN  94  15.370   5.710  16.620
  209    H    CYS  95           H        CYS  95  10.920   4.040  14.260
  210    H    ALA  96           H        ALA  96  10.640  -0.450  13.880
  211    OH   TYR  97           OH       TYR  97   5.660   0.240  11.470
  212    H    TYR  97           H        TYR  97  12.260  -1.570  10.040
  213    HH   TYR  97           HH       TYR  97   4.890  -0.420  11.380
  214    H    LYS  98           H        LYS  98   9.910  -5.150   8.840
  215   1HZ   LYS  98           HZ3      LYS  98   8.620  -9.840  11.110
  216   2HZ   LYS  98           HZ1      LYS  98   9.540  -9.850  12.460
  217   3HZ   LYS  98           HZ2      LYS  98   9.320  -8.460  11.640
  218    H    THR  99           H        THR  99  12.560  -5.280   5.390
  219    HG1  THR  99           HG1      THR  99  12.640  -2.890   5.390
  220    H    THR 100           H        THR 100   9.480  -5.380   2.280
  221    HG1  THR 100           HG1      THR 100  10.860  -8.200   2.570
  222    H    GLN 101           H        GLN 101  11.750  -6.120  -1.170
  223   1HE2  GLN 101           HE2      GLN 101   9.620  -4.990  -6.800
  224   2HE2  GLN 101           HE2      GLN 101  11.110  -5.440  -6.050
  225    H    ALA 102           H        ALA 102   8.260  -5.950  -3.850
  226    H    ASN 103           H        ASN 103   8.410  -8.380  -7.420
  227   1HD2  ASN 103           HD2      ASN 103   9.230  -4.430 -10.480
  228   2HD2  ASN 103           HD2      ASN 103   8.060  -5.430 -11.310
  229    H    LYS 104           H        LYS 104   4.430  -7.150  -7.780
  230   1HZ   LYS 104           HZ3      LYS 104   4.150 -11.860  -2.470
  231   2HZ   LYS 104           HZ1      LYS 104   3.260 -12.990  -3.230
  232   3HZ   LYS 104           HZ2      LYS 104   4.780 -13.360  -2.760
  233    H    HIS 105           H        HIS 105   1.180 -10.010  -8.520
  234    HD1  HIS 105           HD1      HIS 105  -2.920 -10.460 -11.560
  235    HE2  HIS 105           HE2      HIS 105   0.500 -11.800 -13.220
  236    H    ILE 106           H        ILE 106  -1.860  -6.590  -9.090
  237    H    ILE 107           H        ILE 107  -3.670  -6.440  -5.110
  238    H    VAL 108           H        VAL 108  -6.970  -4.060  -6.390
  239    H    ALA 109           H        ALA 109  -8.590  -1.650  -2.980
  240    H    CYS 110           H        CYS 110 -12.460  -1.230  -5.200
  241    H    GLU 111           H        GLU 111 -12.900   3.170  -5.920
  242    H    GLY 112           H        GLY 112 -16.950   4.720  -6.110
  243    H    ASN 113           H        ASN 113 -16.330   8.780  -7.730
  244   1HD2  ASN 113           HD2      ASN 113 -19.510  10.060 -12.580
  245   2HD2  ASN 113           HD2      ASN 113 -19.850   9.970 -10.860
  246    OH   TYR 115           OH       TYR 115 -16.070  -0.030  -8.550
  247    H    TYR 115           H        TYR 115 -13.870   6.390 -11.800
  248    HH   TYR 115           HH       TYR 115 -15.730  -0.920  -8.920
  249    H    VAL 116           H        VAL 116 -12.410   5.370  -7.850
  250    H    VAL 118           H        VAL 118  -9.730   2.290  -3.560
  251    H    HIS 119           H        HIS 119  -8.630   1.220  -2.030
  252    HD1  HIS 119           HD1      HIS 119  -8.120  -0.900   3.160
  253    HE2  HIS 119           HE2      HIS 119  -8.660  -4.540   1.500
  254    H    PHE 120           H        PHE 120  -5.560  -0.330   0.440
  255    H    ASP 121           H        ASP 121  -5.260  -4.220  -1.780
  256    H    ALA 122           H        ALA 122  -4.880  -6.670  -2.150
  257    H    SER 123           H        SER 123  -0.950  -8.500  -1.640
  258    HG   SER 123           HG       SER 123   0.690  -6.290  -4.070
  259    H    VAL 124           H        VAL 124  -0.850  -9.990  -5.850
   
  Start of MODEL          20
 Raw file had 259 H/Q atoms
  Start of MODEL   20
    1   1H    LYS   1           H2       LYS   1 -10.750  16.770   2.180
    2   2H    LYS   1           H3       LYS   1 -11.220  17.840   3.330
    3   3H    LYS   1           H1       LYS   1  -9.620  17.440   3.160
    4   1HZ   LYS   1           HZ1      LYS   1 -16.040  15.150   2.220
    5   2HZ   LYS   1           HZ2      LYS   1 -16.150  14.450   0.720
    6   3HZ   LYS   1           HZ3      LYS   1 -15.660  13.560   2.050
    7    H    GLU   2           H        GLU   2  -9.960  14.340   5.540
    8    H    THR   3           H        THR   3 -10.080  11.930   2.290
    9    HG1  THR   3           HG1      THR   3 -11.330  11.820  -0.210
   10    H    ALA   4           H        ALA   4 -12.260   7.960   2.220
   11    H    ALA   5           H        ALA   5 -10.630   7.720  -0.420
   12    H    ALA   6           H        ALA   6  -8.470   9.340   0.300
   13    H    LYS   7           H        LYS   7  -7.300   8.000   2.330
   14   1HZ   LYS   7           HZ3      LYS   7  -9.730   5.300   7.550
   15   2HZ   LYS   7           HZ1      LYS   7  -9.770   4.240   6.310
   16   3HZ   LYS   7           HZ2      LYS   7  -8.920   3.870   7.660
   17    H    PHE   8           H        PHE   8  -6.450   5.550   0.920
   18    H    GLU   9           H        GLU   9  -4.450   6.990  -0.860
   19    NH1  ARG  10           NH2      ARG  10  -3.690   9.970   8.060
   20    NH2  ARG  10           NH1      ARG  10  -4.820   8.020   7.890
   21    H    ARG  10           H        ARG  10  -2.690   7.960   1.430
   22    HE   ARG  10           HE       ARG  10  -3.170   7.500   6.100
   23   1HH1  ARG  10           HH2      ARG  10  -3.030  10.620   7.690
   24   2HH1  ARG  10           HH2      ARG  10  -4.290  10.230   8.810
   25   1HH2  ARG  10           HH1      ARG  10  -4.970   7.120   7.480
   26   2HH2  ARG  10           HH1      ARG  10  -5.400   8.340   8.630
   27    H    GLN  11           H        GLN  11  -1.910   5.560   2.880
   28   1HE2  GLN  11           HE2      GLN  11  -3.460   0.270   5.440
   29   2HE2  GLN  11           HE2      GLN  11  -1.820   0.830   5.250
   30    H    HIS  12           H        HIS  12  -0.720   4.380   0.640
   31    HD1  HIS  12           HD1      HIS  12   0.000   0.050   0.660
   32    HE2  HIS  12           HE2      HIS  12  -3.550   0.790   2.380
   33    H    MET  13           H        MET  13   0.450   5.540  -1.190
   34    H    ASP  14           H        ASP  14   3.730   4.850  -4.160
   35    H    SER  15           H        SER  15   4.390   7.370  -5.070
   36    HG   SER  15           HG       SER  15   2.830   6.710  -7.200
   37    H    SER  16           H        SER  16   6.880   8.720  -5.540
   38    HG   SER  16           HG       SER  16   9.320   9.100  -3.650
   39    H    THR  17           H        THR  17   8.730   6.720  -5.560
   40    HG1  THR  17           HG1      THR  17  10.130   4.870  -2.890
   41    H    SER  18           H        SER  18  11.760   4.290  -7.660
   42    HG   SER  18           HG       SER  18  13.330   2.590  -9.840
   43    H    ALA  19           H        ALA  19  11.760   2.270  -6.170
   44    H    ALA  20           H        ALA  20  11.550  -1.150  -3.650
   45    H    SER  21           H        SER  21  14.770   1.270  -2.380
   46    HG   SER  21           HG       SER  21  17.430   3.200  -1.410
   47    H    SER  22           H        SER  22  15.800  -0.590  -0.340
   48    HG   SER  22           HG       SER  22  17.420   1.320   2.080
   49    H    SER  23           H        SER  23  18.050  -3.340   2.060
   50    HG   SER  23           HG       SER  23  18.510  -3.720   5.460
   51    H    ASN  24           H        ASN  24  16.770  -1.580   4.010
   52   1HD2  ASN  24           HD2      ASN  24  16.340  -3.470   8.630
   53   2HD2  ASN  24           HD2      ASN  24  15.140  -2.260   8.260
   54    OH   TYR  25           OH       TYR  25   9.880   4.060  -1.250
   55    H    TYR  25           H        TYR  25  14.770  -0.590   3.110
   56    HH   TYR  25           HH       TYR  25   8.920   3.760  -1.110
   57    H    CYS  26           H        CYS  26  11.920  -0.380   3.990
   58    H    ASN  27           H        ASN  27  12.490   0.900   6.580
   59   1HD2  ASN  27           HD2      ASN  27  14.510  -0.740  10.610
   60   2HD2  ASN  27           HD2      ASN  27  14.410   0.980  10.860
   61    H    GLN  28           H        GLN  28  13.040   3.790   6.750
   62   1HE2  GLN  28           HE2      GLN  28  11.600   9.970   6.360
   63   2HE2  GLN  28           HE2      GLN  28  12.570   9.390   7.690
   64    H    MET  29           H        MET  29  11.150   4.450   5.140
   65    H    MET  30           H        MET  30   8.560   3.690   6.110
   66    H    LYS  31           H        LYS  31   8.470   5.740   8.130
   67   1HZ   LYS  31           HZ2      LYS  31   6.920   8.110  14.130
   68   2HZ   LYS  31           HZ3      LYS  31   7.880   7.480  15.300
   69   3HZ   LYS  31           HZ1      LYS  31   8.370   8.790  14.470
   70    H    SER  32           H        SER  32   8.410   8.110   6.880
   71    HG   SER  32           HG       SER  32  10.190   9.110   4.770
   72    NH1  ARG  33           NH2      ARG  33   6.210  10.160   0.990
   73    NH2  ARG  33           NH1      ARG  33   5.500   9.130  -0.910
   74    H    ARG  33           H        ARG  33   5.800   8.100   5.470
   75    HE   ARG  33           HE       ARG  33   4.720   7.340   0.580
   76   1HH1  ARG  33           HH2      ARG  33   6.200  10.210   1.990
   77   2HH1  ARG  33           HH2      ARG  33   6.590  10.900   0.450
   78   1HH2  ARG  33           HH1      ARG  33   4.910   8.450  -1.350
   79   2HH2  ARG  33           HH1      ARG  33   5.890   9.880  -1.440
   80    H    ASN  34           H        ASN  34   4.460   9.700   7.760
   81   1HD2  ASN  34           HD2      ASN  34   2.530  13.600   9.450
   82   2HD2  ASN  34           HD2      ASN  34   1.970  12.280  10.470
   83    H    LEU  35           H        LEU  35   2.770   7.170   8.160
   84    H    THR  36           H        THR  36   4.040   6.160  10.610
   85    HG1  THR  36           HG1      THR  36   6.990   5.810  12.060
   86    H    LYS  37           H        LYS  37   3.240   7.650  12.490
   87   1HZ   LYS  37           HZ1      LYS  37   5.290  13.560  11.040
   88   2HZ   LYS  37           HZ2      LYS  37   6.620  13.250  10.160
   89   3HZ   LYS  37           HZ3      LYS  37   5.170  12.630   9.690
   90    H    ASP  38           H        ASP  38   2.260   6.640  15.000
   91    NH1  ARG  39           NH2      ARG  39  -0.620   4.340  13.640
   92    NH2  ARG  39           NH1      ARG  39  -2.800   4.810  14.090
   93    H    ARG  39           H        ARG  39   1.020   4.740  15.690
   94    HE   ARG  39           HE       ARG  39  -2.650   2.880  15.640
   95   1HH1  ARG  39           HH2      ARG  39   0.180   3.740  13.720
   96   2HH1  ARG  39           HH2      ARG  39  -0.600   5.080  12.960
   97   1HH2  ARG  39           HH1      ARG  39  -3.650   4.600  14.560
   98   2HH2  ARG  39           HH1      ARG  39  -2.760   5.550  13.420
   99    H    CYS  40           H        CYS  40   3.950   1.760  16.720
  100    H    LYS  41           H        LYS  41   3.330   1.280  12.370
  101   1HZ   LYS  41           HZ1      LYS  41  -0.210   2.920   9.950
  102   2HZ   LYS  41           HZ2      LYS  41  -1.780   3.080  10.310
  103   3HZ   LYS  41           HZ3      LYS  41  -0.810   2.170  11.270
  104    H    VAL  43           H        VAL  43   1.180  -3.640   9.970
  105    H    ASN  44           H        ASN  44   3.130  -3.500   6.370
  106   1HD2  ASN  44           HD2      ASN  44   2.060   1.660   3.620
  107   2HD2  ASN  44           HD2      ASN  44   3.350   0.890   4.500
  108    H    THR  45           H        THR  45   0.990  -1.770   3.010
  109    HG1  THR  45           HG1      THR  45   1.630  -4.990   2.000
  110    H    PHE  46           H        PHE  46   4.600  -1.030   0.820
  111    H    VAL  47           H        VAL  47   3.060   1.790  -2.190
  112    H    HIS  48           H        HIS  48   4.960   0.350  -5.740
  113    HD1  HIS  48           HD1      HIS  48   8.730   3.400  -4.820
  114    HE2  HIS  48           HE2      HIS  48   9.080   0.150  -2.430
  115    H    GLU  49           H        GLU  49   3.590   3.080  -7.050
  116    H    SER  50           H        SER  50   3.280   5.350 -10.780
  117    HG   SER  50           HG       SER  50   1.810   5.470 -12.490
  118    H    LEU  51           H        LEU  51  -0.200   8.100  -9.040
  119    H    ALA  52           H        ALA  52  -2.040   8.120 -11.250
  120    H    ASP  53           H        ASP  53  -0.960   5.520 -12.520
  121    H    VAL  54           H        VAL  54  -2.020   3.820 -10.630
  122    H    GLN  55           H        GLN  55  -4.470   4.170 -10.470
  123   1HE2  GLN  55           HE2      GLN  55  -8.870   8.370 -10.400
  124   2HE2  GLN  55           HE2      GLN  55  -9.090   6.660 -10.150
  125    H    ALA  56           H        ALA  56  -5.000   2.700 -12.840
  126    H    VAL  57           H        VAL  57  -5.740   0.200 -11.570
  127    H    CYS  58           H        CYS  58  -8.070   0.020 -11.040
  128    H    SER  59           H        SER  59  -9.400  -1.050 -13.220
  129    HG   SER  59           HG       SER  59 -12.050   0.100 -13.720
  130    H    GLN  60           H        GLN  60  -9.580  -3.700 -13.260
  131   1HE2  GLN  60           HE2      GLN  60  -4.070  -2.850 -15.560
  132   2HE2  GLN  60           HE2      GLN  60  -5.660  -2.110 -15.540
  133    H    LYS  61           H        LYS  61  -8.770  -6.850 -13.000
  134   1HZ   LYS  61           HZ3      LYS  61  -9.260 -12.470 -10.120
  135   2HZ   LYS  61           HZ1      LYS  61 -10.660 -12.250 -10.910
  136   3HZ   LYS  61           HZ2      LYS  61 -10.230 -13.760 -10.460
  137    H    ASN  62           H        ASN  62 -12.800  -8.540 -12.380
  138   1HD2  ASN  62           HD2      ASN  62 -15.760  -7.000  -7.620
  139   2HD2  ASN  62           HD2      ASN  62 -14.370  -6.330  -8.430
  140    H    VAL  63           H        VAL  63 -12.770  -7.890  -7.860
  141    H    ALA  64           H        ALA  64 -12.500 -11.150  -4.900
  142    H    CYS  65           H        CYS  65 -13.790  -8.110  -1.890
  143    H    LYS  66           H        LYS  66 -10.220  -8.140   1.060
  144   1HZ   LYS  66           HZ3      LYS  66  -5.390  -9.580   3.380
  145   2HZ   LYS  66           HZ1      LYS  66  -6.290 -10.320   4.520
  146   3HZ   LYS  66           HZ2      LYS  66  -4.960 -11.070   3.940
  147    H    ASN  67           H        ASN  67 -12.570  -8.040   3.070
  148   1HD2  ASN  67           HD2      ASN  67 -15.380  -4.770   3.570
  149   2HD2  ASN  67           HD2      ASN  67 -15.240  -5.430   5.160
  150    H    GLY  68           H        GLY  68 -14.280  -9.750   1.830
  151    H    GLN  69           H        GLN  69 -15.600  -7.680   1.270
  152   1HE2  GLN  69           HE2      GLN  69 -16.520  -1.640   1.260
  153   2HE2  GLN  69           HE2      GLN  69 -17.320  -2.610   0.040
  154    H    THR  70           H        THR  70 -18.320  -6.540  -2.270
  155    HG1  THR  70           HG1      THR  70 -20.020  -6.080  -5.200
  156    H    ASN  71           H        ASN  71 -16.060  -5.080  -3.240
  157   1HD2  ASN  71           HD2      ASN  71 -15.170  -0.840  -1.950
  158   2HD2  ASN  71           HD2      ASN  71 -15.320  -0.470  -3.650
  159    H    CYS  72           H        CYS  72 -13.870  -5.910  -5.530
  160    OH   TYR  73           OH       TYR  73 -15.500  -2.300  -9.200
  161    H    TYR  73           H        TYR  73  -9.840  -4.690  -6.420
  162    HH   TYR  73           HH       TYR  73 -16.000  -2.750  -9.940
  163    H    GLN  74           H        GLN  74  -8.870  -7.220  -9.770
  164   1HE2  GLN  74           HE2      GLN  74  -4.810 -12.510 -10.250
  165   2HE2  GLN  74           HE2      GLN  74  -4.380 -11.040 -11.070
  166    H    SER  75           H        SER  75  -4.540  -6.300 -10.220
  167    HG   SER  75           HG       SER  75  -1.410  -6.260 -11.790
  168    OH   TYR  76           OH       TYR  76  -9.730  -9.120 -16.900
  169    H    TYR  76           H        TYR  76  -4.350  -6.740 -14.790
  170    HH   TYR  76           HH       TYR  76 -10.130  -8.260 -17.210
  171    H    SER  77           H        SER  77  -1.710  -7.140 -14.520
  172    HG   SER  77           HG       SER  77   0.940  -5.940 -16.760
  173    H    THR  78           H        THR  78   2.560  -7.520 -14.050
  174    HG1  THR  78           HG1      THR  78   5.870  -7.760 -12.670
  175    H    MET  79           H        MET  79   2.870  -5.900  -9.840
  176    H    SER  80           H        SER  80   5.080  -2.070  -9.490
  177    HG   SER  80           HG       SER  80   8.930  -0.800  -7.550
  178    H    ILE  81           H        ILE  81   6.050  -4.360  -5.820
  179    H    THR  82           H        THR  82   5.630  -2.070  -2.110
  180    HG1  THR  82           HG1      THR  82   8.830  -2.300  -2.670
  181    H    ASP  83           H        ASP  83   7.110  -5.130   0.100
  182    H    CYS  84           H        CYS  84   5.290  -3.540   3.780
  183    NH1  ARG  85           NH2      ARG  85   3.930  -8.070  11.220
  184    NH2  ARG  85           NH1      ARG  85   3.530 -10.180  11.630
  185    H    ARG  85           H        ARG  85   8.060  -5.200   6.610
  186    HE   ARG  85           HE       ARG  85   4.960 -10.360   9.490
  187   1HH1  ARG  85           HH2      ARG  85   4.440  -7.420  10.650
  188   2HH1  ARG  85           HH2      ARG  85   3.550  -7.850  12.110
  189   1HH2  ARG  85           HH1      ARG  85   3.760 -11.140  11.520
  190   2HH2  ARG  85           HH1      ARG  85   3.110  -9.860  12.490
  191    H    GLU  86           H        GLU  86   5.800  -5.490  10.250
  192    H    THR  87           H        THR  87   9.690  -4.610  12.580
  193    HG1  THR  87           HG1      THR  87  12.860  -4.160  13.890
  194    H    GLY  88           H        GLY  88  11.340  -8.300  14.870
  195    H    SER  89           H        SER  89  12.570  -6.120  16.120
  196    HG   SER  89           HG       SER  89  14.790  -3.720  15.550
  197    H    SER  90           H        SER  90  10.530  -4.290  17.310
  198    HG   SER  90           HG       SER  90   8.390  -1.460  14.330
  199    H    LYS  91           H        LYS  91  10.390   0.100  17.730
  200   1HZ   LYS  91           HZ3      LYS  91   9.670  -2.670  22.940
  201   2HZ   LYS  91           HZ1      LYS  91  10.600  -3.690  23.830
  202   3HZ   LYS  91           HZ2      LYS  91  10.190  -2.230  24.440
  203    OH   TYR  92           OH       TYR  92   4.120   9.150  18.860
  204    H    TYR  92           H        TYR  92   7.500   1.920  20.510
  205    HH   TYR  92           HH       TYR  92   3.690   9.220  17.950
  206    H    ASN  94           H        ASN  94  10.570   4.030  18.470
  207   1HD2  ASN  94           HD2      ASN  94  12.780   0.800  19.790
  208   2HD2  ASN  94           HD2      ASN  94  13.480   1.010  18.210
  209    H    CYS  95           H        CYS  95  10.130   3.760  14.960
  210    H    ALA  96           H        ALA  96  10.560  -0.560  14.260
  211    OH   TYR  97           OH       TYR  97   5.750  -0.010  11.640
  212    H    TYR  97           H        TYR  97  12.400  -1.500  10.300
  213    HH   TYR  97           HH       TYR  97   5.030  -0.720  11.540
  214    H    LYS  98           H        LYS  98  10.300  -5.030   8.730
  215   1HZ   LYS  98           HZ1      LYS  98   9.870  -7.650   4.690
  216   2HZ   LYS  98           HZ2      LYS  98   8.950  -8.940   5.000
  217   3HZ   LYS  98           HZ3      LYS  98   9.570  -8.070   6.240
  218    H    THR  99           H        THR  99  12.930  -5.180   5.160
  219    HG1  THR  99           HG1      THR  99  12.750  -2.790   5.250
  220    H    THR 100           H        THR 100   9.680  -5.280   2.190
  221    HG1  THR 100           HG1      THR 100  10.720  -8.470   2.330
  222    H    GLN 101           H        GLN 101  11.990  -6.140  -1.230
  223   1HE2  GLN 101           HE2      GLN 101   8.820  -3.390  -5.990
  224   2HE2  GLN 101           HE2      GLN 101   9.710  -4.880  -6.090
  225    H    ALA 102           H        ALA 102   8.410  -5.790  -3.660
  226    H    ASN 103           H        ASN 103   8.200  -8.580  -7.080
  227   1HD2  ASN 103           HD2      ASN 103   6.520  -5.240 -11.620
  228   2HD2  ASN 103           HD2      ASN 103   6.910  -5.000  -9.930
  229    H    LYS 104           H        LYS 104   4.450  -7.180  -7.990
  230   1HZ   LYS 104           HZ2      LYS 104   4.270 -13.110  -5.240
  231   2HZ   LYS 104           HZ3      LYS 104   5.210 -13.700  -4.020
  232   3HZ   LYS 104           HZ1      LYS 104   3.790 -12.960  -3.680
  233    H    HIS 105           H        HIS 105   1.240 -10.110  -8.500
  234    HD1  HIS 105           HD1      HIS 105  -2.980 -10.040 -11.640
  235    HE2  HIS 105           HE2      HIS 105   0.200 -11.790 -13.310
  236    H    ILE 106           H        ILE 106  -1.910  -6.750  -8.980
  237    H    ILE 107           H        ILE 107  -3.560  -6.300  -4.900
  238    H    VAL 108           H        VAL 108  -6.940  -4.000  -6.250
  239    H    ALA 109           H        ALA 109  -8.560  -1.740  -2.780
  240    H    CYS 110           H        CYS 110 -12.460  -1.080  -4.950
  241    H    GLU 111           H        GLU 111 -12.660   3.320  -5.690
  242    H    GLY 112           H        GLY 112 -16.630   5.110  -6.140
  243    H    ASN 113           H        ASN 113 -15.820   9.120  -7.860
  244   1HD2  ASN 113           HD2      ASN 113 -18.230  10.340 -13.370
  245   2HD2  ASN 113           HD2      ASN 113 -19.090  10.070 -11.860
  246    OH   TYR 115           OH       TYR 115 -15.950   0.060  -8.190
  247    H    TYR 115           H        TYR 115 -13.270   6.300 -11.820
  248    HH   TYR 115           HH       TYR 115 -15.660  -0.860  -8.530
  249    H    VAL 116           H        VAL 116 -12.120   5.450  -7.780
  250    H    VAL 118           H        VAL 118  -9.760   2.350  -3.390
  251    H    HIS 119           H        HIS 119  -8.500   1.250  -1.910
  252    HD1  HIS 119           HD1      HIS 119  -7.880  -0.850   3.190
  253    HE2  HIS 119           HE2      HIS 119  -8.770  -4.540   1.810
  254    H    PHE 120           H        PHE 120  -5.510  -0.470   0.590
  255    H    ASP 121           H        ASP 121  -5.090  -4.250  -1.700
  256    H    ALA 122           H        ALA 122  -4.530  -6.570  -1.920
  257    H    SER 123           H        SER 123  -0.720  -8.530  -1.480
  258    HG   SER 123           HG       SER 123   1.900  -6.400  -3.580
  259    H    VAL 124           H        VAL 124  -0.500  -9.790  -5.780
   
  Start of MODEL          21
 Raw file had 259 H/Q atoms
  Start of MODEL   21
    1   1H    LYS   1           H3       LYS   1 -10.410  17.400   3.000
    2   2H    LYS   1           H1       LYS   1 -10.550  18.160   4.460
    3   3H    LYS   1           H2       LYS   1  -9.050  17.890   3.840
    4   1HZ   LYS   1           HZ3      LYS   1 -15.700  15.960   4.470
    5   2HZ   LYS   1           HZ1      LYS   1 -15.920  17.460   5.170
    6   3HZ   LYS   1           HZ2      LYS   1 -15.320  17.330   3.630
    7    H    GLU   2           H        GLU   2  -9.310  14.500   5.600
    8    H    THR   3           H        THR   3  -9.950  12.350   2.150
    9    HG1  THR   3           HG1      THR   3 -11.300  11.970  -0.490
   10    H    ALA   4           H        ALA   4 -11.930   8.300   2.230
   11    H    ALA   5           H        ALA   5 -10.310   8.110  -0.610
   12    H    ALA   6           H        ALA   6  -8.070   9.780   0.210
   13    H    LYS   7           H        LYS   7  -6.890   8.350   2.000
   14   1HZ   LYS   7           HZ3      LYS   7  -6.710   3.030   5.940
   15   2HZ   LYS   7           HZ2      LYS   7  -6.960   4.080   7.430
   16   3HZ   LYS   7           HZ1      LYS   7  -7.310   2.960   7.370
   17    H    PHE   8           H        PHE   8  -6.050   5.900   0.730
   18    H    GLU   9           H        GLU   9  -4.070   7.290  -0.920
   19    NH1  ARG  10           NH2      ARG  10  -2.680  10.670   7.780
   20    NH2  ARG  10           NH1      ARG  10  -4.010   8.810   7.750
   21    H    ARG  10           H        ARG  10  -2.220   8.260   1.220
   22    HE   ARG  10           HE       ARG  10  -2.600   8.170   5.810
   23   1HH1  ARG  10           HH2      ARG  10  -1.880  11.140   7.410
   24   2HH1  ARG  10           HH2      ARG  10  -3.180  11.040   8.560
   25   1HH2  ARG  10           HH1      ARG  10  -4.290   7.940   7.340
   26   2HH2  ARG  10           HH1      ARG  10  -4.450   9.150   8.580
   27    H    GLN  11           H        GLN  11  -1.560   5.910   2.570
   28   1HE2  GLN  11           HE2      GLN  11  -3.460   0.500   5.000
   29   2HE2  GLN  11           HE2      GLN  11  -1.820   1.050   5.100
   30    H    HIS  12           H        HIS  12  -0.300   4.590   0.450
   31    HD1  HIS  12           HD1      HIS  12   0.430   0.300   0.550
   32    HE2  HIS  12           HE2      HIS  12  -3.270   0.930   1.930
   33    H    MET  13           H        MET  13   0.930   5.700  -1.360
   34    H    ASP  14           H        ASP  14   4.180   4.930  -4.380
   35    H    SER  15           H        SER  15   5.230   7.730  -5.830
   36    HG   SER  15           HG       SER  15   5.050   9.900  -8.460
   37    H    SER  16           H        SER  16   7.680   8.830  -6.410
   38    HG   SER  16           HG       SER  16  10.170   9.700  -4.530
   39    H    THR  17           H        THR  17   9.830   7.270  -5.490
   40    HG1  THR  17           HG1      THR  17  11.560   6.860  -2.780
   41    H    SER  18           H        SER  18  11.940   4.630  -8.050
   42    HG   SER  18           HG       SER  18   9.800   1.540  -9.950
   43    H    ALA  19           H        ALA  19  11.370   2.550  -5.960
   44    H    ALA  20           H        ALA  20  11.350  -0.860  -3.570
   45    H    SER  21           H        SER  21  14.430   1.690  -2.290
   46    HG   SER  21           HG       SER  21  16.460   4.110  -1.900
   47    H    SER  22           H        SER  22  15.630  -0.390  -0.570
   48    HG   SER  22           HG       SER  22  18.920   0.030   3.020
   49    H    SER  23           H        SER  23  18.030  -2.890   1.710
   50    HG   SER  23           HG       SER  23  18.960  -4.060   4.550
   51    H    ASN  24           H        ASN  24  16.820  -1.410   3.860
   52   1HD2  ASN  24           HD2      ASN  24  16.110  -3.550   8.400
   53   2HD2  ASN  24           HD2      ASN  24  15.000  -2.270   7.990
   54    OH   TYR  25           OH       TYR  25   8.680   3.550  -0.390
   55    H    TYR  25           H        TYR  25  14.670  -0.490   3.040
   56    HH   TYR  25           HH       TYR  25   8.960   4.140  -1.160
   57    H    CYS  26           H        CYS  26  11.940  -0.420   4.070
   58    H    ASN  27           H        ASN  27  12.430   0.740   6.690
   59   1HD2  ASN  27           HD2      ASN  27  15.320  -0.970   9.850
   60   2HD2  ASN  27           HD2      ASN  27  15.200   0.690  10.330
   61    H    GLN  28           H        GLN  28  13.020   3.640   7.410
   62   1HE2  GLN  28           HE2      GLN  28  14.880   5.620  11.030
   63   2HE2  GLN  28           HE2      GLN  28  14.130   7.070  10.440
   64    H    MET  29           H        MET  29  10.970   4.350   5.640
   65    H    MET  30           H        MET  30   8.410   3.410   6.460
   66    H    LYS  31           H        LYS  31   8.310   5.520   8.490
   67   1HZ   LYS  31           HZ2      LYS  31  11.100   4.550  10.810
   68   2HZ   LYS  31           HZ3      LYS  31  12.680   4.950  11.040
   69   3HZ   LYS  31           HZ1      LYS  31  11.810   4.250  12.230
   70    H    SER  32           H        SER  32   8.480   7.890   7.610
   71    HG   SER  32           HG       SER  32   8.480   8.890   4.360
   72    NH1  ARG  33           NH2      ARG  33   4.290   8.510   0.210
   73    NH2  ARG  33           NH1      ARG  33   5.850  10.110   0.090
   74    H    ARG  33           H        ARG  33   6.220   7.960   5.940
   75    HE   ARG  33           HE       ARG  33   5.470  10.360   2.550
   76   1HH1  ARG  33           HH2      ARG  33   3.650   7.950   0.740
   77   2HH1  ARG  33           HH2      ARG  33   4.410   8.350  -0.770
   78   1HH2  ARG  33           HH1      ARG  33   6.400  10.850   0.480
   79   2HH2  ARG  33           HH1      ARG  33   5.920   9.860  -0.870
   80    H    ASN  34           H        ASN  34   2.890   9.990   7.490
   81   1HD2  ASN  34           HD2      ASN  34   4.800  12.390   9.570
   82   2HD2  ASN  34           HD2      ASN  34   4.640  10.710   9.980
   83    H    LEU  35           H        LEU  35   2.720   6.800   8.670
   84    H    THR  36           H        THR  36   3.350   5.930  11.060
   85    HG1  THR  36           HG1      THR  36   5.970   5.530  11.360
   86    H    LYS  37           H        LYS  37   1.940   6.970  13.000
   87   1HZ   LYS  37           HZ3      LYS  37   6.470  11.420  15.170
   88   2HZ   LYS  37           HZ1      LYS  37   7.040   9.910  15.020
   89   3HZ   LYS  37           HZ2      LYS  37   7.610  11.080  14.040
   90    H    ASP  38           H        ASP  38   1.280   5.740  15.540
   91    NH1  ARG  39           NH2      ARG  39   0.450  -2.840  18.810
   92    NH2  ARG  39           NH1      ARG  39   2.090  -3.050  17.260
   93    H    ARG  39           H        ARG  39   0.540   3.640  16.290
   94    HE   ARG  39           HE       ARG  39   0.970  -1.080  16.220
   95   1HH1  ARG  39           HH2      ARG  39  -0.410  -2.390  19.090
   96   2HH1  ARG  39           HH2      ARG  39   0.800  -3.630  19.300
   97   1HH2  ARG  39           HH1      ARG  39   2.540  -2.760  16.410
   98   2HH2  ARG  39           HH1      ARG  39   2.410  -3.850  17.760
   99    H    CYS  40           H        CYS  40   4.060   1.240  16.810
  100    H    LYS  41           H        LYS  41   3.100   0.880  12.470
  101   1HZ   LYS  41           HZ3      LYS  41  -2.160  -1.060   9.950
  102   2HZ   LYS  41           HZ1      LYS  41  -2.840   0.370   9.570
  103   3HZ   LYS  41           HZ2      LYS  41  -3.170  -0.950   8.670
  104    H    VAL  43           H        VAL  43   0.890  -3.950   9.790
  105    H    ASN  44           H        ASN  44   3.060  -3.500   6.360
  106   1HD2  ASN  44           HD2      ASN  44   1.770   1.670   3.740
  107   2HD2  ASN  44           HD2      ASN  44   3.090   1.070   4.680
  108    H    THR  45           H        THR  45   1.040  -1.470   3.060
  109    HG1  THR  45           HG1      THR  45   1.610  -4.920   0.960
  110    H    PHE  46           H        PHE  46   4.700  -1.140   0.770
  111    H    VAL  47           H        VAL  47   3.490   1.860  -2.260
  112    H    HIS  48           H        HIS  48   5.100   0.330  -5.840
  113    HD1  HIS  48           HD1      HIS  48   8.750   3.360  -4.740
  114    HE2  HIS  48           HE2      HIS  48   8.930   0.160  -2.280
  115    H    GLU  49           H        GLU  49   3.830   3.130  -7.200
  116    H    SER  50           H        SER  50   3.600   5.020 -11.120
  117    HG   SER  50           HG       SER  50   2.130   5.040 -12.730
  118    H    LEU  51           H        LEU  51   0.150   7.940  -9.800
  119    H    ALA  52           H        ALA  52  -1.650   7.770 -12.090
  120    H    ASP  53           H        ASP  53  -0.660   5.020 -13.080
  121    H    VAL  54           H        VAL  54  -1.680   3.550 -11.060
  122    H    GLN  55           H        GLN  55  -4.210   4.050 -10.890
  123   1HE2  GLN  55           HE2      GLN  55  -7.830   8.740 -11.500
  124   2HE2  GLN  55           HE2      GLN  55  -8.490   7.240 -10.930
  125    H    ALA  56           H        ALA  56  -4.900   2.500 -13.150
  126    H    VAL  57           H        VAL  57  -5.650   0.090 -11.700
  127    H    CYS  58           H        CYS  58  -8.050  -0.040 -11.090
  128    H    SER  59           H        SER  59  -9.370  -1.210 -13.390
  129    HG   SER  59           HG       SER  59 -12.440   0.010 -14.120
  130    H    GLN  60           H        GLN  60  -9.600  -3.770 -13.300
  131   1HE2  GLN  60           HE2      GLN  60  -3.940  -3.190 -15.240
  132   2HE2  GLN  60           HE2      GLN  60  -5.510  -2.440 -15.410
  133    H    LYS  61           H        LYS  61  -8.890  -6.860 -12.740
  134   1HZ   LYS  61           HZ1      LYS  61  -9.300 -12.650  -9.720
  135   2HZ   LYS  61           HZ2      LYS  61 -10.730 -12.400 -10.450
  136   3HZ   LYS  61           HZ3      LYS  61 -10.230 -13.930 -10.130
  137    H    ASN  62           H        ASN  62 -12.940  -8.530 -12.140
  138   1HD2  ASN  62           HD2      ASN  62 -15.760  -6.520  -7.460
  139   2HD2  ASN  62           HD2      ASN  62 -14.280  -6.090  -8.270
  140    H    VAL  63           H        VAL  63 -12.900  -7.690  -7.660
  141    H    ALA  64           H        ALA  64 -12.650 -10.750  -4.540
  142    H    CYS  65           H        CYS  65 -14.080  -7.620  -1.760
  143    H    LYS  66           H        LYS  66 -10.690  -7.450   1.340
  144   1HZ   LYS  66           HZ3      LYS  66  -8.310 -10.920   2.070
  145   2HZ   LYS  66           HZ1      LYS  66  -6.700 -11.300   1.940
  146   3HZ   LYS  66           HZ2      LYS  66  -7.390 -10.990   3.410
  147    H    ASN  67           H        ASN  67 -13.190  -7.120   3.250
  148   1HD2  ASN  67           HD2      ASN  67 -15.840  -3.880   3.120
  149   2HD2  ASN  67           HD2      ASN  67 -15.970  -4.300   4.800
  150    H    GLY  68           H        GLY  68 -14.770  -8.880   2.060
  151    H    GLN  69           H        GLN  69 -16.000  -7.130   1.110
  152   1HE2  GLN  69           HE2      GLN  69 -20.840  -4.760  -1.880
  153   2HE2  GLN  69           HE2      GLN  69 -20.600  -5.480  -0.310
  154    H    THR  70           H        THR  70 -18.610  -6.150  -2.560
  155    HG1  THR  70           HG1      THR  70 -19.940  -5.720  -5.520
  156    H    ASN  71           H        ASN  71 -16.040  -4.700  -3.250
  157   1HD2  ASN  71           HD2      ASN  71 -14.720  -0.410  -1.860
  158   2HD2  ASN  71           HD2      ASN  71 -15.000  -0.050  -3.550
  159    H    CYS  72           H        CYS  72 -13.910  -5.510  -5.390
  160    OH   TYR  73           OH       TYR  73 -15.530  -2.130  -9.320
  161    H    TYR  73           H        TYR  73  -9.830  -4.520  -6.280
  162    HH   TYR  73           HH       TYR  73 -16.110  -2.730  -9.870
  163    H    GLN  74           H        GLN  74  -9.000  -7.170  -9.550
  164   1HE2  GLN  74           HE2      GLN  74  -5.120 -12.380 -10.200
  165   2HE2  GLN  74           HE2      GLN  74  -5.160 -10.820 -10.990
  166    H    SER  75           H        SER  75  -4.620  -6.450 -10.070
  167    HG   SER  75           HG       SER  75  -1.530  -6.300 -11.660
  168    OH   TYR  76           OH       TYR  76  -9.890  -9.580 -16.190
  169    H    TYR  76           H        TYR  76  -4.480  -7.140 -14.610
  170    HH   TYR  76           HH       TYR  76 -10.270  -8.640 -16.240
  171    H    SER  77           H        SER  77  -1.900  -7.430 -14.210
  172    HG   SER  77           HG       SER  77   2.370  -8.390 -16.570
  173    H    THR  78           H        THR  78   2.430  -7.660 -13.870
  174    HG1  THR  78           HG1      THR  78   5.190  -6.780 -12.620
  175    H    MET  79           H        MET  79   2.800  -5.890  -9.690
  176    H    SER  80           H        SER  80   5.300  -2.280  -9.590
  177    HG   SER  80           HG       SER  80   9.090  -0.840  -7.680
  178    H    ILE  81           H        ILE  81   6.090  -4.410  -5.890
  179    H    THR  82           H        THR  82   5.580  -2.170  -2.150
  180    HG1  THR  82           HG1      THR  82   8.720  -2.320  -2.710
  181    H    ASP  83           H        ASP  83   7.030  -5.220   0.080
  182    H    CYS  84           H        CYS  84   5.100  -3.760   3.830
  183    NH1  ARG  85           NH2      ARG  85   7.460  -9.470   3.420
  184    NH2  ARG  85           NH1      ARG  85   5.400 -10.050   2.660
  185    H    ARG  85           H        ARG  85   7.800  -5.280   6.680
  186    HE   ARG  85           HE       ARG  85   4.620  -8.960   4.800
  187   1HH1  ARG  85           HH2      ARG  85   8.030  -9.000   4.090
  188   2HH1  ARG  85           HH2      ARG  85   7.890  -9.870   2.610
  189   1HH2  ARG  85           HH1      ARG  85   4.400 -10.060   2.770
  190   2HH2  ARG  85           HH1      ARG  85   5.840 -10.460   1.870
  191    H    GLU  86           H        GLU  86   5.620  -5.500  10.540
  192    H    THR  87           H        THR  87   9.620  -4.620  12.620
  193    HG1  THR  87           HG1      THR  87  11.600  -3.930  13.220
  194    H    GLY  88           H        GLY  88  11.640  -8.120  14.980
  195    H    SER  89           H        SER  89  12.690  -5.800  16.270
  196    HG   SER  89           HG       SER  89  14.260  -3.440  15.770
  197    H    SER  90           H        SER  90  10.220  -4.030  17.130
  198    HG   SER  90           HG       SER  90   7.660  -1.330  14.880
  199    H    LYS  91           H        LYS  91  10.460   0.020  17.510
  200   1HZ   LYS  91           HZ3      LYS  91  12.610   4.320  21.280
  201   2HZ   LYS  91           HZ1      LYS  91  10.980   4.430  21.370
  202   3HZ   LYS  91           HZ2      LYS  91  11.860   4.270  22.740
  203    OH   TYR  92           OH       TYR  92   3.140   8.740  19.130
  204    H    TYR  92           H        TYR  92   7.220   1.830  20.050
  205    HH   TYR  92           HH       TYR  92   2.530   8.680  18.310
  206    H    ASN  94           H        ASN  94  10.270   4.350  17.960
  207   1HD2  ASN  94           HD2      ASN  94  15.270   3.230  15.420
  208   2HD2  ASN  94           HD2      ASN  94  13.970   2.560  16.370
  209    H    CYS  95           H        CYS  95   9.890   3.870  14.480
  210    H    ALA  96           H        ALA  96  10.340  -0.640  13.780
  211    OH   TYR  97           OH       TYR  97   5.350  -0.390  11.580
  212    H    TYR  97           H        TYR  97  12.350  -1.530  10.050
  213    HH   TYR  97           HH       TYR  97   4.600  -1.050  11.380
  214    H    LYS  98           H        LYS  98  10.030  -5.050   8.770
  215   1HZ   LYS  98           HZ3      LYS  98   8.900 -11.470   6.010
  216   2HZ   LYS  98           HZ1      LYS  98  10.020 -12.270   5.140
  217   3HZ   LYS  98           HZ2      LYS  98  10.180 -12.180   6.770
  218    H    THR  99           H        THR  99  12.600  -5.640   5.140
  219    HG1  THR  99           HG1      THR  99  12.890  -3.050   5.230
  220    H    THR 100           H        THR 100   9.500  -5.420   2.170
  221    HG1  THR 100           HG1      THR 100  10.780  -8.280   2.320
  222    H    GLN 101           H        GLN 101  11.870  -6.000  -1.180
  223   1HE2  GLN 101           HE2      GLN 101   8.860  -3.460  -6.110
  224   2HE2  GLN 101           HE2      GLN 101   9.910  -4.840  -6.070
  225    H    ALA 102           H        ALA 102   8.420  -5.790  -3.760
  226    H    ASN 103           H        ASN 103   8.240  -8.600  -7.210
  227   1HD2  ASN 103           HD2      ASN 103   7.690  -6.330 -12.560
  228   2HD2  ASN 103           HD2      ASN 103   8.860  -7.240 -11.610
  229    H    LYS 104           H        LYS 104   4.470  -7.090  -7.920
  230   1HZ   LYS 104           HZ1      LYS 104   4.350 -11.130  -1.870
  231   2HZ   LYS 104           HZ2      LYS 104   3.870 -12.490  -2.630
  232   3HZ   LYS 104           HZ3      LYS 104   5.380 -12.390  -2.000
  233    H    HIS 105           H        HIS 105   1.220 -10.000  -8.220
  234    HD1  HIS 105           HD1      HIS 105  -3.130 -10.630 -10.960
  235    HE2  HIS 105           HE2      HIS 105   0.150 -11.790 -13.010
  236    H    ILE 106           H        ILE 106  -1.900  -6.640  -8.810
  237    H    ILE 107           H        ILE 107  -3.650  -6.260  -4.820
  238    H    VAL 108           H        VAL 108  -7.000  -3.850  -6.190
  239    H    ALA 109           H        ALA 109  -8.500  -1.280  -2.810
  240    H    CYS 110           H        CYS 110 -12.310  -0.830  -5.060
  241    H    GLU 111           H        GLU 111 -12.620   3.560  -5.810
  242    H    GLY 112           H        GLY 112 -16.610   5.310  -6.120
  243    H    ASN 113           H        ASN 113 -16.840   9.220  -7.700
  244   1HD2  ASN 113           HD2      ASN 113 -19.640  11.830  -8.350
  245   2HD2  ASN 113           HD2      ASN 113 -18.930  11.690  -9.940
  246    OH   TYR 115           OH       TYR 115 -16.040   0.370  -8.630
  247    H    TYR 115           H        TYR 115 -13.860   6.440 -11.560
  248    HH   TYR 115           HH       TYR 115 -15.640  -0.530  -8.900
  249    H    VAL 116           H        VAL 116 -12.070   5.720  -7.720
  250    H    VAL 118           H        VAL 118  -9.540   2.720  -3.570
  251    H    HIS 119           H        HIS 119  -8.720   1.570  -1.930
  252    HD1  HIS 119           HD1      HIS 119  -7.650  -0.380   3.130
  253    HE2  HIS 119           HE2      HIS 119  -8.380  -4.080   1.680
  254    H    PHE 120           H        PHE 120  -5.580  -0.080   0.580
  255    H    ASP 121           H        ASP 121  -5.270  -3.860  -1.700
  256    H    ALA 122           H        ALA 122  -4.770  -6.310  -1.940
  257    H    SER 123           H        SER 123  -0.920  -8.190  -1.260
  258    HG   SER 123           HG       SER 123   0.650  -6.050  -3.400
  259    H    VAL 124           H        VAL 124  -0.570  -9.620  -5.470
   
  Start of MODEL          22
 Raw file had 259 H/Q atoms
  Start of MODEL   22
    1   1H    LYS   1           H2       LYS   1  -9.070  17.420   3.550
    2   2H    LYS   1           H3       LYS   1 -10.260  17.580   2.430
    3   3H    LYS   1           H1       LYS   1 -10.380  18.350   3.870
    4   1HZ   LYS   1           HZ1      LYS   1 -12.950  15.380   0.370
    5   2HZ   LYS   1           HZ2      LYS   1 -14.360  14.570   0.530
    6   3HZ   LYS   1           HZ3      LYS   1 -13.990  15.350  -0.880
    7    H    GLU   2           H        GLU   2 -10.040  14.540   5.380
    8    H    THR   3           H        THR   3 -10.230  12.600   2.000
    9    HG1  THR   3           HG1      THR   3 -13.890  10.760  -0.210
   10    H    ALA   4           H        ALA   4 -12.440   8.780   1.410
   11    H    ALA   5           H        ALA   5 -10.660   8.240  -0.820
   12    H    ALA   6           H        ALA   6  -8.390   9.700   0.180
   13    H    LYS   7           H        LYS   7  -7.380   8.240   2.130
   14   1HZ   LYS   7           HZ1      LYS   7  -7.800   2.310   4.740
   15   2HZ   LYS   7           HZ2      LYS   7  -6.260   2.670   5.190
   16   3HZ   LYS   7           HZ3      LYS   7  -7.180   1.690   6.120
   17    H    PHE   8           H        PHE   8  -6.530   5.760   0.880
   18    H    GLU   9           H        GLU   9  -4.450   7.110  -0.800
   19    NH1  ARG  10           NH2      ARG  10  -4.380  10.410   7.180
   20    NH2  ARG  10           NH1      ARG  10  -5.280   8.310   7.080
   21    H    ARG  10           H        ARG  10  -2.660   8.120   1.440
   22    HE   ARG  10           HE       ARG  10  -3.140   7.670   6.080
   23   1HH1  ARG  10           HH2      ARG  10  -3.600  11.020   7.030
   24   2HH1  ARG  10           HH2      ARG  10  -5.210  10.730   7.630
   25   1HH2  ARG  10           HH1      ARG  10  -5.180   7.340   6.890
   26   2HH2  ARG  10           HH1      ARG  10  -6.100   8.660   7.530
   27    H    GLN  11           H        GLN  11  -1.920   5.710   2.920
   28   1HE2  GLN  11           HE2      GLN  11  -3.460   0.260   5.300
   29   2HE2  GLN  11           HE2      GLN  11  -1.820   0.740   4.970
   30    H    HIS  12           H        HIS  12  -0.760   4.460   0.680
   31    HD1  HIS  12           HD1      HIS  12  -0.100   0.030   0.690
   32    HE2  HIS  12           HE2      HIS  12  -3.610   0.820   2.480
   33    H    MET  13           H        MET  13   0.570   5.610  -1.120
   34    H    ASP  14           H        ASP  14   3.670   4.840  -4.370
   35    H    SER  15           H        SER  15   4.540   7.080  -5.230
   36    HG   SER  15           HG       SER  15   5.890   8.080  -9.110
   37    H    SER  16           H        SER  16   7.180   8.420  -5.260
   38    HG   SER  16           HG       SER  16   9.300   8.130  -3.290
   39    H    THR  17           H        THR  17   9.050   6.420  -5.390
   40    HG1  THR  17           HG1      THR  17  10.550   4.640  -2.780
   41    H    SER  18           H        SER  18  11.920   4.090  -7.770
   42    HG   SER  18           HG       SER  18  13.430   2.120  -9.910
   43    H    ALA  19           H        ALA  19  11.830   1.990  -6.170
   44    H    ALA  20           H        ALA  20  11.320  -1.340  -3.570
   45    H    SER  21           H        SER  21  14.690   0.900  -2.210
   46    HG   SER  21           HG       SER  21  16.950   2.860  -1.040
   47    H    SER  22           H        SER  22  15.710  -0.990  -0.250
   48    HG   SER  22           HG       SER  22  17.190   0.660   2.300
   49    H    SER  23           H        SER  23  17.790  -3.940   2.130
   50    HG   SER  23           HG       SER  23  18.320  -4.740   5.320
   51    H    ASN  24           H        ASN  24  16.550  -2.260   4.030
   52   1HD2  ASN  24           HD2      ASN  24  15.680  -4.180   8.670
   53   2HD2  ASN  24           HD2      ASN  24  14.590  -2.960   8.110
   54    OH   TYR  25           OH       TYR  25  10.140   3.920  -1.190
   55    H    TYR  25           H        TYR  25  14.640  -1.110   3.130
   56    HH   TYR  25           HH       TYR  25   9.170   3.650  -1.100
   57    H    CYS  26           H        CYS  26  11.760  -0.770   3.970
   58    H    ASN  27           H        ASN  27  12.250   0.370   6.650
   59   1HD2  ASN  27           HD2      ASN  27  14.750  -1.500   9.930
   60   2HD2  ASN  27           HD2      ASN  27  14.680   0.140  10.490
   61    H    GLN  28           H        GLN  28  12.980   3.210   6.980
   62   1HE2  GLN  28           HE2      GLN  28  13.890   6.690  10.280
   63   2HE2  GLN  28           HE2      GLN  28  12.780   7.220   9.040
   64    H    MET  29           H        MET  29  11.040   4.060   5.220
   65    H    MET  30           H        MET  30   8.520   3.450   6.130
   66    H    LYS  31           H        LYS  31   8.440   5.470   8.200
   67   1HZ   LYS  31           HZ2      LYS  31  12.550   5.170  10.870
   68   2HZ   LYS  31           HZ3      LYS  31  12.990   5.730  12.370
   69   3HZ   LYS  31           HZ1      LYS  31  12.660   4.150  12.140
   70    H    SER  32           H        SER  32   8.470   7.920   6.940
   71    HG   SER  32           HG       SER  32  10.070  10.020   5.570
   72    NH1  ARG  33           NH2      ARG  33   6.090  10.290   1.070
   73    NH2  ARG  33           NH1      ARG  33   6.050   8.830  -0.680
   74    H    ARG  33           H        ARG  33   5.820   8.070   5.520
   75    HE   ARG  33           HE       ARG  33   4.300   7.650   0.620
   76   1HH1  ARG  33           HH2      ARG  33   5.720  10.600   1.940
   77   2HH1  ARG  33           HH2      ARG  33   6.820  10.790   0.620
   78   1HH2  ARG  33           HH1      ARG  33   5.660   8.040  -1.150
   79   2HH2  ARG  33           HH1      ARG  33   6.780   9.360  -1.110
   80    H    ASN  34           H        ASN  34   4.500   9.910   7.790
   81   1HD2  ASN  34           HD2      ASN  34   2.200  13.200  11.140
   82   2HD2  ASN  34           HD2      ASN  34   1.380  11.670  11.350
   83    H    LEU  35           H        LEU  35   2.960   7.250   8.250
   84    H    THR  36           H        THR  36   4.360   6.000  10.510
   85    HG1  THR  36           HG1      THR  36   7.420   5.080  11.900
   86    H    LYS  37           H        LYS  37   3.790   7.670  12.420
   87   1HZ   LYS  37           HZ3      LYS  37   5.530  12.750   9.490
   88   2HZ   LYS  37           HZ1      LYS  37   6.440  13.630  10.530
   89   3HZ   LYS  37           HZ2      LYS  37   7.140  12.940   9.220
   90    H    ASP  38           H        ASP  38   2.770   7.040  14.830
   91    NH1  ARG  39           NH2      ARG  39  -1.470   0.170  20.240
   92    NH2  ARG  39           NH1      ARG  39   0.520  -0.910  20.380
   93    H    ARG  39           H        ARG  39   1.590   5.200  15.840
   94    HE   ARG  39           HE       ARG  39   1.430   1.250  19.420
   95   1HH1  ARG  39           HH2      ARG  39  -1.970   0.990  19.970
   96   2HH1  ARG  39           HH2      ARG  39  -1.930  -0.620  20.610
   97   1HH2  ARG  39           HH1      ARG  39   1.500  -0.990  20.190
   98   2HH2  ARG  39           HH1      ARG  39   0.020  -1.680  20.770
   99    H    CYS  40           H        CYS  40   4.100   1.810  16.860
  100    H    LYS  41           H        LYS  41   3.230   1.270  12.580
  101   1HZ   LYS  41           HZ2      LYS  41  -1.240   2.490   8.220
  102   2HZ   LYS  41           HZ3      LYS  41   0.000   2.550   7.150
  103   3HZ   LYS  41           HZ1      LYS  41  -1.060   1.320   7.110
  104    H    VAL  43           H        VAL  43   0.870  -3.540  10.230
  105    H    ASN  44           H        ASN  44   2.820  -3.630   6.440
  106   1HD2  ASN  44           HD2      ASN  44   1.890   1.610   3.580
  107   2HD2  ASN  44           HD2      ASN  44   3.210   0.920   4.460
  108    H    THR  45           H        THR  45   1.090  -1.360   3.120
  109    HG1  THR  45           HG1      THR  45   1.740  -4.530   2.450
  110    H    PHE  46           H        PHE  46   4.540  -1.110   0.750
  111    H    VAL  47           H        VAL  47   3.120   1.770  -2.260
  112    H    HIS  48           H        HIS  48   4.980   0.310  -5.750
  113    HD1  HIS  48           HD1      HIS  48   8.780   3.280  -4.870
  114    HE2  HIS  48           HE2      HIS  48   9.040  -0.050  -2.590
  115    H    GLU  49           H        GLU  49   3.620   3.220  -6.910
  116    H    SER  50           H        SER  50   2.850   5.530 -10.550
  117    HG   SER  50           HG       SER  50   1.450   5.980 -12.160
  118    H    LEU  51           H        LEU  51  -0.480   8.050  -8.400
  119    H    ALA  52           H        ALA  52  -2.080   8.130 -10.910
  120    H    ASP  53           H        ASP  53  -1.010   5.480 -12.090
  121    H    VAL  54           H        VAL  54  -2.220   3.770 -10.330
  122    H    GLN  55           H        GLN  55  -4.660   4.250 -10.400
  123   1HE2  GLN  55           HE2      GLN  55  -8.320   8.940 -10.940
  124   2HE2  GLN  55           HE2      GLN  55  -8.920   7.350 -10.540
  125    H    ALA  56           H        ALA  56  -5.220   2.930 -12.800
  126    H    VAL  57           H        VAL  57  -5.990   0.430 -11.530
  127    H    CYS  58           H        CYS  58  -8.090   0.060 -10.560
  128    H    SER  59           H        SER  59  -9.470  -0.580 -13.080
  129    HG   SER  59           HG       SER  59  -9.470   0.020 -16.100
  130    H    GLN  60           H        GLN  60  -9.660  -3.330 -13.290
  131   1HE2  GLN  60           HE2      GLN  60  -3.850  -2.750 -15.640
  132   2HE2  GLN  60           HE2      GLN  60  -5.370  -1.870 -15.520
  133    H    LYS  61           H        LYS  61  -9.270  -6.250 -12.900
  134   1HZ   LYS  61           HZ1      LYS  61  -7.990 -12.960 -12.770
  135   2HZ   LYS  61           HZ2      LYS  61  -7.850 -12.440 -11.220
  136   3HZ   LYS  61           HZ3      LYS  61  -9.140 -13.360 -11.680
  137    H    ASN  62           H        ASN  62 -13.200  -8.160 -12.390
  138   1HD2  ASN  62           HD2      ASN  62 -15.860  -6.810  -7.380
  139   2HD2  ASN  62           HD2      ASN  62 -14.440  -6.210  -8.190
  140    H    VAL  63           H        VAL  63 -13.020  -7.760  -7.870
  141    H    ALA  64           H        ALA  64 -12.710 -11.170  -5.150
  142    H    CYS  65           H        CYS  65 -13.540  -8.150  -1.940
  143    H    LYS  66           H        LYS  66  -9.800  -8.630   0.760
  144   1HZ   LYS  66           HZ3      LYS  66  -7.870 -11.310  -1.770
  145   2HZ   LYS  66           HZ1      LYS  66  -6.280 -10.950  -1.780
  146   3HZ   LYS  66           HZ2      LYS  66  -6.770 -12.500  -2.010
  147    H    ASN  67           H        ASN  67 -12.070  -8.440   2.690
  148   1HD2  ASN  67           HD2      ASN  67 -14.270  -4.820   3.550
  149   2HD2  ASN  67           HD2      ASN  67 -14.150  -5.450   5.140
  150    H    GLY  68           H        GLY  68 -13.880  -9.790   1.790
  151    H    GLN  69           H        GLN  69 -15.150  -7.690   1.370
  152   1HE2  GLN  69           HE2      GLN  69 -15.810  -1.620   1.520
  153   2HE2  GLN  69           HE2      GLN  69 -16.600  -2.510   0.230
  154    H    THR  70           H        THR  70 -18.160  -6.670  -1.910
  155    HG1  THR  70           HG1      THR  70 -20.290  -6.170  -4.320
  156    H    ASN  71           H        ASN  71 -16.230  -4.950  -2.980
  157   1HD2  ASN  71           HD2      ASN  71 -15.200  -0.600  -1.700
  158   2HD2  ASN  71           HD2      ASN  71 -15.480  -0.300  -3.400
  159    H    CYS  72           H        CYS  72 -14.020  -5.800  -5.320
  160    OH   TYR  73           OH       TYR  73 -15.780  -2.150  -9.030
  161    H    TYR  73           H        TYR  73 -10.010  -4.540  -6.420
  162    HH   TYR  73           HH       TYR  73 -16.370  -2.770  -9.550
  163    H    GLN  74           H        GLN  74  -9.070  -6.970  -9.830
  164   1HE2  GLN  74           HE2      GLN  74  -5.150 -12.050 -10.700
  165   2HE2  GLN  74           HE2      GLN  74  -5.040 -10.420 -11.330
  166    H    SER  75           H        SER  75  -4.720  -6.180 -10.210
  167    HG   SER  75           HG       SER  75  -1.600  -5.850 -11.680
  168    OH   TYR  76           OH       TYR  76  -9.970  -8.650 -17.180
  169    H    TYR  76           H        TYR  76  -4.660  -6.570 -14.810
  170    HH   TYR  76           HH       TYR  76 -10.350  -7.720 -17.100
  171    H    SER  77           H        SER  77  -1.960  -6.990 -14.440
  172    HG   SER  77           HG       SER  77  -0.100  -6.430 -16.990
  173    H    THR  78           H        THR  78   2.280  -7.640 -13.910
  174    HG1  THR  78           HG1      THR  78   4.740  -6.450 -12.960
  175    H    MET  79           H        MET  79   2.480  -5.770  -9.790
  176    H    SER  80           H        SER  80   5.060  -2.170  -9.610
  177    HG   SER  80           HG       SER  80   8.870  -0.930  -7.540
  178    H    ILE  81           H        ILE  81   5.900  -4.420  -5.880
  179    H    THR  82           H        THR  82   5.480  -2.130  -2.190
  180    HG1  THR  82           HG1      THR  82   8.760  -2.540  -2.680
  181    H    ASP  83           H        ASP  83   6.840  -5.160   0.000
  182    H    CYS  84           H        CYS  84   4.850  -3.910   3.850
  183    NH1  ARG  85           NH2      ARG  85   4.270 -12.060   8.850
  184    NH2  ARG  85           NH1      ARG  85   3.750 -11.580  11.030
  185    H    ARG  85           H        ARG  85   7.590  -5.430   6.580
  186    HE   ARG  85           HE       ARG  85   4.750  -9.360  10.500
  187   1HH1  ARG  85           HH2      ARG  85   4.650 -11.740   7.990
  188   2HH1  ARG  85           HH2      ARG  85   3.900 -12.980   8.940
  189   1HH2  ARG  85           HH1      ARG  85   3.760 -10.950  11.800
  190   2HH2  ARG  85           HH1      ARG  85   3.360 -12.490  11.110
  191    H    GLU  86           H        GLU  86   5.480  -5.410  10.460
  192    H    THR  87           H        THR  87   9.520  -4.790  12.540
  193    HG1  THR  87           HG1      THR  87  11.480  -4.340  13.180
  194    H    GLY  88           H        GLY  88  11.110  -8.290  15.200
  195    H    SER  89           H        SER  89  12.490  -5.940  15.890
  196    HG   SER  89           HG       SER  89  15.170  -2.830  17.040
  197    H    SER  90           H        SER  90  10.770  -3.780  17.360
  198    HG   SER  90           HG       SER  90   8.060  -0.820  15.600
  199    H    LYS  91           H        LYS  91  11.700   0.210  17.590
  200   1HZ   LYS  91           HZ2      LYS  91  14.030   0.130  17.010
  201   2HZ   LYS  91           HZ3      LYS  91  14.970   1.410  17.400
  202   3HZ   LYS  91           HZ1      LYS  91  15.610   0.130  16.630
  203    OH   TYR  92           OH       TYR  92   5.120   9.060  18.830
  204    H    TYR  92           H        TYR  92   8.490   1.780  19.090
  205    HH   TYR  92           HH       TYR  92   4.770   9.270  17.910
  206    H    ASN  94           H        ASN  94  11.490   4.480  17.770
  207   1HD2  ASN  94           HD2      ASN  94  16.700   3.440  15.180
  208   2HD2  ASN  94           HD2      ASN  94  16.260   4.070  16.750
  209    H    CYS  95           H        CYS  95  10.640   3.680  14.060
  210    H    ALA  96           H        ALA  96  10.650  -0.770  14.060
  211    OH   TYR  97           OH       TYR  97   5.570  -0.290  11.720
  212    H    TYR  97           H        TYR  97  12.110  -1.900  10.060
  213    HH   TYR  97           HH       TYR  97   4.740  -0.870  11.560
  214    H    LYS  98           H        LYS  98   9.920  -5.530   8.660
  215   1HZ   LYS  98           HZ3      LYS  98   8.010 -10.130   9.790
  216   2HZ   LYS  98           HZ1      LYS  98   8.930  -9.990  11.130
  217   3HZ   LYS  98           HZ2      LYS  98   8.670  -8.680  10.200
  218    H    THR  99           H        THR  99  12.520  -5.680   5.060
  219    HG1  THR  99           HG1      THR  99  12.510  -3.260   5.180
  220    H    THR 100           H        THR 100   9.230  -5.570   2.110
  221    HG1  THR 100           HG1      THR 100  10.060  -8.470   2.340
  222    H    GLN 101           H        GLN 101  11.550  -6.560  -1.350
  223   1HE2  GLN 101           HE2      GLN 101   8.860  -3.580  -6.360
  224   2HE2  GLN 101           HE2      GLN 101   9.880  -4.990  -6.480
  225    H    ALA 102           H        ALA 102   8.270  -5.880  -4.100
  226    H    ASN 103           H        ASN 103   8.220  -8.190  -7.720
  227   1HD2  ASN 103           HD2      ASN 103   8.440  -9.750 -11.450
  228   2HD2  ASN 103           HD2      ASN 103   6.870  -9.000 -11.520
  229    H    LYS 104           H        LYS 104   4.120  -6.980  -7.920
  230   1HZ   LYS 104           HZ1      LYS 104   3.670 -12.490  -4.190
  231   2HZ   LYS 104           HZ2      LYS 104   5.110 -13.140  -3.830
  232   3HZ   LYS 104           HZ3      LYS 104   4.890 -11.520  -3.710
  233    H    HIS 105           H        HIS 105   0.860  -9.930  -8.500
  234    HD1  HIS 105           HD1      HIS 105  -3.350 -10.540 -11.310
  235    HE2  HIS 105           HE2      HIS 105  -0.040 -11.560 -13.360
  236    H    ILE 106           H        ILE 106  -2.140  -6.440  -8.970
  237    H    ILE 107           H        ILE 107  -3.810  -6.300  -4.900
  238    H    VAL 108           H        VAL 108  -7.050  -3.910  -6.190
  239    H    ALA 109           H        ALA 109  -8.650  -1.590  -2.700
  240    H    CYS 110           H        CYS 110 -12.560  -0.990  -4.810
  241    H    GLU 111           H        GLU 111 -12.880   3.400  -5.580
  242    H    GLY 112           H        GLY 112 -16.870   5.190  -5.970
  243    H    ASN 113           H        ASN 113 -16.220   9.310  -7.390
  244   1HD2  ASN 113           HD2      ASN 113 -19.110  11.600 -11.860
  245   2HD2  ASN 113           HD2      ASN 113 -18.950  11.670 -10.120
  246    OH   TYR 115           OH       TYR 115 -16.220   0.440  -8.310
  247    H    TYR 115           H        TYR 115 -13.740   6.850 -11.530
  248    HH   TYR 115           HH       TYR 115 -15.870  -0.480  -8.590
  249    H    VAL 116           H        VAL 116 -12.350   5.510  -7.590
  250    H    VAL 118           H        VAL 118  -9.870   2.510  -3.300
  251    H    HIS 119           H        HIS 119  -8.810   1.390  -1.780
  252    HD1  HIS 119           HD1      HIS 119  -8.070  -0.530   3.380
  253    HE2  HIS 119           HE2      HIS 119  -8.670  -4.280   2.000
  254    H    PHE 120           H        PHE 120  -5.610  -0.140   0.630
  255    H    ASP 121           H        ASP 121  -5.340  -4.070  -1.510
  256    H    ALA 122           H        ALA 122  -4.920  -6.430  -1.840
  257    H    SER 123           H        SER 123  -1.100  -8.540  -1.520
  258    HG   SER 123           HG       SER 123   0.710  -6.100  -4.050
  259    H    VAL 124           H        VAL 124  -0.930  -9.840  -5.730
   
  Start of MODEL          23
 Raw file had 259 H/Q atoms
  Start of MODEL   23
    1   1H    LYS   1           H3       LYS   1 -10.400  16.310   4.480
    2   2H    LYS   1           H1       LYS   1 -10.680  16.710   6.090
    3   3H    LYS   1           H2       LYS   1  -9.110  16.590   5.510
    4   1HZ   LYS   1           HZ2      LYS   1  -9.910  14.260   9.240
    5   2HZ   LYS   1           HZ3      LYS   1  -9.020  13.020   9.890
    6   3HZ   LYS   1           HZ1      LYS   1  -8.560  13.770   8.480
    7    H    GLU   2           H        GLU   2  -8.450  13.510   6.220
    8    H    THR   3           H        THR   3  -9.540  12.080   2.820
    9    HG1  THR   3           HG1      THR   3 -11.260  12.330   0.450
   10    H    ALA   4           H        ALA   4 -11.760   8.260   2.540
   11    H    ALA   5           H        ALA   5 -10.480   8.270  -0.540
   12    H    ALA   6           H        ALA   6  -8.240  10.000  -0.050
   13    H    LYS   7           H        LYS   7  -6.990   8.530   1.940
   14   1HZ   LYS   7           HZ1      LYS   7  -8.730   7.670   6.410
   15   2HZ   LYS   7           HZ2      LYS   7  -7.990   8.020   7.860
   16   3HZ   LYS   7           HZ3      LYS   7  -7.250   8.360   6.410
   17    H    PHE   8           H        PHE   8  -6.230   5.960   0.700
   18    H    GLU   9           H        GLU   9  -4.220   7.260  -1.220
   19    NH1  ARG  10           NH2      ARG  10  -0.710  10.520   7.490
   20    NH2  ARG  10           NH1      ARG  10  -2.890  10.040   7.910
   21    H    ARG  10           H        ARG  10  -2.370   8.290   0.920
   22    HE   ARG  10           HE       ARG  10  -2.720   8.600   5.880
   23   1HH1  ARG  10           HH2      ARG  10   0.140  10.280   7.010
   24   2HH1  ARG  10           HH2      ARG  10  -0.710  11.210   8.210
   25   1HH2  ARG  10           HH1      ARG  10  -3.720   9.530   7.700
   26   2HH2  ARG  10           HH1      ARG  10  -2.880  10.710   8.650
   27    H    GLN  11           H        GLN  11  -1.620   6.080   2.430
   28   1HE2  GLN  11           HE2      GLN  11  -3.480   0.890   4.790
   29   2HE2  GLN  11           HE2      GLN  11  -1.800   1.370   4.760
   30    H    HIS  12           H        HIS  12  -0.450   4.680   0.350
   31    HD1  HIS  12           HD1      HIS  12   0.250   0.340   0.480
   32    HE2  HIS  12           HE2      HIS  12  -3.180   1.320   2.240
   33    H    MET  13           H        MET  13   0.650   5.670  -1.660
   34    H    ASP  14           H        ASP  14   3.940   4.850  -4.640
   35    H    SER  15           H        SER  15   4.610   7.290  -5.740
   36    HG   SER  15           HG       SER  15   3.140   6.700  -7.890
   37    H    SER  16           H        SER  16   7.190   8.710  -6.260
   38    HG   SER  16           HG       SER  16  11.090  10.290  -6.800
   39    H    THR  17           H        THR  17   9.110   6.750  -5.910
   40    HG1  THR  17           HG1      THR  17  10.290   4.950  -3.110
   41    H    SER  18           H        SER  18  11.890   4.410  -8.190
   42    HG   SER  18           HG       SER  18  10.300   4.070 -10.800
   43    H    ALA  19           H        ALA  19  11.770   2.170  -6.460
   44    H    ALA  20           H        ALA  20  11.260  -1.040  -3.760
   45    H    SER  21           H        SER  21  14.680   1.310  -2.670
   46    HG   SER  21           HG       SER  21  17.490   2.760  -1.800
   47    H    SER  22           H        SER  22  15.700  -0.610  -0.860
   48    HG   SER  22           HG       SER  22  18.650   0.240   2.960
   49    H    SER  23           H        SER  23  18.020  -3.280   1.420
   50    HG   SER  23           HG       SER  23  19.130  -5.210   3.800
   51    H    ASN  24           H        ASN  24  16.820  -1.770   3.440
   52   1HD2  ASN  24           HD2      ASN  24  15.470  -0.810   8.950
   53   2HD2  ASN  24           HD2      ASN  24  15.620  -2.140   7.850
   54    OH   TYR  25           OH       TYR  25   9.740   4.130  -1.240
   55    H    TYR  25           H        TYR  25  14.720  -0.790   2.730
   56    HH   TYR  25           HH       TYR  25   8.770   3.880  -1.060
   57    H    CYS  26           H        CYS  26  11.770  -0.580   3.760
   58    H    ASN  27           H        ASN  27  12.310   0.570   6.370
   59   1HD2  ASN  27           HD2      ASN  27  13.890   0.060  11.290
   60   2HD2  ASN  27           HD2      ASN  27  14.290   1.620  10.640
   61    H    GLN  28           H        GLN  28  13.090   3.420   6.440
   62   1HE2  GLN  28           HE2      GLN  28  16.400   2.710   7.440
   63   2HE2  GLN  28           HE2      GLN  28  16.250   4.270   8.220
   64    H    MET  29           H        MET  29  11.050   4.280   4.860
   65    H    MET  30           H        MET  30   8.550   3.570   5.890
   66    H    LYS  31           H        LYS  31   8.740   5.360   8.070
   67   1HZ   LYS  31           HZ2      LYS  31   8.430   6.170  14.630
   68   2HZ   LYS  31           HZ3      LYS  31   8.510   7.520  15.550
   69   3HZ   LYS  31           HZ1      LYS  31   7.220   7.260  14.570
   70    H    SER  32           H        SER  32   8.880   8.050   7.270
   71    HG   SER  32           HG       SER  32   9.160   9.020   4.150
   72    NH1  ARG  33           NH2      ARG  33   3.270   8.060   0.070
   73    NH2  ARG  33           NH1      ARG  33   4.950   9.280  -0.830
   74    H    ARG  33           H        ARG  33   6.360   8.260   5.920
   75    HE   ARG  33           HE       ARG  33   5.430   9.940   1.520
   76   1HH1  ARG  33           HH2      ARG  33   2.720   7.750   0.850
   77   2HH1  ARG  33           HH2      ARG  33   3.080   7.720  -0.860
   78   1HH2  ARG  33           HH1      ARG  33   5.630  10.010  -0.780
   79   2HH2  ARG  33           HH1      ARG  33   4.710   8.840  -1.690
   80    H    ASN  34           H        ASN  34   4.840   9.810   8.240
   81   1HD2  ASN  34           HD2      ASN  34  -0.720  10.220  11.050
   82   2HD2  ASN  34           HD2      ASN  34  -0.340   9.760   9.400
   83    H    LEU  35           H        LEU  35   3.140   7.230   8.310
   84    H    THR  36           H        THR  36   4.210   6.060  10.730
   85    HG1  THR  36           HG1      THR  36   7.110   5.650  11.810
   86    H    LYS  37           H        LYS  37   3.350   7.530  12.580
   87   1HZ   LYS  37           HZ2      LYS  37   8.450  10.920  14.190
   88   2HZ   LYS  37           HZ3      LYS  37   8.880  12.110  13.130
   89   3HZ   LYS  37           HZ1      LYS  37   7.830  12.420  14.340
   90    H    ASP  38           H        ASP  38   2.340   6.730  15.150
   91    NH1  ARG  39           NH2      ARG  39  -1.790   0.010  15.730
   92    NH2  ARG  39           NH1      ARG  39  -3.780   1.080  16.080
   93    H    ARG  39           H        ARG  39   1.510   4.810  16.040
   94    HE   ARG  39           HE       ARG  39  -2.540   2.340  17.810
   95   1HH1  ARG  39           HH2      ARG  39  -0.830  -0.110  15.970
   96   2HH1  ARG  39           HH2      ARG  39  -2.210  -0.540  15.010
   97   1HH2  ARG  39           HH1      ARG  39  -4.350   1.680  16.640
   98   2HH2  ARG  39           HH1      ARG  39  -4.170   0.560  15.330
   99    H    CYS  40           H        CYS  40   4.200   1.580  16.830
  100    H    LYS  41           H        LYS  41   3.350   1.190  12.500
  101   1HZ   LYS  41           HZ2      LYS  41  -2.310   1.340   8.960
  102   2HZ   LYS  41           HZ3      LYS  41  -1.600   1.780   7.540
  103   3HZ   LYS  41           HZ1      LYS  41  -2.680   0.550   7.570
  104    H    VAL  43           H        VAL  43   0.760  -3.450   9.870
  105    H    ASN  44           H        ASN  44   2.790  -3.460   6.220
  106   1HD2  ASN  44           HD2      ASN  44   2.010   1.770   3.440
  107   2HD2  ASN  44           HD2      ASN  44   3.270   1.050   4.380
  108    H    THR  45           H        THR  45   1.210  -1.110   2.930
  109    HG1  THR  45           HG1      THR  45   1.310  -4.480   2.030
  110    H    PHE  46           H        PHE  46   4.680  -1.010   0.580
  111    H    VAL  47           H        VAL  47   3.320   1.930  -2.420
  112    H    HIS  48           H        HIS  48   5.130   0.410  -5.840
  113    HD1  HIS  48           HD1      HIS  48   8.880   3.440  -4.960
  114    HE2  HIS  48           HE2      HIS  48   9.120   0.210  -2.540
  115    H    GLU  49           H        GLU  49   3.660   2.970  -7.340
  116    H    SER  50           H        SER  50   3.170   4.840 -11.360
  117    HG   SER  50           HG       SER  50   1.760   5.040 -12.990
  118    H    LEU  51           H        LEU  51   0.000   7.880  -9.660
  119    H    ALA  52           H        ALA  52  -1.590   7.610 -12.060
  120    H    ASP  53           H        ASP  53  -0.730   4.800 -12.850
  121    H    VAL  54           H        VAL  54  -1.920   3.440 -10.880
  122    H    GLN  55           H        GLN  55  -4.370   4.020 -10.850
  123   1HE2  GLN  55           HE2      GLN  55  -8.060   8.700 -11.660
  124   2HE2  GLN  55           HE2      GLN  55  -8.620   7.290 -10.810
  125    H    ALA  56           H        ALA  56  -5.020   2.560 -13.130
  126    H    VAL  57           H        VAL  57  -5.830   0.140 -11.640
  127    H    CYS  58           H        CYS  58  -8.090  -0.060 -10.940
  128    H    SER  59           H        SER  59  -9.410  -1.020 -13.280
  129    HG   SER  59           HG       SER  59  -9.300  -0.460 -16.380
  130    H    GLN  60           H        GLN  60  -9.720  -3.640 -13.260
  131   1HE2  GLN  60           HE2      GLN  60  -3.970  -3.450 -15.250
  132   2HE2  GLN  60           HE2      GLN  60  -5.460  -2.530 -15.340
  133    H    LYS  61           H        LYS  61  -8.950  -6.850 -12.780
  134   1HZ   LYS  61           HZ1      LYS  61 -12.360 -13.240 -13.450
  135   2HZ   LYS  61           HZ2      LYS  61 -12.420 -12.450 -12.020
  136   3HZ   LYS  61           HZ3      LYS  61 -13.700 -12.400 -13.050
  137    H    ASN  62           H        ASN  62 -13.060  -8.310 -12.160
  138   1HD2  ASN  62           HD2      ASN  62 -15.960  -6.950  -7.320
  139   2HD2  ASN  62           HD2      ASN  62 -14.520  -6.350  -8.060
  140    H    VAL  63           H        VAL  63 -13.010  -7.800  -7.620
  141    H    ALA  64           H        ALA  64 -12.740 -11.000  -4.640
  142    H    CYS  65           H        CYS  65 -13.930  -7.890  -1.640
  143    H    LYS  66           H        LYS  66 -10.240  -8.020   1.190
  144   1HZ   LYS  66           HZ3      LYS  66  -5.600  -9.170   5.200
  145   2HZ   LYS  66           HZ1      LYS  66  -5.040 -10.540   4.500
  146   3HZ   LYS  66           HZ2      LYS  66  -4.240  -9.130   4.270
  147    H    ASN  67           H        ASN  67 -12.550  -7.770   3.290
  148   1HD2  ASN  67           HD2      ASN  67 -15.340  -4.470   3.690
  149   2HD2  ASN  67           HD2      ASN  67 -15.530  -5.160   5.260
  150    H    GLY  68           H        GLY  68 -14.330  -9.360   2.100
  151    H    GLN  69           H        GLN  69 -15.710  -7.440   1.260
  152   1HE2  GLN  69           HE2      GLN  69 -16.390  -1.350   1.170
  153   2HE2  GLN  69           HE2      GLN  69 -16.330  -2.210  -0.360
  154    H    THR  70           H        THR  70 -18.540  -6.320  -2.160
  155    HG1  THR  70           HG1      THR  70 -20.340  -6.090  -4.840
  156    H    ASN  71           H        ASN  71 -16.250  -4.790  -3.020
  157   1HD2  ASN  71           HD2      ASN  71 -15.160  -0.390  -2.160
  158   2HD2  ASN  71           HD2      ASN  71 -15.280  -0.260  -3.890
  159    H    CYS  72           H        CYS  72 -13.990  -5.750  -5.220
  160    OH   TYR  73           OH       TYR  73 -15.610  -2.180  -9.480
  161    H    TYR  73           H        TYR  73  -9.960  -4.630  -6.330
  162    HH   TYR  73           HH       TYR  73 -16.030  -2.590 -10.300
  163    H    GLN  74           H        GLN  74  -9.050  -7.280  -9.550
  164   1HE2  GLN  74           HE2      GLN  74  -4.980 -12.420 -10.190
  165   2HE2  GLN  74           HE2      GLN  74  -4.760 -10.820 -10.880
  166    H    SER  75           H        SER  75  -4.690  -6.380  -9.930
  167    HG   SER  75           HG       SER  75  -1.490  -6.190 -11.610
  168    OH   TYR  76           OH       TYR  76  -9.840  -9.490 -16.880
  169    H    TYR  76           H        TYR  76  -4.610  -7.080 -14.460
  170    HH   TYR  76           HH       TYR  76 -10.440  -9.220 -16.130
  171    H    SER  77           H        SER  77  -1.990  -7.460 -14.030
  172    HG   SER  77           HG       SER  77   1.690  -8.550 -16.630
  173    H    THR  78           H        THR  78   2.360  -7.840 -13.750
  174    HG1  THR  78           HG1      THR  78   5.570  -8.220 -12.700
  175    H    MET  79           H        MET  79   2.660  -5.980  -9.630
  176    H    SER  80           H        SER  80   5.200  -2.350  -9.660
  177    HG   SER  80           HG       SER  80   9.149  -1.091  -8.085
  178    H    ILE  81           H        ILE  81   6.040  -4.400  -5.930
  179    H    THR  82           H        THR  82   5.660  -2.050  -2.270
  180    HG1  THR  82           HG1      THR  82   8.720  -2.240  -2.860
  181    H    ASP  83           H        ASP  83   6.990  -5.080  -0.060
  182    H    CYS  84           H        CYS  84   4.950  -3.640   3.670
  183    NH1  ARG  85           NH2      ARG  85   3.210  -7.920  11.070
  184    NH2  ARG  85           NH1      ARG  85   3.340 -10.160  11.410
  185    H    ARG  85           H        ARG  85   7.590  -5.400   6.260
  186    HE   ARG  85           HE       ARG  85   4.050 -10.290   9.070
  187   1HH1  ARG  85           HH2      ARG  85   3.240  -7.130  10.460
  188   2HH1  ARG  85           HH2      ARG  85   2.930  -7.810  12.020
  189   1HH2  ARG  85           HH1      ARG  85   3.490 -11.080  11.070
  190   2HH2  ARG  85           HH1      ARG  85   3.050 -10.000  12.360
  191    H    GLU  86           H        GLU  86   5.370  -5.460  10.010
  192    H    THR  87           H        THR  87   9.320  -4.920  12.250
  193    HG1  THR  87           HG1      THR  87  11.170  -4.390  13.050
  194    H    GLY  88           H        GLY  88  10.670  -8.650  14.770
  195    H    SER  89           H        SER  89  12.110  -6.670  16.150
  196    HG   SER  89           HG       SER  89  13.840  -4.820  15.290
  197    H    SER  90           H        SER  90   9.980  -4.570  16.970
  198    HG   SER  90           HG       SER  90   7.760  -1.540  15.010
  199    H    LYS  91           H        LYS  91  10.550  -0.770  17.990
  200   1HZ   LYS  91           HZ2      LYS  91  12.760   1.630  22.400
  201   2HZ   LYS  91           HZ3      LYS  91  11.390   2.000  21.590
  202   3HZ   LYS  91           HZ1      LYS  91  11.590   2.520  23.110
  203    OH   TYR  92           OH       TYR  92   5.200   9.220  18.670
  204    H    TYR  92           H        TYR  92   7.360   1.580  20.030
  205    HH   TYR  92           HH       TYR  92   4.620   9.280  17.840
  206    H    ASN  94           H        ASN  94  11.210   3.540  18.300
  207   1HD2  ASN  94           HD2      ASN  94  13.370   0.150  19.310
  208   2HD2  ASN  94           HD2      ASN  94  13.810   0.310  17.630
  209    H    CYS  95           H        CYS  95  10.300   3.230  14.890
  210    H    ALA  96           H        ALA  96  10.180  -1.130  13.720
  211    OH   TYR  97           OH       TYR  97   5.640  -0.550  11.930
  212    H    TYR  97           H        TYR  97  11.920  -1.770   9.850
  213    HH   TYR  97           HH       TYR  97   4.820  -1.130  11.780
  214    H    LYS  98           H        LYS  98   9.780  -5.360   8.470
  215   1HZ   LYS  98           HZ3      LYS  98   9.490 -11.130   5.230
  216   2HZ   LYS  98           HZ1      LYS  98  10.700 -10.400   4.430
  217   3HZ   LYS  98           HZ2      LYS  98  10.670 -12.030   4.530
  218    H    THR  99           H        THR  99  12.490  -5.430   5.080
  219    HG1  THR  99           HG1      THR  99  12.650  -3.070   5.200
  220    H    THR 100           H        THR 100   9.390  -5.340   2.010
  221    HG1  THR 100           HG1      THR 100   9.830  -7.910   2.670
  222    H    GLN 101           H        GLN 101  11.760  -6.040  -1.250
  223   1HE2  GLN 101           HE2      GLN 101   8.630  -3.990  -6.130
  224   2HE2  GLN 101           HE2      GLN 101   9.980  -5.070  -6.360
  225    H    ALA 102           H        ALA 102   8.360  -5.880  -3.860
  226    H    ASN 103           H        ASN 103   8.220  -8.470  -7.360
  227   1HD2  ASN 103           HD2      ASN 103   8.330  -4.500 -10.740
  228   2HD2  ASN 103           HD2      ASN 103   7.030  -5.560 -11.200
  229    H    LYS 104           H        LYS 104   4.270  -7.080  -7.690
  230   1HZ   LYS 104           HZ3      LYS 104   4.170 -11.060  -1.790
  231   2HZ   LYS 104           HZ1      LYS 104   3.230 -12.240  -2.430
  232   3HZ   LYS 104           HZ2      LYS 104   4.770 -12.590  -1.980
  233    H    HIS 105           H        HIS 105   1.020 -10.030  -8.030
  234    HD1  HIS 105           HD1      HIS 105  -3.250 -10.940 -10.680
  235    HE2  HIS 105           HE2      HIS 105  -0.030 -11.850 -12.920
  236    H    ILE 106           H        ILE 106  -2.010  -6.650  -8.780
  237    H    ILE 107           H        ILE 107  -3.700  -6.210  -4.750
  238    H    VAL 108           H        VAL 108  -7.100  -3.990  -6.100
  239    H    ALA 109           H        ALA 109  -8.650  -1.400  -2.840
  240    H    CYS 110           H        CYS 110 -12.450  -0.940  -5.020
  241    H    GLU 111           H        GLU 111 -12.800   3.460  -5.900
  242    H    GLY 112           H        GLY 112 -16.770   5.240  -6.090
  243    H    ASN 113           H        ASN 113 -16.160   9.280  -7.680
  244   1HD2  ASN 113           HD2      ASN 113 -19.510  11.170 -12.230
  245   2HD2  ASN 113           HD2      ASN 113 -19.800  11.160 -10.510
  246    OH   TYR 115           OH       TYR 115 -15.990   0.330  -8.310
  247    H    TYR 115           H        TYR 115 -13.910   6.750 -11.720
  248    HH   TYR 115           HH       TYR 115 -15.700  -0.570  -8.690
  249    H    VAL 116           H        VAL 116 -12.350   5.580  -7.810
  250    H    VAL 118           H        VAL 118  -9.820   2.690  -3.610
  251    H    HIS 119           H        HIS 119  -8.850   1.540  -2.010
  252    HD1  HIS 119           HD1      HIS 119  -8.020  -0.170   3.140
  253    HE2  HIS 119           HE2      HIS 119  -8.500  -3.990   1.910
  254    H    PHE 120           H        PHE 120  -5.660   0.020   0.520
  255    H    ASP 121           H        ASP 121  -5.300  -3.830  -1.570
  256    H    ALA 122           H        ALA 122  -4.840  -6.190  -1.800
  257    H    SER 123           H        SER 123  -1.060  -8.080  -1.210
  258    HG   SER 123           HG       SER 123   1.700  -6.680  -4.210
  259    H    VAL 124           H        VAL 124  -0.890  -9.690  -5.320
   
  Start of MODEL          24
 Raw file had 259 H/Q atoms
  Start of MODEL   24
    1   1H    LYS   1           H1       LYS   1  -9.310  17.120   1.840
    2   2H    LYS   1           H2       LYS   1  -9.820  18.200   2.980
    3   3H    LYS   1           H3       LYS   1  -8.310  17.580   3.050
    4   1HZ   LYS   1           HZ3      LYS   1 -10.980  17.680   2.320
    5   2HZ   LYS   1           HZ1      LYS   1 -11.280  18.370   0.880
    6   3HZ   LYS   1           HZ2      LYS   1 -12.040  18.960   2.270
    7    H    GLU   2           H        GLU   2  -9.410  14.560   4.940
    8    H    THR   3           H        THR   3  -9.820  12.400   1.760
    9    HG1  THR   3           HG1      THR   3 -10.650  12.070  -0.890
   10    H    ALA   4           H        ALA   4 -12.310   8.610   1.620
   11    H    ALA   5           H        ALA   5 -10.700   8.130  -0.750
   12    H    ALA   6           H        ALA   6  -8.440   9.660   0.000
   13    H    LYS   7           H        LYS   7  -7.490   8.240   2.110
   14   1HZ   LYS   7           HZ3      LYS   7 -10.020   6.170   7.690
   15   2HZ   LYS   7           HZ1      LYS   7 -10.590   7.630   8.160
   16   3HZ   LYS   7           HZ2      LYS   7 -11.110   6.980   6.760
   17    H    PHE   8           H        PHE   8  -6.610   5.780   0.810
   18    H    GLU   9           H        GLU   9  -4.410   6.940  -0.830
   19    NH1  ARG  10           NH2      ARG  10  -2.190   6.950   8.630
   20    NH2  ARG  10           NH1      ARG  10  -4.300   7.810   8.500
   21    H    ARG  10           H        ARG  10  -2.780   8.000   1.470
   22    HE   ARG  10           HE       ARG  10  -3.660   8.510   6.240
   23   1HH1  ARG  10           HH2      ARG  10  -1.290   6.810   8.220
   24   2HH1  ARG  10           HH2      ARG  10  -2.380   6.650   9.560
   25   1HH2  ARG  10           HH1      ARG  10  -4.950   8.440   8.080
   26   2HH2  ARG  10           HH1      ARG  10  -4.470   7.450   9.420
   27    H    GLN  11           H        GLN  11  -2.080   5.570   2.780
   28   1HE2  GLN  11           HE2      GLN  11  -5.720   3.510   5.960
   29   2HE2  GLN  11           HE2      GLN  11  -4.480   4.740   6.140
   30    H    HIS  12           H        HIS  12  -0.850   4.260   0.900
   31    HD1  HIS  12           HD1      HIS  12  -0.210  -0.230   0.830
   32    HE2  HIS  12           HE2      HIS  12  -3.660   0.650   2.690
   33    H    MET  13           H        MET  13   0.550   5.360  -0.800
   34    H    ASP  14           H        ASP  14   3.760   4.720  -3.890
   35    H    SER  15           H        SER  15   4.650   7.170  -4.720
   36    HG   SER  15           HG       SER  15   4.780   9.880  -6.740
   37    H    SER  16           H        SER  16   7.220   8.520  -4.910
   38    HG   SER  16           HG       SER  16   9.770   8.190  -3.160
   39    H    THR  17           H        THR  17   9.030   6.480  -5.040
   40    HG1  THR  17           HG1      THR  17  10.240   4.600  -2.440
   41    H    SER  18           H        SER  18  11.630   4.400  -7.720
   42    HG   SER  18           HG       SER  18  10.630   4.000 -10.320
   43    H    ALA  19           H        ALA  19  11.660   2.060  -5.950
   44    H    ALA  20           H        ALA  20  11.360  -1.360  -3.440
   45    H    SER  21           H        SER  21  14.690   1.030  -2.140
   46    HG   SER  21           HG       SER  21  17.560   1.770  -0.610
   47    H    SER  22           H        SER  22  15.960  -0.810  -0.320
   48    HG   SER  22           HG       SER  22  18.080   0.530   2.580
   49    H    SER  23           H        SER  23  18.230  -3.570   2.060
   50    HG   SER  23           HG       SER  23  19.410  -4.760   4.930
   51    H    ASN  24           H        ASN  24  17.310  -1.680   4.160
   52   1HD2  ASN  24           HD2      ASN  24  17.920   2.500   4.400
   53   2HD2  ASN  24           HD2      ASN  24  16.730   2.270   5.620
   54    OH   TYR  25           OH       TYR  25   9.690   3.750  -0.920
   55    H    TYR  25           H        TYR  25  14.970  -0.720   3.180
   56    HH   TYR  25           HH       TYR  25   8.740   3.460  -0.710
   57    H    CYS  26           H        CYS  26  11.840  -0.830   3.940
   58    H    ASN  27           H        ASN  27  12.260   0.210   6.680
   59   1HD2  ASN  27           HD2      ASN  27  14.370  -1.970   9.800
   60   2HD2  ASN  27           HD2      ASN  27  14.180  -0.450  10.670
   61    H    GLN  28           H        GLN  28  12.890   2.990   6.840
   62   1HE2  GLN  28           HE2      GLN  28  17.670   5.990   5.960
   63   2HE2  GLN  28           HE2      GLN  28  16.580   7.020   6.870
   64    H    MET  29           H        MET  29  11.010   3.790   5.270
   65    H    MET  30           H        MET  30   8.460   3.120   6.180
   66    H    LYS  31           H        LYS  31   8.570   5.370   7.880
   67   1HZ   LYS  31           HZ1      LYS  31   8.900   7.550  12.580
   68   2HZ   LYS  31           HZ2      LYS  31   9.820   7.000  13.800
   69   3HZ   LYS  31           HZ3      LYS  31   9.790   8.610  13.420
   70    H    SER  32           H        SER  32   8.740   7.680   6.690
   71    HG   SER  32           HG       SER  32   8.270   8.530   3.180
   72    NH1  ARG  33           NH1      ARG  33   5.820  10.110   1.510
   73    NH2  ARG  33           NH2      ARG  33   5.830   9.120  -0.530
   74    H    ARG  33           H        ARG  33   6.320   7.640   5.070
   75    HE   ARG  33           HE       ARG  33   4.170   7.570   0.430
   76   1HH1  ARG  33           HH1      ARG  33   5.460  10.180   2.440
   77   2HH1  ARG  33           HH1      ARG  33   6.500  10.770   1.180
   78   1HH2  ARG  33           HH2      ARG  33   5.440   8.470  -1.180
   79   2HH2  ARG  33           HH2      ARG  33   6.540   9.760  -0.820
   80    H    ASN  34           H        ASN  34   3.650   9.910   7.050
   81   1HD2  ASN  34           HD2      ASN  34   3.590  12.710   6.850
   82   2HD2  ASN  34           HD2      ASN  34   2.220  11.650   6.670
   83    H    LEU  35           H        LEU  35   3.050   6.790   8.390
   84    H    THR  36           H        THR  36   3.990   6.020  10.710
   85    HG1  THR  36           HG1      THR  36   6.200   5.530  10.620
   86    H    LYS  37           H        LYS  37   2.980   7.500  12.660
   87   1HZ   LYS  37           HZ2      LYS  37   5.830  11.140  10.360
   88   2HZ   LYS  37           HZ3      LYS  37   6.570  12.170  11.400
   89   3HZ   LYS  37           HZ1      LYS  37   7.450  11.360  10.300
   90    H    ASP  38           H        ASP  38   2.210   6.710  15.340
   91    NH1  ARG  39           NH2      ARG  39  -0.200   4.640  14.570
   92    NH2  ARG  39           NH1      ARG  39  -2.360   5.210  14.410
   93    H    ARG  39           H        ARG  39   1.030   4.790  16.430
   94    HE   ARG  39           HE       ARG  39  -2.690   3.760  16.330
   95   1HH1  ARG  39           HH2      ARG  39   0.410   3.860  14.760
   96   2HH1  ARG  39           HH2      ARG  39   0.010   5.220  13.780
   97   1HH2  ARG  39           HH1      ARG  39  -3.310   5.020  14.630
   98   2HH2  ARG  39           HH1      ARG  39  -2.130   5.760  13.600
   99    H    CYS  40           H        CYS  40   4.230   1.880  17.030
  100    H    LYS  41           H        LYS  41   3.640   1.270  12.670
  101   1HZ   LYS  41           HZ3      LYS  41  -0.400   1.450   7.080
  102   2HZ   LYS  41           HZ1      LYS  41  -1.830   0.670   6.910
  103   3HZ   LYS  41           HZ2      LYS  41  -1.710   1.910   7.960
  104    H    VAL  43           H        VAL  43   1.270  -3.360  10.110
  105    H    ASN  44           H        ASN  44   3.000  -3.610   6.340
  106   1HD2  ASN  44           HD2      ASN  44   3.300   1.500   4.580
  107   2HD2  ASN  44           HD2      ASN  44   1.600   1.350   4.830
  108    H    THR  45           H        THR  45   0.660  -2.280   2.930
  109    HG1  THR  45           HG1      THR  45   2.030  -5.460   1.480
  110    H    PHE  46           H        PHE  46   4.320  -1.590   0.990
  111    H    VAL  47           H        VAL  47   3.120   1.500  -1.960
  112    H    HIS  48           H        HIS  48   4.830   0.230  -5.540
  113    HD1  HIS  48           HD1      HIS  48   8.540   3.200  -4.380
  114    HE2  HIS  48           HE2      HIS  48   8.980  -0.250  -2.300
  115    H    GLU  49           H        GLU  49   3.460   3.040  -6.710
  116    H    SER  50           H        SER  50   2.930   5.530 -10.330
  117    HG   SER  50           HG       SER  50   1.610   5.990 -11.950
  118    H    LEU  51           H        LEU  51  -0.490   8.070  -8.290
  119    H    ALA  52           H        ALA  52  -1.910   8.080 -10.820
  120    H    ASP  53           H        ASP  53  -0.880   5.420 -11.910
  121    H    VAL  54           H        VAL  54  -2.130   3.770 -10.260
  122    H    GLN  55           H        GLN  55  -4.580   4.230 -10.310
  123   1HE2  GLN  55           HE2      GLN  55  -8.310   8.880 -10.860
  124   2HE2  GLN  55           HE2      GLN  55  -8.910   7.310 -10.380
  125    H    ALA  56           H        ALA  56  -5.000   2.860 -12.710
  126    H    VAL  57           H        VAL  57  -5.730   0.370 -11.530
  127    H    CYS  58           H        CYS  58  -8.070   0.190 -11.050
  128    H    SER  59           H        SER  59  -9.380  -0.720 -13.360
  129    HG   SER  59           HG       SER  59 -10.330   1.270 -15.900
  130    H    GLN  60           H        GLN  60  -9.450  -3.380 -13.430
  131   1HE2  GLN  60           HE2      GLN  60  -3.960  -2.710 -15.660
  132   2HE2  GLN  60           HE2      GLN  60  -5.540  -1.950 -15.630
  133    H    LYS  61           H        LYS  61  -8.840  -6.660 -13.160
  134   1HZ   LYS  61           HZ1      LYS  61 -12.480 -11.560 -12.000
  135   2HZ   LYS  61           HZ2      LYS  61 -13.560 -11.190 -13.150
  136   3HZ   LYS  61           HZ3      LYS  61 -13.420 -12.730 -12.620
  137    H    ASN  62           H        ASN  62 -12.980  -7.860 -12.750
  138   1HD2  ASN  62           HD2      ASN  62 -15.960  -6.630  -7.920
  139   2HD2  ASN  62           HD2      ASN  62 -14.520  -6.020  -8.690
  140    H    VAL  63           H        VAL  63 -13.040  -7.720  -8.190
  141    H    ALA  64           H        ALA  64 -12.870 -11.000  -5.270
  142    H    CYS  65           H        CYS  65 -14.170  -7.970  -2.230
  143    H    LYS  66           H        LYS  66 -10.670  -8.380   0.800
  144   1HZ   LYS  66           HZ3      LYS  66  -6.870 -10.570   2.070
  145   2HZ   LYS  66           HZ1      LYS  66  -5.310 -10.080   2.000
  146   3HZ   LYS  66           HZ2      LYS  66  -5.960 -10.520   3.440
  147    H    ASN  67           H        ASN  67 -13.160  -8.110   2.820
  148   1HD2  ASN  67           HD2      ASN  67 -16.060  -4.810   3.200
  149   2HD2  ASN  67           HD2      ASN  67 -16.170  -5.550   4.750
  150    H    GLY  68           H        GLY  68 -14.830  -9.660   1.400
  151    H    GLN  69           H        GLN  69 -16.090  -7.640   0.850
  152   1HE2  GLN  69           HE2      GLN  69 -16.560  -1.420   0.860
  153   2HE2  GLN  69           HE2      GLN  69 -17.010  -2.300  -0.590
  154    H    THR  70           H        THR  70 -18.720  -6.410  -2.720
  155    HG1  THR  70           HG1      THR  70 -20.410  -6.020  -5.670
  156    H    ASN  71           H        ASN  71 -16.380  -4.980  -3.570
  157   1HD2  ASN  71           HD2      ASN  71 -15.450  -0.720  -2.150
  158   2HD2  ASN  71           HD2      ASN  71 -15.440  -0.390  -3.860
  159    H    CYS  72           H        CYS  72 -14.080  -5.790  -5.750
  160    OH   TYR  73           OH       TYR  73 -15.610  -1.990  -9.670
  161    H    TYR  73           H        TYR  73 -10.000  -4.640  -6.560
  162    HH   TYR  73           HH       TYR  73 -16.110  -2.490 -10.390
  163    H    GLN  74           H        GLN  74  -9.050  -7.100  -9.930
  164   1HE2  GLN  74           HE2      GLN  74  -5.170 -12.410 -10.350
  165   2HE2  GLN  74           HE2      GLN  74  -4.940 -10.910 -11.210
  166    H    SER  75           H        SER  75  -4.770  -6.090 -10.240
  167    HG   SER  75           HG       SER  75  -1.550  -6.190 -11.750
  168    OH   TYR  76           OH       TYR  76  -9.800  -8.840 -17.280
  169    H    TYR  76           H        TYR  76  -4.530  -6.600 -14.830
  170    HH   TYR  76           HH       TYR  76 -10.190  -7.950 -17.520
  171    H    SER  77           H        SER  77  -1.920  -7.040 -14.340
  172    HG   SER  77           HG       SER  77   0.040  -9.270 -16.400
  173    H    THR  78           H        THR  78   2.400  -7.720 -13.840
  174    HG1  THR  78           HG1      THR  78   5.060  -6.590 -12.830
  175    H    MET  79           H        MET  79   2.750  -5.940  -9.690
  176    H    SER  80           H        SER  80   5.010  -2.210  -9.420
  177    HG   SER  80           HG       SER  80   9.079  -1.254  -8.045
  178    H    ILE  81           H        ILE  81   5.950  -4.480  -5.800
  179    H    THR  82           H        THR  82   5.390  -2.470  -1.960
  180    HG1  THR  82           HG1      THR  82   8.430  -2.840  -2.660
  181    H    ASP  83           H        ASP  83   7.050  -5.440   0.290
  182    H    CYS  84           H        CYS  84   5.120  -3.930   3.940
  183    NH1  ARG  85           NH2      ARG  85   7.220 -11.310   5.870
  184    NH2  ARG  85           NH1      ARG  85   9.170 -11.430   7.040
  185    H    ARG  85           H        ARG  85   7.840  -5.700   6.830
  186    HE   ARG  85           HE       ARG  85   7.880 -10.310   8.840
  187   1HH1  ARG  85           HH2      ARG  85   6.290 -10.960   5.790
  188   2HH1  ARG  85           HH2      ARG  85   7.670 -11.760   5.100
  189   1HH2  ARG  85           HH1      ARG  85   9.720 -11.210   7.840
  190   2HH2  ARG  85           HH1      ARG  85   9.580 -11.850   6.240
  191    H    GLU  86           H        GLU  86   5.620  -5.680  10.550
  192    H    THR  87           H        THR  87   9.590  -4.920  12.640
  193    HG1  THR  87           HG1      THR  87  13.050  -8.290  12.750
  194    H    GLY  88           H        GLY  88  11.690  -7.890  15.450
  195    H    SER  89           H        SER  89  12.940  -5.520  16.390
  196    HG   SER  89           HG       SER  89  14.650  -3.340  15.220
  197    H    SER  90           H        SER  90  10.700  -3.510  17.340
  198    HG   SER  90           HG       SER  90   7.850  -0.760  15.240
  199    H    LYS  91           H        LYS  91  11.650   0.360  17.500
  200   1HZ   LYS  91           HZ3      LYS  91  16.570   1.910  21.140
  201   2HZ   LYS  91           HZ1      LYS  91  15.910   2.960  22.210
  202   3HZ   LYS  91           HZ2      LYS  91  15.510   1.370  22.270
  203    OH   TYR  92           OH       TYR  92   4.680   9.140  18.820
  204    H    TYR  92           H        TYR  92   8.480   2.100  19.060
  205    HH   TYR  92           HH       TYR  92   4.190   9.250  17.940
  206    H    ASN  94           H        ASN  94  11.430   4.980  17.650
  207   1HD2  ASN  94           HD2      ASN  94  15.620   2.350  15.060
  208   2HD2  ASN  94           HD2      ASN  94  14.440   2.210  16.340
  209    H    CYS  95           H        CYS  95  10.490   3.880  14.140
  210    H    ALA  96           H        ALA  96  10.300  -0.740  13.910
  211    OH   TYR  97           OH       TYR  97   5.920  -0.180  11.950
  212    H    TYR  97           H        TYR  97  12.240  -2.030  10.240
  213    HH   TYR  97           HH       TYR  97   5.120  -0.810  11.940
  214    H    LYS  98           H        LYS  98  10.080  -5.630   8.980
  215   1HZ   LYS  98           HZ2      LYS  98   9.220 -10.710  10.910
  216   2HZ   LYS  98           HZ3      LYS  98  10.350 -11.870  10.620
  217   3HZ   LYS  98           HZ1      LYS  98  10.230 -11.190  12.100
  218    H    THR  99           H        THR  99  12.690  -5.620   5.440
  219    HG1  THR  99           HG1      THR  99  13.110  -3.150   5.250
  220    H    THR 100           H        THR 100   9.520  -5.700   2.340
  221    HG1  THR 100           HG1      THR 100  10.340  -8.530   2.700
  222    H    GLN 101           H        GLN 101  11.730  -6.600  -1.230
  223   1HE2  GLN 101           HE2      GLN 101   9.200  -4.920  -6.690
  224   2HE2  GLN 101           HE2      GLN 101   8.950  -4.300  -5.090
  225    H    ALA 102           H        ALA 102   8.140  -6.120  -3.600
  226    H    ASN 103           H        ASN 103   7.960  -8.720  -7.110
  227   1HD2  ASN 103           HD2      ASN 103  10.610  -6.000  -8.380
  228   2HD2  ASN 103           HD2      ASN 103  10.200  -7.580  -8.960
  229    H    LYS 104           H        LYS 104   4.240  -7.110  -7.770
  230   1HZ   LYS 104           HZ1      LYS 104   3.930 -11.240  -2.070
  231   2HZ   LYS 104           HZ2      LYS 104   3.030 -12.430  -2.720
  232   3HZ   LYS 104           HZ3      LYS 104   4.540 -12.750  -2.170
  233    H    HIS 105           H        HIS 105   0.960  -9.980  -8.360
  234    HD1  HIS 105           HD1      HIS 105  -3.140 -10.030 -11.670
  235    HE2  HIS 105           HE2      HIS 105   0.190 -11.720 -13.180
  236    H    ILE 106           H        ILE 106  -2.140  -6.570  -9.010
  237    H    ILE 107           H        ILE 107  -3.900  -6.330  -5.060
  238    H    VAL 108           H        VAL 108  -7.170  -3.940  -6.270
  239    H    ALA 109           H        ALA 109  -8.740  -1.600  -2.810
  240    H    CYS 110           H        CYS 110 -12.580  -1.070  -5.060
  241    H    GLU 111           H        GLU 111 -12.910   3.350  -5.740
  242    H    GLY 112           H        GLY 112 -16.910   5.000  -6.030
  243    H    ASN 113           H        ASN 113 -16.270   9.220  -7.280
  244   1HD2  ASN 113           HD2      ASN 113 -19.170  11.020 -12.290
  245   2HD2  ASN 113           HD2      ASN 113 -19.780  10.680 -10.670
  246    OH   TYR 115           OH       TYR 115 -15.990   0.350  -8.470
  247    H    TYR 115           H        TYR 115 -13.630   6.990 -11.690
  248    HH   TYR 115           HH       TYR 115 -15.720  -0.530  -8.900
  249    H    VAL 116           H        VAL 116 -12.420   5.450  -7.750
  250    H    VAL 118           H        VAL 118  -9.820   2.410  -3.330
  251    H    HIS 119           H        HIS 119  -8.930   1.290  -1.760
  252    HD1  HIS 119           HD1      HIS 119  -8.180  -0.820   3.260
  253    HE2  HIS 119           HE2      HIS 119  -9.020  -4.470   1.750
  254    H    PHE 120           H        PHE 120  -5.850  -0.430   0.730
  255    H    ASP 121           H        ASP 121  -5.470  -4.170  -1.670
  256    H    ALA 122           H        ALA 122  -5.200  -6.720  -2.030
  257    H    SER 123           H        SER 123  -1.310  -8.560  -1.540
  258    HG   SER 123           HG       SER 123   0.330  -7.060  -4.930
  259    H    VAL 124           H        VAL 124  -1.080  -9.810  -5.830
   
  Start of MODEL          25
 Raw file had 259 H/Q atoms
  Start of MODEL   25
    1   1H    LYS   1           H1       LYS   1 -10.650  16.810   4.950
    2   2H    LYS   1           H2       LYS   1 -10.440  17.560   6.390
    3   3H    LYS   1           H3       LYS   1  -9.180  17.420   5.320
    4   1HZ   LYS   1           HZ1      LYS   1 -13.590  12.110   5.320
    5   2HZ   LYS   1           HZ2      LYS   1 -11.980  12.370   5.330
    6   3HZ   LYS   1           HZ3      LYS   1 -12.600  11.060   6.090
    7    H    GLU   2           H        GLU   2  -8.490  13.630   6.840
    8    H    THR   3           H        THR   3  -9.150  12.580   2.910
    9    HG1  THR   3           HG1      THR   3 -10.070  12.560   0.040
   10    H    ALA   4           H        ALA   4 -11.600   8.750   2.350
   11    H    ALA   5           H        ALA   5 -10.230   8.440  -0.400
   12    H    ALA   6           H        ALA   6  -7.900  10.090   0.210
   13    H    LYS   7           H        LYS   7  -6.840   8.510   2.300
   14   1HZ   LYS   7           HZ1      LYS   7  -4.530   7.000   7.730
   15   2HZ   LYS   7           HZ2      LYS   7  -5.560   6.560   8.920
   16   3HZ   LYS   7           HZ3      LYS   7  -4.590   5.440   8.200
   17    H    PHE   8           H        PHE   8  -6.080   6.050   0.870
   18    H    GLU   9           H        GLU   9  -4.030   7.290  -0.960
   19    NH1  ARG  10           NH1      ARG  10  -0.430   7.920   8.450
   20    NH2  ARG  10           NH2      ARG  10  -2.490   8.790   8.760
   21    H    ARG  10           H        ARG  10  -2.240   8.190   1.260
   22    HE   ARG  10           HE       ARG  10  -2.740   8.500   6.280
   23   1HH1  ARG  10           HH1      ARG  10   0.330   7.710   7.820
   24   2HH1  ARG  10           HH1      ARG  10  -0.290   7.920   9.440
   25   1HH2  ARG  10           HH2      ARG  10  -3.300   9.260   8.400
   26   2HH2  ARG  10           HH2      ARG  10  -2.310   8.770   9.740
   27    H    GLN  11           H        GLN  11  -1.590   5.780   2.640
   28   1HE2  GLN  11           HE2      GLN  11  -3.750   1.100   5.760
   29   2HE2  GLN  11           HE2      GLN  11  -2.080   1.590   5.910
   30    H    HIS  12           H        HIS  12  -0.400   4.520   0.490
   31    HD1  HIS  12           HD1      HIS  12   0.160   0.120   0.480
   32    HE2  HIS  12           HE2      HIS  12  -3.220   1.100   2.350
   33    H    MET  13           H        MET  13   0.920   5.570  -1.420
   34    H    ASP  14           H        ASP  14   3.990   4.620  -4.590
   35    H    SER  15           H        SER  15   4.940   6.980  -5.640
   36    HG   SER  15           HG       SER  15   6.370   7.390  -9.570
   37    H    SER  16           H        SER  16   7.380   8.540  -6.000
   38    HG   SER  16           HG       SER  16   8.780  11.270  -5.490
   39    H    THR  17           H        THR  17   9.320   6.330  -5.480
   40    HG1  THR  17           HG1      THR  17  10.280   4.410  -2.790
   41    H    SER  18           H        SER  18  12.080   3.990  -7.830
   42    HG   SER  18           HG       SER  18  11.030   3.460 -10.630
   43    H    ALA  19           H        ALA  19  12.110   1.720  -6.110
   44    H    ALA  20           H        ALA  20  11.250  -1.460  -3.420
   45    H    SER  21           H        SER  21  15.020   0.080  -1.250
   46    HG   SER  21           HG       SER  21  17.350  -0.650   0.970
   47    H    SER  22           H        SER  22  15.480  -2.320   0.200
   48    HG   SER  22           HG       SER  22  18.770  -6.060   1.100
   49    H    SER  23           H        SER  23  16.470  -5.600   2.670
   50    HG   SER  23           HG       SER  23  14.540  -5.860   6.570
   51    H    ASN  24           H        ASN  24  16.420  -2.960   3.800
   52   1HD2  ASN  24           HD2      ASN  24  17.300   1.000   2.250
   53   2HD2  ASN  24           HD2      ASN  24  16.990   1.320   3.930
   54    OH   TYR  25           OH       TYR  25   9.800   3.600  -1.100
   55    H    TYR  25           H        TYR  25  14.480  -1.380   3.220
   56    HH   TYR  25           HH       TYR  25   8.830   3.360  -0.950
   57    H    CYS  26           H        CYS  26  11.450  -0.880   4.210
   58    H    ASN  27           H        ASN  27  12.090  -0.020   6.810
   59   1HD2  ASN  27           HD2      ASN  27  14.390  -2.580   9.440
   60   2HD2  ASN  27           HD2      ASN  27  14.800  -1.050  10.180
   61    H    GLN  28           H        GLN  28  13.100   2.840   7.080
   62   1HE2  GLN  28           HE2      GLN  28  14.840   3.380  10.750
   63   2HE2  GLN  28           HE2      GLN  28  13.840   4.760  10.390
   64    H    MET  29           H        MET  29  11.570   3.980   5.410
   65    H    MET  30           H        MET  30   8.830   3.620   6.190
   66    H    LYS  31           H        LYS  31   8.630   5.520   8.340
   67   1HZ   LYS  31           HZ3      LYS  31  13.140   6.400  12.580
   68   2HZ   LYS  31           HZ1      LYS  31  13.880   7.350  11.470
   69   3HZ   LYS  31           HZ2      LYS  31  12.730   7.980  12.420
   70    H    SER  32           H        SER  32   8.760   8.030   7.220
   71    HG   SER  32           HG       SER  32   7.860  11.490   5.010
   72    NH1  ARG  33           NH2      ARG  33   3.670   8.410  -0.100
   73    NH2  ARG  33           NH1      ARG  33   5.720   9.050  -0.810
   74    H    ARG  33           H        ARG  33   6.140   8.060   6.030
   75    HE   ARG  33           HE       ARG  33   6.170   9.460   1.620
   76   1HH1  ARG  33           HH2      ARG  33   2.980   8.320   0.620
   77   2HH1  ARG  33           HH2      ARG  33   3.460   8.140  -1.040
   78   1HH2  ARG  33           HH1      ARG  33   6.570   9.550  -0.670
   79   2HH2  ARG  33           HH1      ARG  33   5.450   8.750  -1.720
   80    H    ASN  34           H        ASN  34   4.750   9.670   8.090
   81   1HD2  ASN  34           HD2      ASN  34   2.490  12.850   7.070
   82   2HD2  ASN  34           HD2      ASN  34   1.750  11.270   6.930
   83    H    LEU  35           H        LEU  35   3.360   7.050   8.360
   84    H    THR  36           H        THR  36   4.400   5.890  10.740
   85    HG1  THR  36           HG1      THR  36   7.300   5.680  12.560
   86    H    LYS  37           H        LYS  37   3.140   7.250  12.610
   87   1HZ   LYS  37           HZ2      LYS  37   5.640  11.840  11.550
   88   2HZ   LYS  37           HZ3      LYS  37   7.220  11.990  11.110
   89   3HZ   LYS  37           HZ1      LYS  37   6.260  10.870  10.400
   90    H    ASP  38           H        ASP  38   2.110   6.240  14.970
   91    NH1  ARG  39           NH2      ARG  39  -3.140   0.580  17.750
   92    NH2  ARG  39           NH1      ARG  39  -3.920   0.310  15.640
   93    H    ARG  39           H        ARG  39   1.210   4.260  15.670
   94    HE   ARG  39           HE       ARG  39  -1.470   0.520  15.030
   95   1HH1  ARG  39           HH2      ARG  39  -2.350   0.760  18.330
   96   2HH1  ARG  39           HH2      ARG  39  -4.060   0.510  18.100
   97   1HH2  ARG  39           HH1      ARG  39  -3.790   0.240  14.650
   98   2HH2  ARG  39           HH1      ARG  39  -4.830   0.280  16.040
   99    H    CYS  40           H        CYS  40   4.220   1.450  16.770
  100    H    LYS  41           H        LYS  41   3.560   1.070  12.410
  101   1HZ   LYS  41           HZ3      LYS  41  -0.730  -1.140   7.870
  102   2HZ   LYS  41           HZ1      LYS  41  -2.120  -0.580   7.260
  103   3HZ   LYS  41           HZ2      LYS  41  -0.700   0.010   6.720
  104    H    VAL  43           H        VAL  43   0.960  -3.340   9.980
  105    H    ASN  44           H        ASN  44   2.860  -3.700   6.340
  106   1HD2  ASN  44           HD2      ASN  44   2.130   1.510   3.450
  107   2HD2  ASN  44           HD2      ASN  44   3.460   0.660   4.180
  108    H    THR  45           H        THR  45   1.120  -1.420   3.040
  109    HG1  THR  45           HG1      THR  45   1.140  -4.920   1.980
  110    H    PHE  46           H        PHE  46   4.570  -1.350   0.690
  111    H    VAL  47           H        VAL  47   3.340   1.630  -2.360
  112    H    HIS  48           H        HIS  48   5.110   0.120  -5.720
  113    HD1  HIS  48           HD1      HIS  48   8.840   3.060  -4.800
  114    HE2  HIS  48           HE2      HIS  48   9.190  -0.340  -2.630
  115    H    GLU  49           H        GLU  49   3.650   2.820  -7.070
  116    H    SER  50           H        SER  50   3.360   5.200 -10.750
  117    HG   SER  50           HG       SER  50   1.940   5.510 -12.530
  118    H    LEU  51           H        LEU  51   0.000   7.950  -8.940
  119    H    ALA  52           H        ALA  52  -1.570   7.890 -11.360
  120    H    ASP  53           H        ASP  53  -0.670   5.160 -12.440
  121    H    VAL  54           H        VAL  54  -2.050   3.620 -10.530
  122    H    GLN  55           H        GLN  55  -4.430   4.220 -10.580
  123   1HE2  GLN  55           HE2      GLN  55  -8.150   9.030 -10.400
  124   2HE2  GLN  55           HE2      GLN  55  -8.700   7.400 -10.100
  125    H    ALA  56           H        ALA  56  -4.980   2.970 -13.020
  126    H    VAL  57           H        VAL  57  -5.940   0.450 -11.640
  127    H    CYS  58           H        CYS  58  -8.200   0.460 -11.010
  128    H    SER  59           H        SER  59  -9.550  -0.210 -13.370
  129    HG   SER  59           HG       SER  59  -9.210  -0.320 -16.400
  130    H    GLN  60           H        GLN  60 -10.150  -2.730 -13.250
  131   1HE2  GLN  60           HE2      GLN  60  -4.500  -3.280 -15.240
  132   2HE2  GLN  60           HE2      GLN  60  -5.920  -2.290 -15.510
  133    H    LYS  61           H        LYS  61  -9.820  -6.880 -13.560
  134   1HZ   LYS  61           HZ2      LYS  61 -12.980  -7.810 -16.800
  135   2HZ   LYS  61           HZ3      LYS  61 -13.280  -8.690 -18.160
  136   3HZ   LYS  61           HZ1      LYS  61 -14.500  -7.960 -17.350
  137    H    ASN  62           H        ASN  62 -13.970  -7.360 -12.070
  138   1HD2  ASN  62           HD2      ASN  62 -16.110  -6.200  -6.870
  139   2HD2  ASN  62           HD2      ASN  62 -14.730  -5.630  -7.770
  140    H    VAL  63           H        VAL  63 -13.450  -7.300  -7.600
  141    H    ALA  64           H        ALA  64 -12.890 -10.460  -4.670
  142    H    CYS  65           H        CYS  65 -13.800  -7.420  -1.540
  143    H    LYS  66           H        LYS  66  -9.960  -8.250   0.850
  144   1HZ   LYS  66           HZ2      LYS  66  -6.170 -10.890   1.000
  145   2HZ   LYS  66           HZ1      LYS  66  -5.360 -11.680   1.090
  146   3HZ   LYS  66           HZ3      LYS  66  -6.290 -12.760   1.230
  147    H    ASN  67           H        ASN  67 -11.850  -7.760   3.260
  148   1HD2  ASN  67           HD2      ASN  67 -13.590  -4.020   3.780
  149   2HD2  ASN  67           HD2      ASN  67 -13.890  -4.640   5.370
  150    H    GLY  68           H        GLY  68 -14.040  -9.050   2.210
  151    H    GLN  69           H        GLN  69 -15.150  -6.890   1.710
  152   1HE2  GLN  69           HE2      GLN  69 -14.180  -0.840  -0.170
  153   2HE2  GLN  69           HE2      GLN  69 -14.520  -2.070  -1.350
  154    H    THR  70           H        THR  70 -18.350  -5.920  -1.300
  155    HG1  THR  70           HG1      THR  70 -20.790  -5.830  -3.340
  156    H    ASN  71           H        ASN  71 -16.500  -4.350  -2.720
  157   1HD2  ASN  71           HD2      ASN  71 -16.489  -0.453  -1.471
  158   2HD2  ASN  71           HD2      ASN  71 -16.259   0.042  -3.107
  159    H    CYS  72           H        CYS  72 -14.160  -5.460  -5.040
  160    OH   TYR  73           OH       TYR  73 -15.530  -1.180  -9.740
  161    H    TYR  73           H        TYR  73 -10.160  -4.200  -6.420
  162    HH   TYR  73           HH       TYR  73 -15.890  -1.570 -10.590
  163    H    GLN  74           H        GLN  74  -9.490  -6.740  -9.840
  164   1HE2  GLN  74           HE2      GLN  74  -6.190 -12.310  -9.960
  165   2HE2  GLN  74           HE2      GLN  74  -5.910 -10.860 -10.900
  166    H    SER  75           H        SER  75  -5.020  -6.230 -10.010
  167    HG   SER  75           HG       SER  75  -1.740  -6.090 -11.680
  168    OH   TYR  76           OH       TYR  76  -8.640  -8.720 -12.320
  169    H    TYR  76           H        TYR  76  -4.630  -7.120 -14.520
  170    HH   TYR  76           HH       TYR  76  -8.340  -7.780 -12.070
  171    H    SER  77           H        SER  77  -2.080  -7.350 -14.500
  172    HG   SER  77           HG       SER  77   0.410  -5.950 -16.570
  173    H    THR  78           H        THR  78   2.240  -7.970 -13.840
  174    HG1  THR  78           HG1      THR  78   5.050  -7.020 -12.760
  175    H    MET  79           H        MET  79   2.500  -5.980  -9.770
  176    H    SER  80           H        SER  80   4.970  -2.300  -9.620
  177    HG   SER  80           HG       SER  80   8.870  -1.160  -7.510
  178    H    ILE  81           H        ILE  81   6.010  -4.540  -5.900
  179    H    THR  82           H        THR  82   5.420  -2.360  -2.190
  180    HG1  THR  82           HG1      THR  82   8.540  -2.710  -2.770
  181    H    ASP  83           H        ASP  83   6.690  -5.440  -0.140
  182    H    CYS  84           H        CYS  84   4.690  -4.460   3.740
  183    NH1  ARG  85           NH2      ARG  85   2.750 -11.940   6.200
  184    NH2  ARG  85           NH1      ARG  85   1.750 -11.100   4.350
  185    H    ARG  85           H        ARG  85   7.200  -6.240   6.630
  186    HE   ARG  85           HE       ARG  85   3.230  -9.120   4.760
  187   1HH1  ARG  85           HH2      ARG  85   3.330 -11.790   7.000
  188   2HH1  ARG  85           HH2      ARG  85   2.220 -12.780   6.120
  189   1HH2  ARG  85           HH1      ARG  85   1.600 -10.340   3.710
  190   2HH2  ARG  85           HH1      ARG  85   1.210 -11.930   4.290
  191    H    GLU  86           H        GLU  86   5.040  -5.910  10.460
  192    H    THR  87           H        THR  87   9.110  -5.340  12.450
  193    HG1  THR  87           HG1      THR  87  10.920  -4.790  13.290
  194    H    GLY  88           H        GLY  88  10.330  -8.760  15.410
  195    H    SER  89           H        SER  89  11.850  -6.590  16.360
  196    HG   SER  89           HG       SER  89  13.840  -4.780  15.560
  197    H    SER  90           H        SER  90  10.010  -4.150  17.250
  198    HG   SER  90           HG       SER  90   7.870  -2.510  17.440
  199    H    LYS  91           H        LYS  91  11.260   0.110  16.890
  200   1HZ   LYS  91           HZ2      LYS  91  13.230   5.130  20.440
  201   2HZ   LYS  91           HZ3      LYS  91  11.810   4.750  21.150
  202   3HZ   LYS  91           HZ1      LYS  91  12.930   5.600  21.980
  203    OH   TYR  92           OH       TYR  92   4.000   8.840  18.870
  204    H    TYR  92           H        TYR  92   8.980   2.610  19.930
  205    HH   TYR  92           HH       TYR  92   3.440   8.810  18.030
  206    H    ASN  94           H        ASN  94  10.840   4.710  16.770
  207   1HD2  ASN  94           HD2      ASN  94  14.390   3.430  18.410
  208   2HD2  ASN  94           HD2      ASN  94  14.880   3.230  16.750
  209    H    CYS  95           H        CYS  95  10.130   3.120  13.490
  210    H    ALA  96           H        ALA  96  10.200  -1.460  13.410
  211    OH   TYR  97           OH       TYR  97   5.700  -0.240  11.320
  212    H    TYR  97           H        TYR  97  11.750  -2.490   9.640
  213    HH   TYR  97           HH       TYR  97   4.980  -0.920  11.520
  214    H    LYS  98           H        LYS  98   9.420  -6.160   8.700
  215   1HZ   LYS  98           HZ2      LYS  98   8.170 -10.770  11.260
  216   2HZ   LYS  98           HZ3      LYS  98   9.380 -11.170  12.290
  217   3HZ   LYS  98           HZ1      LYS  98   9.270  -9.660  11.680
  218    H    THR  99           H        THR  99  12.000  -5.850   5.490
  219    HG1  THR  99           HG1      THR  99  11.950  -3.440   5.910
  220    H    THR 100           H        THR 100   9.140  -5.830   2.190
  221    HG1  THR 100           HG1      THR 100   9.850  -8.950   2.600
  222    H    GLN 101           H        GLN 101  11.640  -6.330  -1.250
  223   1HE2  GLN 101           HE2      GLN 101   8.750  -3.680  -6.470
  224   2HE2  GLN 101           HE2      GLN 101   9.630  -5.170  -6.550
  225    H    ALA 102           H        ALA 102   8.190  -6.000  -3.950
  226    H    ASN 103           H        ASN 103   8.000  -8.670  -7.400
  227   1HD2  ASN 103           HD2      ASN 103   8.700  -4.730 -10.710
  228   2HD2  ASN 103           HD2      ASN 103   7.490  -5.740 -11.440
  229    H    LYS 104           H        LYS 104   4.150  -7.220  -7.740
  230   1HZ   LYS 104           HZ3      LYS 104   3.570 -13.790  -6.580
  231   2HZ   LYS 104           HZ1      LYS 104   5.190 -13.650  -6.510
  232   3HZ   LYS 104           HZ2      LYS 104   4.390 -14.460  -5.320
  233    H    HIS 105           H        HIS 105   0.730  -9.940  -8.330
  234    HD1  HIS 105           HD1      HIS 105  -3.450 -10.410 -11.170
  235    HE2  HIS 105           HE2      HIS 105  -0.160 -11.910 -12.950
  236    H    ILE 106           H        ILE 106  -2.330  -6.540  -8.950
  237    H    ILE 107           H        ILE 107  -3.980  -6.050  -4.910
  238    H    VAL 108           H        VAL 108  -7.350  -3.720  -6.190
  239    H    ALA 109           H        ALA 109  -8.870  -1.090  -2.950
  240    H    CYS 110           H        CYS 110 -12.880  -0.180  -5.040
  241    H    GLU 111           H        GLU 111 -12.540   4.140  -5.740
  242    H    GLY 112           H        GLY 112 -16.070   6.680  -6.120
  243    H    ASN 113           H        ASN 113 -14.430  10.730  -6.780
  244   1HD2  ASN 113           HD2      ASN 113 -17.000  14.230 -10.810
  245   2HD2  ASN 113           HD2      ASN 113 -17.340  13.800  -9.150
  246    OH   TYR 115           OH       TYR 115 -16.260   1.150  -8.860
  247    H    TYR 115           H        TYR 115 -13.130   7.910 -11.360
  248    HH   TYR 115           HH       TYR 115 -15.820   0.280  -9.180
  249    H    VAL 116           H        VAL 116 -11.830   6.460  -7.580
  250    H    VAL 118           H        VAL 118  -9.720   2.890  -3.460
  251    H    HIS 119           H        HIS 119  -8.780   1.680  -1.930
  252    HD1  HIS 119           HD1      HIS 119  -8.140  -0.540   3.020
  253    HE2  HIS 119           HE2      HIS 119  -9.070  -4.140   1.440
  254    H    PHE 120           H        PHE 120  -5.650   0.070   0.510
  255    H    ASP 121           H        ASP 121  -5.390  -3.830  -1.620
  256    H    ALA 122           H        ALA 122  -5.080  -6.360  -1.880
  257    H    SER 123           H        SER 123  -1.190  -8.340  -1.470
  258    HG   SER 123           HG       SER 123   1.220  -6.170  -3.870
  259    H    VAL 124           H        VAL 124  -1.210  -9.770  -5.650
   
  Start of MODEL          26
 Raw file had 259 H/Q atoms
  Start of MODEL   26
    1   1H    LYS   1           H3       LYS   1  -8.220  17.680   5.100
    2   2H    LYS   1           H1       LYS   1  -9.700  17.990   4.460
    3   3H    LYS   1           H2       LYS   1  -9.410  18.350   6.040
    4   1HZ   LYS   1           HZ3      LYS   1 -14.000  15.660   5.250
    5   2HZ   LYS   1           HZ1      LYS   1 -13.330  14.330   4.560
    6   3HZ   LYS   1           HZ2      LYS   1 -14.930  14.340   4.950
    7    H    GLU   2           H        GLU   2  -9.110  14.140   6.370
    8    H    THR   3           H        THR   3  -8.970  12.700   2.470
    9    HG1  THR   3           HG1      THR   3  -9.880  12.550  -0.490
   10    H    ALA   4           H        ALA   4 -11.470   8.930   1.880
   11    H    ALA   5           H        ALA   5 -10.000   8.570  -0.520
   12    H    ALA   6           H        ALA   6  -7.750  10.150  -0.010
   13    H    LYS   7           H        LYS   7  -6.620   8.660   2.010
   14   1HZ   LYS   7           HZ2      LYS   7  -7.740   5.000   7.930
   15   2HZ   LYS   7           HZ3      LYS   7  -8.760   4.640   6.690
   16   3HZ   LYS   7           HZ1      LYS   7  -7.960   3.440   7.460
   17    H    PHE   8           H        PHE   8  -5.980   6.110   0.920
   18    H    GLU   9           H        GLU   9  -3.920   7.270  -1.100
   19    NH1  ARG  10           NH1      ARG  10  -0.720  12.470   6.570
   20    NH2  ARG  10           NH2      ARG  10  -2.510  11.450   7.500
   21    H    ARG  10           H        ARG  10  -2.030   8.200   1.100
   22    HE   ARG  10           HE       ARG  10  -2.410   9.960   5.480
   23   1HH1  ARG  10           HH1      ARG  10   0.040  12.440   5.920
   24   2HH1  ARG  10           HH1      ARG  10  -0.770  13.180   7.260
   25   1HH2  ARG  10           HH2      ARG  10  -3.070  10.630   7.610
   26   2HH2  ARG  10           HH2      ARG  10  -2.560  12.190   8.170
   27    H    GLN  11           H        GLN  11  -1.430   5.800   2.620
   28   1HE2  GLN  11           HE2      GLN  11  -4.480   2.460   6.450
   29   2HE2  GLN  11           HE2      GLN  11  -3.110   3.390   7.010
   30    H    HIS  12           H        HIS  12  -0.270   4.430   0.520
   31    HD1  HIS  12           HD1      HIS  12   0.070  -0.100   0.470
   32    HE2  HIS  12           HE2      HIS  12  -3.230   1.070   2.440
   33    H    MET  13           H        MET  13   0.860   5.390  -1.390
   34    H    ASP  14           H        ASP  14   4.100   4.500  -4.340
   35    H    SER  15           H        SER  15   5.180   7.020  -5.310
   36    HG   SER  15           HG       SER  15   5.080   9.610  -7.490
   37    H    SER  16           H        SER  16   7.770   8.170  -5.490
   38    HG   SER  16           HG       SER  16  10.420   8.200  -3.480
   39    H    THR  17           H        THR  17   9.500   6.050  -5.490
   40    HG1  THR  17           HG1      THR  17  10.500   3.940  -2.860
   41    H    SER  18           H        SER  18  12.270   3.430  -7.680
   42    HG   SER  18           HG       SER  18  13.740   1.420  -9.680
   43    H    ALA  19           H        ALA  19  11.940   1.350  -6.140
   44    H    ALA  20           H        ALA  20  11.200  -2.010  -3.670
   45    H    SER  21           H        SER  21  14.800  -0.180  -2.390
   46    HG   SER  21           HG       SER  21  17.410   1.630  -1.950
   47    H    SER  22           H        SER  22  15.480  -2.360  -0.550
   48    HG   SER  22           HG       SER  22  18.690  -1.920   3.220
   49    H    SER  23           H        SER  23  17.370  -5.030   2.080
   50    HG   SER  23           HG       SER  23  17.410  -5.720   5.290
   51    H    ASN  24           H        ASN  24  16.280  -3.260   3.960
   52   1HD2  ASN  24           HD2      ASN  24  15.550  -4.930   8.770
   53   2HD2  ASN  24           HD2      ASN  24  14.520  -3.670   8.170
   54    OH   TYR  25           OH       TYR  25  10.090   3.270  -1.180
   55    H    TYR  25           H        TYR  25  14.330  -2.050   3.110
   56    HH   TYR  25           HH       TYR  25   9.100   3.120  -1.010
   57    H    CYS  26           H        CYS  26  11.560  -1.280   4.020
   58    H    ASN  27           H        ASN  27  12.300  -0.150   6.610
   59   1HD2  ASN  27           HD2      ASN  27  14.960  -1.890   9.980
   60   2HD2  ASN  27           HD2      ASN  27  15.180  -0.190  10.210
   61    H    GLN  28           H        GLN  28  13.240   2.940   6.990
   62   1HE2  GLN  28           HE2      GLN  28  12.640   8.770   8.960
   63   2HE2  GLN  28           HE2      GLN  28  11.920   8.400   7.420
   64    H    MET  29           H        MET  29  11.480   3.790   5.230
   65    H    MET  30           H        MET  30   8.790   3.230   6.180
   66    H    LYS  31           H        LYS  31   8.630   5.220   8.270
   67   1HZ   LYS  31           HZ2      LYS  31  11.930   4.040  12.280
   68   2HZ   LYS  31           HZ3      LYS  31  11.610   4.050  10.670
   69   3HZ   LYS  31           HZ1      LYS  31  13.130   4.300  11.210
   70    H    SER  32           H        SER  32   8.910   7.460   6.950
   71    HG   SER  32           HG       SER  32  11.000   8.610   4.580
   72    NH1  ARG  33           NH2      ARG  33   7.270   9.600   0.790
   73    NH2  ARG  33           NH1      ARG  33   6.480   8.490  -1.040
   74    H    ARG  33           H        ARG  33   6.350   7.740   5.360
   75    HE   ARG  33           HE       ARG  33   5.330   7.040   0.540
   76   1HH1  ARG  33           HH2      ARG  33   7.310   9.710   1.790
   77   2HH1  ARG  33           HH2      ARG  33   7.740  10.240   0.190
   78   1HH2  ARG  33           HH1      ARG  33   5.910   7.790  -1.450
   79   2HH2  ARG  33           HH1      ARG  33   6.980   9.140  -1.620
   80    H    ASN  34           H        ASN  34   5.230   9.610   7.550
   81   1HD2  ASN  34           HD2      ASN  34   0.130  10.900   7.550
   82   2HD2  ASN  34           HD2      ASN  34   1.500   9.850   7.270
   83    H    LEU  35           H        LEU  35   3.740   6.990   8.240
   84    H    THR  36           H        THR  36   4.270   6.190  10.780
   85    HG1  THR  36           HG1      THR  36   6.920   6.030  12.590
   86    H    LYS  37           H        LYS  37   2.480   7.110  12.820
   87   1HZ   LYS  37           HZ3      LYS  37   0.720  12.440  14.610
   88   2HZ   LYS  37           HZ1      LYS  37   0.200  13.140  13.230
   89   3HZ   LYS  37           HZ2      LYS  37  -0.900  12.480  14.290
   90    H    ASP  38           H        ASP  38   2.230   6.320  15.560
   91    NH1  ARG  39           NH2      ARG  39   0.200  -2.240  18.810
   92    NH2  ARG  39           NH1      ARG  39   1.620  -2.680  17.080
   93    H    ARG  39           H        ARG  39   1.430   4.390  16.710
   94    HE   ARG  39           HE       ARG  39   1.360  -0.320  16.510
   95   1HH1  ARG  39           HH2      ARG  39  -0.390  -1.610  19.300
   96   2HH1  ARG  39           HH2      ARG  39   0.280  -3.190  19.090
   97   1HH2  ARG  39           HH1      ARG  39   2.140  -2.380  16.280
   98   2HH2  ARG  39           HH1      ARG  39   1.660  -3.630  17.380
   99    H    CYS  40           H        CYS  40   4.740   1.550  16.560
  100    H    LYS  41           H        LYS  41   3.450   1.250  12.200
  101   1HZ   LYS  41           HZ1      LYS  41  -0.130   2.540  10.670
  102   2HZ   LYS  41           HZ2      LYS  41  -0.070   3.390   9.290
  103   3HZ   LYS  41           HZ3      LYS  41  -1.430   3.370  10.200
  104    H    VAL  43           H        VAL  43   0.800  -3.420   9.850
  105    H    ASN  44           H        ASN  44   2.850  -4.160   6.160
  106   1HD2  ASN  44           HD2      ASN  44   2.200   1.400   3.750
  107   2HD2  ASN  44           HD2      ASN  44   1.370   0.810   5.170
  108    H    THR  45           H        THR  45   1.300  -1.690   2.930
  109    HG1  THR  45           HG1      THR  45   2.040  -4.850   2.290
  110    H    PHE  46           H        PHE  46   4.520  -1.590   0.640
  111    H    VAL  47           H        VAL  47   3.270   1.470  -2.300
  112    H    HIS  48           H        HIS  48   5.100   0.000  -5.680
  113    HD1  HIS  48           HD1      HIS  48   8.930   2.760  -4.730
  114    HE2  HIS  48           HE2      HIS  48   8.960  -0.630  -2.510
  115    H    GLU  49           H        GLU  49   3.830   2.940  -7.080
  116    H    SER  50           H        SER  50   3.620   5.150 -10.870
  117    HG   SER  50           HG       SER  50   2.180   5.550 -12.560
  118    H    LEU  51           H        LEU  51   0.370   7.980  -8.990
  119    H    ALA  52           H        ALA  52  -1.400   8.050 -11.510
  120    H    ASP  53           H        ASP  53  -0.510   5.190 -12.440
  121    H    VAL  54           H        VAL  54  -1.890   3.720 -10.590
  122    H    GLN  55           H        GLN  55  -4.240   4.360 -10.650
  123   1HE2  GLN  55           HE2      GLN  55  -7.960   9.120 -10.480
  124   2HE2  GLN  55           HE2      GLN  55  -8.510   7.480 -10.230
  125    H    ALA  56           H        ALA  56  -4.790   2.970 -13.000
  126    H    VAL  57           H        VAL  57  -5.820   0.560 -11.630
  127    H    CYS  58           H        CYS  58  -8.120   0.630 -10.960
  128    H    SER  59           H        SER  59  -9.330   0.020 -13.400
  129    HG   SER  59           HG       SER  59 -11.000   2.020 -14.540
  130    H    GLN  60           H        GLN  60 -10.090  -2.400 -13.400
  131   1HE2  GLN  60           HE2      GLN  60  -4.600  -2.890 -15.350
  132   2HE2  GLN  60           HE2      GLN  60  -6.070  -1.960 -15.570
  133    H    LYS  61           H        LYS  61  -9.990  -6.550 -13.700
  134   1HZ   LYS  61           HZ2      LYS  61 -10.950 -12.460 -16.770
  135   2HZ   LYS  61           HZ3      LYS  61 -11.370 -12.210 -18.340
  136   3HZ   LYS  61           HZ1      LYS  61  -9.960 -11.630 -17.750
  137    H    ASN  62           H        ASN  62 -14.190  -6.780 -12.380
  138   1HD2  ASN  62           HD2      ASN  62 -16.330  -5.820  -7.130
  139   2HD2  ASN  62           HD2      ASN  62 -14.980  -5.200  -8.040
  140    H    VAL  63           H        VAL  63 -13.650  -6.940  -7.860
  141    H    ALA  64           H        ALA  64 -13.290 -10.320  -5.090
  142    H    CYS  65           H        CYS  65 -14.100  -7.330  -1.870
  143    H    LYS  66           H        LYS  66 -10.220  -7.780   0.700
  144   1HZ   LYS  66           HZ1      LYS  66  -6.330 -12.500   2.040
  145   2HZ   LYS  66           HZ2      LYS  66  -6.900 -12.810   0.550
  146   3HZ   LYS  66           HZ3      LYS  66  -5.320 -12.380   0.770
  147    H    ASN  67           H        ASN  67 -12.370  -7.680   2.900
  148   1HD2  ASN  67           HD2      ASN  67 -14.390  -4.170   4.260
  149   2HD2  ASN  67           HD2      ASN  67 -14.400  -5.080   5.730
  150    H    GLY  68           H        GLY  68 -14.170  -9.240   1.750
  151    H    GLN  69           H        GLN  69 -15.470  -7.050   1.500
  152   1HE2  GLN  69           HE2      GLN  69 -15.690  -1.720  -1.780
  153   2HE2  GLN  69           HE2      GLN  69 -14.950  -2.090  -0.260
  154    H    THR  70           H        THR  70 -18.530  -5.500  -1.520
  155    HG1  THR  70           HG1      THR  70 -20.810  -4.990  -3.830
  156    H    ASN  71           H        ASN  71 -16.770  -3.970  -2.800
  157   1HD2  ASN  71           HD2      ASN  71 -14.808  -0.054  -1.898
  158   2HD2  ASN  71           HD2      ASN  71 -14.305  -0.740  -3.406
  159    H    CYS  72           H        CYS  72 -14.460  -5.000  -5.240
  160    OH   TYR  73           OH       TYR  73 -16.090  -1.290  -8.950
  161    H    TYR  73           H        TYR  73 -10.430  -3.800  -6.610
  162    HH   TYR  73           HH       TYR  73 -16.720  -1.870  -9.480
  163    H    GLN  74           H        GLN  74  -9.740  -6.340 -10.100
  164   1HE2  GLN  74           HE2      GLN  74  -6.360 -11.840  -8.640
  165   2HE2  GLN  74           HE2      GLN  74  -7.070 -10.510  -7.750
  166    H    SER  75           H        SER  75  -5.180  -6.060 -10.160
  167    HG   SER  75           HG       SER  75  -1.910  -6.080 -11.740
  168    OH   TYR  76           OH       TYR  76  -8.900  -7.850 -12.680
  169    H    TYR  76           H        TYR  76  -4.910  -6.910 -14.650
  170    HH   TYR  76           HH       TYR  76  -8.780  -8.470 -11.910
  171    H    SER  77           H        SER  77  -2.320  -7.290 -14.400
  172    HG   SER  77           HG       SER  77  -0.410  -6.360 -16.900
  173    H    THR  78           H        THR  78   2.000  -7.870 -13.860
  174    HG1  THR  78           HG1      THR  78   4.730  -6.990 -12.800
  175    H    MET  79           H        MET  79   2.270  -6.010  -9.740
  176    H    SER  80           H        SER  80   4.940  -2.440  -9.580
  177    HG   SER  80           HG       SER  80   8.990  -1.480  -7.840
  178    H    ILE  81           H        ILE  81   5.870  -4.780  -5.980
  179    H    THR  82           H        THR  82   5.340  -2.640  -2.260
  180    HG1  THR  82           HG1      THR  82   8.430  -3.060  -2.800
  181    H    ASP  83           H        ASP  83   6.750  -5.750  -0.220
  182    H    CYS  84           H        CYS  84   4.600  -4.940   3.610
  183    NH1  ARG  85           NH2      ARG  85   5.250  -8.820  13.220
  184    NH2  ARG  85           NH1      ARG  85   3.120  -9.520  13.420
  185    H    ARG  85           H        ARG  85   7.330  -5.880   7.030
  186    HE   ARG  85           HE       ARG  85   3.170  -9.700  10.940
  187   1HH1  ARG  85           HH2      ARG  85   6.060  -8.600  12.670
  188   2HH1  ARG  85           HH2      ARG  85   5.280  -8.720  14.210
  189   1HH2  ARG  85           HH1      ARG  85   2.250  -9.830  13.040
  190   2HH2  ARG  85           HH1      ARG  85   3.240  -9.430  14.410
  191    H    GLU  86           H        GLU  86   5.290  -5.510  10.760
  192    H    THR  87           H        THR  87   9.560  -5.080  12.390
  193    HG1  THR  87           HG1      THR  87  11.480  -4.500  13.090
  194    H    GLY  88           H        GLY  88  11.130  -8.650  15.020
  195    H    SER  89           H        SER  89  12.040  -6.210  16.020
  196    HG   SER  89           HG       SER  89  14.190  -6.200  18.700
  197    H    SER  90           H        SER  90  10.170  -4.420  16.470
  198    HG   SER  90           HG       SER  90   7.790  -1.350  14.620
  199    H    LYS  91           H        LYS  91  10.950  -0.520  17.280
  200   1HZ   LYS  91           HZ2      LYS  91  12.500  -1.440  23.930
  201   2HZ   LYS  91           HZ3      LYS  91  13.090  -0.080  23.230
  202   3HZ   LYS  91           HZ1      LYS  91  12.040   0.040  24.470
  203    OH   TYR  92           OH       TYR  92   5.250   9.390  18.390
  204    H    TYR  92           H        TYR  92   8.220   2.020  19.840
  205    HH   TYR  92           HH       TYR  92   4.570   9.330  17.640
  206    H    ASN  94           H        ASN  94  11.570   3.930  17.660
  207   1HD2  ASN  94           HD2      ASN  94  13.850   0.790  19.000
  208   2HD2  ASN  94           HD2      ASN  94  14.130   0.740  17.290
  209    H    CYS  95           H        CYS  95  10.580   3.320  14.330
  210    H    ALA  96           H        ALA  96  10.410  -1.140  13.430
  211    OH   TYR  97           OH       TYR  97   5.550  -0.320  11.190
  212    H    TYR  97           H        TYR  97  12.020  -2.240   9.620
  213    HH   TYR  97           HH       TYR  97   4.710  -0.890  11.070
  214    H    LYS  98           H        LYS  98   9.760  -5.950   8.770
  215   1HZ   LYS  98           HZ1      LYS  98   9.680 -11.960  10.440
  216   2HZ   LYS  98           HZ2      LYS  98   9.770 -11.270  11.920
  217   3HZ   LYS  98           HZ3      LYS  98   8.370 -11.210  11.060
  218    H    THR  99           H        THR  99  12.200  -6.280   5.240
  219    HG1  THR  99           HG1      THR  99  11.670  -3.950   5.570
  220    H    THR 100           H        THR 100   9.080  -6.250   2.030
  221    HG1  THR 100           HG1      THR 100  10.080  -9.140   2.160
  222    H    GLN 101           H        GLN 101  11.590  -6.940  -1.440
  223   1HE2  GLN 101           HE2      GLN 101   8.590  -3.990  -6.460
  224   2HE2  GLN 101           HE2      GLN 101   9.410  -5.510  -6.640
  225    H    ALA 102           H        ALA 102   8.160  -6.260  -4.180
  226    H    ASN 103           H        ASN 103   7.620  -9.050  -7.450
  227   1HD2  ASN 103           HD2      ASN 103   8.590  -5.000 -10.430
  228   2HD2  ASN 103           HD2      ASN 103   7.120  -5.710 -11.040
  229    H    LYS 104           H        LYS 104   3.890  -7.310  -7.820
  230   1HZ   LYS 104           HZ3      LYS 104   2.900 -12.030  -2.600
  231   2HZ   LYS 104           HZ1      LYS 104   3.590 -13.090  -3.630
  232   3HZ   LYS 104           HZ2      LYS 104   4.440 -12.550  -2.340
  233    H    HIS 105           H        HIS 105   0.450 -10.060  -8.390
  234    HD1  HIS 105           HD1      HIS 105  -3.840 -10.340 -11.320
  235    HE2  HIS 105           HE2      HIS 105  -0.590 -12.060 -12.990
  236    H    ILE 106           H        ILE 106  -2.560  -6.630  -9.010
  237    H    ILE 107           H        ILE 107  -4.290  -6.040  -5.040
  238    H    VAL 108           H        VAL 108  -7.540  -3.490  -6.340
  239    H    ALA 109           H        ALA 109  -8.970  -1.050  -2.890
  240    H    CYS 110           H        CYS 110 -12.820   0.000  -5.120
  241    H    GLU 111           H        GLU 111 -12.520   4.360  -5.790
  242    H    GLY 112           H        GLY 112 -16.220   6.680  -6.100
  243    H    ASN 113           H        ASN 113 -15.000  10.690  -7.460
  244   1HD2  ASN 113           HD2      ASN 113 -17.560  13.210 -12.280
  245   2HD2  ASN 113           HD2      ASN 113 -18.030  13.110 -10.600
  246    OH   TYR 115           OH       TYR 115 -16.240   1.430  -8.920
  247    H    TYR 115           H        TYR 115 -13.060   7.930 -11.650
  248    HH   TYR 115           HH       TYR 115 -15.810   0.540  -9.090
  249    H    VAL 116           H        VAL 116 -11.810   6.460  -7.800
  250    H    VAL 118           H        VAL 118  -9.680   3.090  -3.430
  251    H    HIS 119           H        HIS 119  -8.780   1.950  -1.920
  252    HD1  HIS 119           HD1      HIS 119  -8.140  -0.410   2.990
  253    HE2  HIS 119           HE2      HIS 119  -9.400  -3.930   1.440
  254    H    PHE 120           H        PHE 120  -5.780   0.080   0.540
  255    H    ASP 121           H        ASP 121  -5.550  -3.720  -1.740
  256    H    ALA 122           H        ALA 122  -5.270  -6.110  -2.100
  257    H    SER 123           H        SER 123  -1.390  -7.900  -1.560
  258    HG   SER 123           HG       SER 123   0.230  -6.110  -4.140
  259    H    VAL 124           H        VAL 124  -1.090  -9.790  -5.630
   
  Start of MODEL          27
 Raw file had 259 H/Q atoms
  Start of MODEL   27
    1   1H    LYS   1           H1       LYS   1  -8.930  16.950  -0.180
    2   2H    LYS   1           H2       LYS   1  -9.410  18.370   0.490
    3   3H    LYS   1           H3       LYS   1  -7.980  17.660   0.980
    4   1HZ   LYS   1           HZ2      LYS   1 -15.300  15.410   1.640
    5   2HZ   LYS   1           HZ3      LYS   1 -16.030  15.820   3.080
    6   3HZ   LYS   1           HZ1      LYS   1 -15.480  16.980   2.040
    7    H    GLU   2           H        GLU   2  -9.290  15.660   3.790
    8    H    THR   3           H        THR   3  -9.490  12.440   1.590
    9    HG1  THR   3           HG1      THR   3 -11.220  11.630  -0.810
   10    H    ALA   4           H        ALA   4 -11.670   8.610   2.340
   11    H    ALA   5           H        ALA   5 -10.160   8.240  -0.340
   12    H    ALA   6           H        ALA   6  -7.850  10.010   0.330
   13    H    LYS   7           H        LYS   7  -6.760   8.590   2.440
   14   1HZ   LYS   7           HZ1      LYS   7  -6.100   2.800   4.470
   15   2HZ   LYS   7           HZ2      LYS   7  -7.200   2.410   3.330
   16   3HZ   LYS   7           HZ3      LYS   7  -6.200   3.690   3.110
   17    H    PHE   8           H        PHE   8  -6.060   6.040   1.150
   18    H    GLU   9           H        GLU   9  -4.000   7.270  -0.660
   19    NH1  ARG  10           NH1      ARG  10  -3.010  11.840   5.670
   20    NH2  ARG  10           NH2      ARG  10  -4.340  10.170   6.520
   21    H    ARG  10           H        ARG  10  -2.090   8.190   1.480
   22    HE   ARG  10           HE       ARG  10  -2.430   8.750   6.010
   23   1HH1  ARG  10           HH1      ARG  10  -2.140  12.050   5.240
   24   2HH1  ARG  10           HH1      ARG  10  -3.710  12.530   5.820
   25   1HH2  ARG  10           HH2      ARG  10  -4.480   9.200   6.720
   26   2HH2  ARG  10           HH2      ARG  10  -5.060  10.820   6.720
   27    H    GLN  11           H        GLN  11  -1.450   5.770   2.920
   28   1HE2  GLN  11           HE2      GLN  11  -4.280   2.330   6.900
   29   2HE2  GLN  11           HE2      GLN  11  -2.870   3.250   7.340
   30    H    HIS  12           H        HIS  12  -0.440   4.270   0.760
   31    HD1  HIS  12           HD1      HIS  12   0.160  -0.170   0.580
   32    HE2  HIS  12           HE2      HIS  12  -3.090   0.900   2.680
   33    H    MET  13           H        MET  13   0.800   5.280  -1.070
   34    H    ASP  14           H        ASP  14   4.010   4.640  -4.140
   35    H    SER  15           H        SER  15   4.970   7.130  -4.860
   36    HG   SER  15           HG       SER  15   3.380   6.660  -7.150
   37    H    SER  16           H        SER  16   7.540   8.290  -5.320
   38    HG   SER  16           HG       SER  16   9.890   9.180  -3.230
   39    H    THR  17           H        THR  17   9.230   6.200  -5.400
   40    HG1  THR  17           HG1      THR  17  10.390   4.220  -2.780
   41    H    SER  18           H        SER  18  12.030   3.890  -7.780
   42    HG   SER  18           HG       SER  18  10.440   0.750 -10.170
   43    H    ALA  19           H        ALA  19  11.780   1.610  -6.140
   44    H    ALA  20           H        ALA  20  11.240  -1.760  -3.660
   45    H    SER  21           H        SER  21  14.830   0.220  -2.420
   46    HG   SER  21           HG       SER  21  17.730   1.840  -1.710
   47    H    SER  22           H        SER  22  15.610  -1.980  -0.740
   48    HG   SER  22           HG       SER  22  18.640  -1.340   2.950
   49    H    SER  23           H        SER  23  17.430  -4.990   1.590
   50    HG   SER  23           HG       SER  23  18.600  -7.030   3.490
   51    H    ASN  24           H        ASN  24  16.530  -3.080   3.510
   52   1HD2  ASN  24           HD2      ASN  24  16.620  -1.930   9.150
   53   2HD2  ASN  24           HD2      ASN  24  16.730  -3.330   8.120
   54    OH   TYR  25           OH       TYR  25  10.060   3.470  -1.180
   55    H    TYR  25           H        TYR  25  14.540  -1.840   2.860
   56    HH   TYR  25           HH       TYR  25   9.080   3.240  -1.030
   57    H    CYS  26           H        CYS  26  11.650  -1.110   4.010
   58    H    ASN  27           H        ASN  27  12.420   0.150   6.580
   59   1HD2  ASN  27           HD2      ASN  27  13.390  -2.420   8.380
   60   2HD2  ASN  27           HD2      ASN  27  13.910  -1.190   7.260
   61    H    GLN  28           H        GLN  28  13.480   3.120   6.730
   62   1HE2  GLN  28           HE2      GLN  28  16.310   3.460   9.130
   63   2HE2  GLN  28           HE2      GLN  28  15.690   5.080   9.330
   64    H    MET  29           H        MET  29  11.510   3.960   5.050
   65    H    MET  30           H        MET  30   8.960   3.460   5.970
   66    H    LYS  31           H        LYS  31   8.860   5.410   8.030
   67   1HZ   LYS  31           HZ1      LYS  31  10.840   3.790  11.180
   68   2HZ   LYS  31           HZ2      LYS  31  12.420   4.050  11.400
   69   3HZ   LYS  31           HZ3      LYS  31  11.540   3.260  12.540
   70    H    SER  32           H        SER  32   9.050   7.830   6.840
   71    HG   SER  32           HG       SER  32   8.300  11.170   4.290
   72    NH1  ARG  33           NH2      ARG  33   3.720  10.880   1.380
   73    NH2  ARG  33           NH1      ARG  33   2.080   9.620   0.450
   74    H    ARG  33           H        ARG  33   6.460   7.910   5.500
   75    HE   ARG  33           HE       ARG  33   3.260   7.720   1.550
   76   1HH1  ARG  33           HH2      ARG  33   4.520  10.940   1.970
   77   2HH1  ARG  33           HH2      ARG  33   3.280  11.700   1.020
   78   1HH2  ARG  33           HH1      ARG  33   1.670   8.720   0.260
   79   2HH2  ARG  33           HH1      ARG  33   1.650  10.450   0.130
   80    H    ASN  34           H        ASN  34   5.200   9.680   7.550
   81   1HD2  ASN  34           HD2      ASN  34   3.370  13.110   6.260
   82   2HD2  ASN  34           HD2      ASN  34   2.460  11.620   6.140
   83    H    LEU  35           H        LEU  35   3.300   7.470   8.030
   84    H    THR  36           H        THR  36   4.540   6.230  10.380
   85    HG1  THR  36           HG1      THR  36   7.490   5.500  11.940
   86    H    LYS  37           H        LYS  37   4.140   7.870  12.200
   87   1HZ   LYS  37           HZ3      LYS  37   6.780  13.600  10.770
   88   2HZ   LYS  37           HZ1      LYS  37   7.660  12.950   9.560
   89   3HZ   LYS  37           HZ2      LYS  37   6.040  12.780   9.560
   90    H    ASP  38           H        ASP  38   2.510   7.340  14.170
   91    NH1  ARG  39           NH2      ARG  39  -2.670   0.360  14.680
   92    NH2  ARG  39           NH1      ARG  39  -4.050   1.610  13.370
   93    H    ARG  39           H        ARG  39   1.230   5.390  14.600
   94    HE   ARG  39           HE       ARG  39  -3.070   3.530  14.590
   95   1HH1  ARG  39           HH2      ARG  39  -1.960   0.320  15.390
   96   2HH1  ARG  39           HH2      ARG  39  -2.980  -0.470  14.230
   97   1HH2  ARG  39           HH1      ARG  39  -4.400   2.500  13.090
   98   2HH2  ARG  39           HH1      ARG  39  -4.350   0.770  12.930
   99    H    CYS  40           H        CYS  40   3.280   1.910  16.040
  100    H    LYS  41           H        LYS  41   3.050   1.220  11.730
  101   1HZ   LYS  41           HZ3      LYS  41  -1.490   1.240   6.270
  102   2HZ   LYS  41           HZ1      LYS  41  -0.380   0.260   5.570
  103   3HZ   LYS  41           HZ2      LYS  41  -1.950  -0.170   5.590
  104    H    VAL  43           H        VAL  43   0.860  -3.870   9.680
  105    H    ASN  44           H        ASN  44   3.270  -4.050   6.330
  106   1HD2  ASN  44           HD2      ASN  44   2.190   1.570   4.030
  107   2HD2  ASN  44           HD2      ASN  44   2.970   1.430   5.600
  108    H    THR  45           H        THR  45   1.300  -2.090   3.000
  109    HG1  THR  45           HG1      THR  45   2.220  -5.400   1.470
  110    H    PHE  46           H        PHE  46   4.670  -1.690   0.730
  111    H    VAL  47           H        VAL  47   3.370   1.440  -2.180
  112    H    HIS  48           H        HIS  48   4.990   0.030  -5.790
  113    HD1  HIS  48           HD1      HIS  48   8.810   2.910  -4.760
  114    HE2  HIS  48           HE2      HIS  48   9.210  -0.480  -2.570
  115    H    GLU  49           H        GLU  49   3.630   2.630  -7.200
  116    H    SER  50           H        SER  50   3.450   5.300 -10.740
  117    HG   SER  50           HG       SER  50   2.130   5.800 -12.480
  118    H    LEU  51           H        LEU  51   0.240   8.120  -8.810
  119    H    ALA  52           H        ALA  52  -1.400   8.150 -11.200
  120    H    ASP  53           H        ASP  53  -0.600   5.390 -12.220
  121    H    VAL  54           H        VAL  54  -1.910   3.900 -10.460
  122    H    GLN  55           H        GLN  55  -4.230   4.400 -10.390
  123   1HE2  GLN  55           HE2      GLN  55  -7.930   9.090 -10.090
  124   2HE2  GLN  55           HE2      GLN  55  -8.480   7.450  -9.870
  125    H    ALA  56           H        ALA  56  -4.790   3.020 -12.760
  126    H    VAL  57           H        VAL  57  -5.720   0.540 -11.410
  127    H    CYS  58           H        CYS  58  -8.060   0.570 -10.800
  128    H    SER  59           H        SER  59  -9.390  -0.040 -13.140
  129    HG   SER  59           HG       SER  59  -9.180  -0.120 -16.380
  130    H    GLN  60           H        GLN  60 -10.060  -2.650 -13.030
  131   1HE2  GLN  60           HE2      GLN  60  -4.550  -3.020 -15.110
  132   2HE2  GLN  60           HE2      GLN  60  -6.050  -2.130 -15.210
  133    H    LYS  61           H        LYS  61  -9.710  -6.800 -13.350
  134   1HZ   LYS  61           HZ2      LYS  61 -11.200  -7.070 -17.770
  135   2HZ   LYS  61           HZ3      LYS  61 -10.310  -8.320 -18.360
  136   3HZ   LYS  61           HZ1      LYS  61 -11.790  -8.000 -18.990
  137    H    ASN  62           H        ASN  62 -13.900  -7.220 -12.030
  138   1HD2  ASN  62           HD2      ASN  62 -16.270  -6.270  -6.910
  139   2HD2  ASN  62           HD2      ASN  62 -14.820  -5.710  -7.710
  140    H    VAL  63           H        VAL  63 -13.340  -7.130  -7.530
  141    H    ALA  64           H        ALA  64 -12.960 -10.360  -4.590
  142    H    CYS  65           H        CYS  65 -13.890  -7.290  -1.490
  143    H    LYS  66           H        LYS  66 -10.240  -8.000   1.220
  144   1HZ   LYS  66           HZ1      LYS  66  -4.870  -9.520   3.390
  145   2HZ   LYS  66           HZ2      LYS  66  -5.180 -11.090   3.720
  146   3HZ   LYS  66           HZ3      LYS  66  -4.280 -10.670   2.400
  147    H    ASN  67           H        ASN  67 -12.250  -7.420   3.500
  148   1HD2  ASN  67           HD2      ASN  67 -14.810  -3.780   4.030
  149   2HD2  ASN  67           HD2      ASN  67 -14.950  -4.470   5.620
  150    H    GLY  68           H        GLY  68 -14.380  -8.750   2.330
  151    H    GLN  69           H        GLN  69 -15.460  -6.680   1.720
  152   1HE2  GLN  69           HE2      GLN  69 -14.400  -0.540   0.270
  153   2HE2  GLN  69           HE2      GLN  69 -15.190  -1.310  -1.070
  154    H    THR  70           H        THR  70 -18.450  -5.690  -1.490
  155    HG1  THR  70           HG1      THR  70 -20.640  -5.450  -3.930
  156    H    ASN  71           H        ASN  71 -16.180  -4.430  -2.650
  157   1HD2  ASN  71           HD2      ASN  71 -14.531  -0.824  -1.218
  158   2HD2  ASN  71           HD2      ASN  71 -14.081  -1.221  -2.843
  159    H    CYS  72           H        CYS  72 -14.170  -5.190  -5.030
  160    OH   TYR  73           OH       TYR  73 -15.850  -1.550  -8.650
  161    H    TYR  73           H        TYR  73 -10.190  -4.000  -6.320
  162    HH   TYR  73           HH       TYR  73 -16.480  -2.190  -9.110
  163    H    GLN  74           H        GLN  74  -9.500  -6.660  -9.710
  164   1HE2  GLN  74           HE2      GLN  74  -6.130 -12.150  -9.760
  165   2HE2  GLN  74           HE2      GLN  74  -6.170 -10.700 -10.740
  166    H    SER  75           H        SER  75  -5.050  -6.050  -9.900
  167    HG   SER  75           HG       SER  75  -1.790  -6.190 -11.640
  168    OH   TYR  76           OH       TYR  76  -8.550  -8.840 -12.150
  169    H    TYR  76           H        TYR  76  -4.580  -6.800 -14.440
  170    HH   TYR  76           HH       TYR  76  -8.330  -7.900 -11.850
  171    H    SER  77           H        SER  77  -2.110  -7.260 -14.310
  172    HG   SER  77           HG       SER  77   0.210  -6.100 -16.680
  173    H    THR  78           H        THR  78   2.160  -8.090 -13.730
  174    HG1  THR  78           HG1      THR  78   4.470  -6.860 -12.910
  175    H    MET  79           H        MET  79   2.510  -6.040  -9.680
  176    H    SER  80           H        SER  80   5.070  -2.410  -9.510
  177    HG   SER  80           HG       SER  80   9.030  -1.280  -7.640
  178    H    ILE  81           H        ILE  81   5.960  -4.740  -5.990
  179    H    THR  82           H        THR  82   5.500  -2.580  -2.210
  180    HG1  THR  82           HG1      THR  82   8.550  -2.770  -2.880
  181    H    ASP  83           H        ASP  83   7.040  -5.750  -0.210
  182    H    CYS  84           H        CYS  84   5.030  -4.880   3.650
  183    NH1  ARG  85           NH2      ARG  85   5.070 -10.090  11.050
  184    NH2  ARG  85           NH1      ARG  85   2.970 -10.920  11.140
  185    H    ARG  85           H        ARG  85   7.710  -6.060   6.930
  186    HE   ARG  85           HE       ARG  85   3.110 -10.850   8.620
  187   1HH1  ARG  85           HH2      ARG  85   5.830  -9.750  10.490
  188   2HH1  ARG  85           HH2      ARG  85   5.110 -10.080  12.040
  189   1HH2  ARG  85           HH1      ARG  85   2.090 -11.130  10.730
  190   2HH2  ARG  85           HH1      ARG  85   3.120 -11.060  12.120
  191    H    GLU  86           H        GLU  86   5.380  -5.840  10.670
  192    H    THR  87           H        THR  87   9.400  -5.300  12.750
  193    HG1  THR  87           HG1      THR  87  11.290  -4.740  13.410
  194    H    GLY  88           H        GLY  88  10.910  -8.950  15.270
  195    H    SER  89           H        SER  89  12.070  -6.830  16.740
  196    HG   SER  89           HG       SER  89  13.950  -4.790  16.260
  197    H    SER  90           H        SER  90   9.730  -4.840  17.400
  198    HG   SER  90           HG       SER  90   7.540  -2.000  15.090
  199    H    LYS  91           H        LYS  91  10.040  -0.720  17.900
  200   1HZ   LYS  91           HZ3      LYS  91   8.810  -4.170  20.650
  201   2HZ   LYS  91           HZ1      LYS  91  10.350  -4.700  20.720
  202   3HZ   LYS  91           HZ2      LYS  91   9.190  -5.480  21.550
  203    OH   TYR  92           OH       TYR  92   4.270   8.940  18.680
  204    H    TYR  92           H        TYR  92   6.600   1.360  19.870
  205    HH   TYR  92           HH       TYR  92   4.030   9.130  17.710
  206    H    ASN  94           H        ASN  94  10.250   3.430  18.260
  207   1HD2  ASN  94           HD2      ASN  94  12.600   0.450  20.000
  208   2HD2  ASN  94           HD2      ASN  94  13.410   0.550  18.460
  209    H    CYS  95           H        CYS  95   9.960   3.020  14.770
  210    H    ALA  96           H        ALA  96  10.060  -1.380  14.120
  211    OH   TYR  97           OH       TYR  97   5.420  -0.440  11.180
  212    H    TYR  97           H        TYR  97  11.960  -2.030  10.310
  213    HH   TYR  97           HH       TYR  97   4.630  -1.050  11.000
  214    H    LYS  98           H        LYS  98   9.910  -5.760   8.910
  215   1HZ   LYS  98           HZ2      LYS  98  13.170  -9.150   4.200
  216   2HZ   LYS  98           HZ3      LYS  98  13.250 -10.780   3.940
  217   3HZ   LYS  98           HZ1      LYS  98  11.880 -10.090   4.510
  218    H    THR  99           H        THR  99  12.520  -6.160   5.290
  219    HG1  THR  99           HG1      THR  99  11.590  -3.720   5.570
  220    H    THR 100           H        THR 100   9.550  -6.030   2.010
  221    HG1  THR 100           HG1      THR 100  11.170  -8.810   2.090
  222    H    GLN 101           H        GLN 101  11.880  -6.690  -1.540
  223   1HE2  GLN 101           HE2      GLN 101   8.730  -4.140  -6.510
  224   2HE2  GLN 101           HE2      GLN 101   9.710  -5.570  -6.610
  225    H    ALA 102           H        ALA 102   8.260  -6.250  -4.060
  226    H    ASN 103           H        ASN 103   7.900  -8.960  -7.420
  227   1HD2  ASN 103           HD2      ASN 103   8.890  -5.070 -10.660
  228   2HD2  ASN 103           HD2      ASN 103   7.580  -5.970 -11.380
  229    H    LYS 104           H        LYS 104   4.080  -7.360  -7.760
  230   1HZ   LYS 104           HZ3      LYS 104   2.890 -12.360  -2.370
  231   2HZ   LYS 104           HZ1      LYS 104   4.420 -12.830  -2.050
  232   3HZ   LYS 104           HZ2      LYS 104   4.010 -11.260  -1.890
  233    H    HIS 105           H        HIS 105   0.660 -10.090  -8.230
  234    HD1  HIS 105           HD1      HIS 105  -3.650 -10.400 -11.020
  235    HE2  HIS 105           HE2      HIS 105  -0.420 -11.950 -12.870
  236    H    ILE 106           H        ILE 106  -2.310  -6.560  -8.780
  237    H    ILE 107           H        ILE 107  -4.050  -6.110  -4.780
  238    H    VAL 108           H        VAL 108  -7.340  -3.640  -6.090
  239    H    ALA 109           H        ALA 109  -8.750  -1.100  -2.700
  240    H    CYS 110           H        CYS 110 -12.730  -0.100  -4.770
  241    H    GLU 111           H        GLU 111 -12.410   4.260  -5.520
  242    H    GLY 112           H        GLY 112 -16.220   6.440  -5.880
  243    H    ASN 113           H        ASN 113 -14.760  10.560  -7.060
  244   1HD2  ASN 113           HD2      ASN 113 -17.450  13.200 -11.860
  245   2HD2  ASN 113           HD2      ASN 113 -17.670  13.330 -10.140
  246    OH   TYR 115           OH       TYR 115 -16.000   1.140  -8.300
  247    H    TYR 115           H        TYR 115 -12.880   7.700 -11.310
  248    HH   TYR 115           HH       TYR 115 -15.610   0.250  -8.600
  249    H    VAL 116           H        VAL 116 -11.710   6.460  -7.430
  250    H    VAL 118           H        VAL 118  -9.540   2.890  -3.150
  251    H    HIS 119           H        HIS 119  -8.570   1.720  -1.610
  252    HD1  HIS 119           HD1      HIS 119  -8.430  -0.680   3.500
  253    HE2  HIS 119           HE2      HIS 119  -9.090  -4.130   1.480
  254    H    PHE 120           H        PHE 120  -5.580  -0.090   0.800
  255    H    ASP 121           H        ASP 121  -5.300  -4.000  -1.380
  256    H    ALA 122           H        ALA 122  -5.190  -6.510  -1.760
  257    H    SER 123           H        SER 123  -1.170  -8.130  -1.380
  258    HG   SER 123           HG       SER 123   1.110  -6.190  -3.010
  259    H    VAL 124           H        VAL 124  -1.240  -9.750  -5.540
   
  Start of MODEL          28
 Raw file had 259 H/Q atoms
  Start of MODEL   28
    1   1H    LYS   1           H1       LYS   1  -9.540  17.530   4.560
    2   2H    LYS   1           H2       LYS   1  -9.670  18.110   6.080
    3   3H    LYS   1           H3       LYS   1  -8.210  17.580   5.510
    4   1HZ   LYS   1           HZ1      LYS   1 -10.700  12.260   7.340
    5   2HZ   LYS   1           HZ2      LYS   1  -9.560  12.410   8.490
    6   3HZ   LYS   1           HZ3      LYS   1 -10.860  11.440   8.740
    7    H    GLU   2           H        GLU   2  -8.220  14.130   6.650
    8    H    THR   3           H        THR   3  -8.860  12.920   2.690
    9    HG1  THR   3           HG1      THR   3  -9.370  12.990  -0.040
   10    H    ALA   4           H        ALA   4 -11.490   9.240   2.000
   11    H    ALA   5           H        ALA   5  -9.840   8.890  -0.490
   12    H    ALA   6           H        ALA   6  -7.610  10.150   0.070
   13    H    LYS   7           H        LYS   7  -6.720   8.570   2.180
   14   1HZ   LYS   7           HZ1      LYS   7  -6.890   3.540   3.420
   15   2HZ   LYS   7           HZ2      LYS   7  -7.760   2.480   4.310
   16   3HZ   LYS   7           HZ3      LYS   7  -8.330   3.050   2.870
   17    H    PHE   8           H        PHE   8  -6.010   6.090   0.820
   18    H    GLU   9           H        GLU   9  -3.860   7.150  -0.890
   19    NH1  ARG  10           NH1      ARG  10  -1.060   8.340   8.560
   20    NH2  ARG  10           NH2      ARG  10  -3.200   7.610   8.420
   21    H    ARG  10           H        ARG  10  -2.090   8.040   1.430
   22    HE   ARG  10           HE       ARG  10  -3.070   8.220   6.060
   23   1HH1  ARG  10           HH1      ARG  10  -0.310   8.880   8.170
   24   2HH1  ARG  10           HH1      ARG  10  -1.020   8.000   9.500
   25   1HH2  ARG  10           HH2      ARG  10  -4.070   7.580   7.940
   26   2HH2  ARG  10           HH2      ARG  10  -3.130   7.310   9.370
   27    H    GLN  11           H        GLN  11  -1.460   5.580   2.630
   28   1HE2  GLN  11           HE2      GLN  11  -4.630   2.550   6.590
   29   2HE2  GLN  11           HE2      GLN  11  -3.430   3.790   6.900
   30    H    HIS  12           H        HIS  12  -0.330   4.240   0.690
   31    HD1  HIS  12           HD1      HIS  12   0.040  -0.360   0.430
   32    HE2  HIS  12           HE2      HIS  12  -3.180   0.740   2.540
   33    H    MET  13           H        MET  13   1.160   5.360  -0.960
   34    H    ASP  14           H        ASP  14   4.230   4.460  -4.060
   35    H    SER  15           H        SER  15   5.250   6.910  -5.020
   36    HG   SER  15           HG       SER  15   5.290   9.630  -7.050
   37    H    SER  16           H        SER  16   7.740   8.270  -5.230
   38    HG   SER  16           HG       SER  16  11.780   9.420  -5.580
   39    H    THR  17           H        THR  17   9.540   6.030  -5.060
   40    HG1  THR  17           HG1      THR  17  10.510   4.060  -2.320
   41    H    SER  18           H        SER  18  12.510   3.650  -7.160
   42    HG   SER  18           HG       SER  18  14.030   1.350  -8.980
   43    H    ALA  19           H        ALA  19  12.280   1.390  -5.670
   44    H    ALA  20           H        ALA  20  11.340  -2.010  -3.270
   45    H    SER  21           H        SER  21  14.910  -0.220  -1.840
   46    HG   SER  21           HG       SER  21  17.360   1.630  -1.380
   47    H    SER  22           H        SER  22  15.520  -2.200   0.080
   48    HG   SER  22           HG       SER  22  18.640  -2.040   3.810
   49    H    SER  23           H        SER  23  17.390  -5.020   2.630
   50    HG   SER  23           HG       SER  23  17.470  -5.870   5.820
   51    H    ASN  24           H        ASN  24  16.210  -3.370   4.510
   52   1HD2  ASN  24           HD2      ASN  24  15.320  -5.230   9.130
   53   2HD2  ASN  24           HD2      ASN  24  14.250  -3.990   8.560
   54    OH   TYR  25           OH       TYR  25  10.210   3.270  -0.800
   55    H    TYR  25           H        TYR  25  14.190  -2.210   3.570
   56    HH   TYR  25           HH       TYR  25   9.220   3.090  -0.670
   57    H    CYS  26           H        CYS  26  11.460  -1.470   4.320
   58    H    ASN  27           H        ASN  27  12.180  -0.260   6.910
   59   1HD2  ASN  27           HD2      ASN  27  14.360  -2.130  10.640
   60   2HD2  ASN  27           HD2      ASN  27  14.510  -0.420  10.930
   61    H    GLN  28           H        GLN  28  12.980   2.600   7.010
   62   1HE2  GLN  28           HE2      GLN  28  12.250   8.870   7.330
   63   2HE2  GLN  28           HE2      GLN  28  13.400   8.160   8.430
   64    H    MET  29           H        MET  29  11.170   3.460   5.440
   65    H    MET  30           H        MET  30   8.620   3.050   6.270
   66    H    LYS  31           H        LYS  31   8.660   5.250   8.100
   67   1HZ   LYS  31           HZ1      LYS  31   9.750  10.240  11.640
   68   2HZ   LYS  31           HZ2      LYS  31  10.600  10.940  12.840
   69   3HZ   LYS  31           HZ3      LYS  31  11.330  10.550  11.430
   70    H    SER  32           H        SER  32   9.150   7.510   7.160
   71    HG   SER  32           HG       SER  32  11.360   8.600   5.200
   72    NH1  ARG  33           NH2      ARG  33   3.610  10.940   1.420
   73    NH2  ARG  33           NH1      ARG  33   2.020   9.650   0.460
   74    H    ARG  33           H        ARG  33   6.720   7.720   5.250
   75    HE   ARG  33           HE       ARG  33   3.310   7.740   1.420
   76   1HH1  ARG  33           HH2      ARG  33   4.440  11.010   1.970
   77   2HH1  ARG  33           HH2      ARG  33   3.120  11.750   1.100
   78   1HH2  ARG  33           HH1      ARG  33   1.650   8.760   0.190
   79   2HH2  ARG  33           HH1      ARG  33   1.570  10.490   0.180
   80    H    ASN  34           H        ASN  34   3.740  10.230   6.880
   81   1HD2  ASN  34           HD2      ASN  34  -0.430  10.910   8.060
   82   2HD2  ASN  34           HD2      ASN  34   0.280  10.480   9.600
   83    H    LEU  35           H        LEU  35   3.310   7.140   8.250
   84    H    THR  36           H        THR  36   4.350   5.590  10.300
   85    HG1  THR  36           HG1      THR  36   7.260   5.420  12.390
   86    H    LYS  37           H        LYS  37   4.080   7.620  11.980
   87   1HZ   LYS  37           HZ2      LYS  37   7.280  11.230  14.210
   88   2HZ   LYS  37           HZ3      LYS  37   8.180  12.110  13.150
   89   3HZ   LYS  37           HZ1      LYS  37   7.470  12.840  14.430
   90    H    ASP  38           H        ASP  38   2.060   7.080  13.580
   91    NH1  ARG  39           NH2      ARG  39  -2.680   3.040  12.450
   92    NH2  ARG  39           NH1      ARG  39  -0.800   3.700  11.360
   93    H    ARG  39           H        ARG  39   0.910   4.940  14.280
   94    HE   ARG  39           HE       ARG  39   0.400   2.710  13.290
   95   1HH1  ARG  39           HH2      ARG  39  -3.100   2.590  13.240
   96   2HH1  ARG  39           HH2      ARG  39  -3.230   3.380  11.700
   97   1HH2  ARG  39           HH1      ARG  39   0.190   3.790  11.290
   98   2HH2  ARG  39           HH1      ARG  39  -1.390   4.050  10.630
   99    H    CYS  40           H        CYS  40   3.330   2.040  16.330
  100    H    LYS  41           H        LYS  41   3.080   1.010  12.080
  101   1HZ   LYS  41           HZ2      LYS  41  -2.140  -0.100   9.050
  102   2HZ   LYS  41           HZ3      LYS  41  -2.800   0.560   7.700
  103   3HZ   LYS  41           HZ1      LYS  41  -2.520  -1.040   7.760
  104    H    VAL  43           H        VAL  43   0.590  -3.760   9.800
  105    H    ASN  44           H        ASN  44   2.750  -4.460   6.220
  106   1HD2  ASN  44           HD2      ASN  44   2.120   1.120   3.890
  107   2HD2  ASN  44           HD2      ASN  44   1.240   0.490   5.260
  108    H    THR  45           H        THR  45   1.070  -2.150   2.990
  109    HG1  THR  45           HG1      THR  45   1.680  -5.390   1.410
  110    H    PHE  46           H        PHE  46   4.530  -1.800   0.730
  111    H    VAL  47           H        VAL  47   3.310   1.330  -2.170
  112    H    HIS  48           H        HIS  48   5.330   0.020  -5.510
  113    HD1  HIS  48           HD1      HIS  48   9.100   2.820  -4.400
  114    HE2  HIS  48           HE2      HIS  48   9.260  -0.670  -2.350
  115    H    GLU  49           H        GLU  49   3.970   2.850  -6.800
  116    H    SER  50           H        SER  50   3.390   4.980 -10.590
  117    HG   SER  50           HG       SER  50   2.300   5.420 -12.140
  118    H    LEU  51           H        LEU  51   0.320   8.000  -8.690
  119    H    ALA  52           H        ALA  52  -1.470   8.260 -11.110
  120    H    ASP  53           H        ASP  53  -0.510   5.620 -12.350
  121    H    VAL  54           H        VAL  54  -1.600   3.880 -10.460
  122    H    GLN  55           H        GLN  55  -4.110   4.430 -10.480
  123   1HE2  GLN  55           HE2      GLN  55  -7.840   9.130 -10.300
  124   2HE2  GLN  55           HE2      GLN  55  -8.350   7.490  -9.980
  125    H    ALA  56           H        ALA  56  -4.770   3.080 -12.870
  126    H    VAL  57           H        VAL  57  -5.670   0.590 -11.560
  127    H    CYS  58           H        CYS  58  -8.080   0.630 -10.930
  128    H    SER  59           H        SER  59  -9.380   0.020 -13.210
  129    HG   SER  59           HG       SER  59 -11.770   1.580 -14.210
  130    H    GLN  60           H        GLN  60 -10.060  -2.550 -13.160
  131   1HE2  GLN  60           HE2      GLN  60  -4.390  -2.800 -15.180
  132   2HE2  GLN  60           HE2      GLN  60  -5.840  -1.850 -15.440
  133    H    LYS  61           H        LYS  61  -9.630  -6.670 -13.760
  134   1HZ   LYS  61           HZ3      LYS  61 -13.720 -11.940 -11.430
  135   2HZ   LYS  61           HZ1      LYS  61 -14.810 -11.030 -12.220
  136   3HZ   LYS  61           HZ2      LYS  61 -14.780 -12.650 -12.480
  137    H    ASN  62           H        ASN  62 -13.800  -7.000 -12.440
  138   1HD2  ASN  62           HD2      ASN  62 -16.310  -5.980  -7.400
  139   2HD2  ASN  62           HD2      ASN  62 -14.930  -5.340  -8.270
  140    H    VAL  63           H        VAL  63 -13.370  -7.030  -7.910
  141    H    ALA  64           H        ALA  64 -12.810 -10.230  -5.030
  142    H    CYS  65           H        CYS  65 -13.950  -7.450  -1.820
  143    H    LYS  66           H        LYS  66 -10.140  -7.930   0.750
  144   1HZ   LYS  66           HZ3      LYS  66  -5.420  -8.410   4.480
  145   2HZ   LYS  66           HZ1      LYS  66  -4.590  -8.360   3.050
  146   3HZ   LYS  66           HZ2      LYS  66  -5.570  -7.110   3.460
  147    H    ASN  67           H        ASN  67 -12.320  -7.620   3.010
  148   1HD2  ASN  67           HD2      ASN  67 -14.590  -4.140   3.520
  149   2HD2  ASN  67           HD2      ASN  67 -14.950  -4.900   5.040
  150    H    GLY  68           H        GLY  68 -14.160  -9.210   1.850
  151    H    GLN  69           H        GLN  69 -15.540  -7.150   1.190
  152   1HE2  GLN  69           HE2      GLN  69 -18.450  -4.170   3.990
  153   2HE2  GLN  69           HE2      GLN  69 -19.190  -4.960   2.610
  154    H    THR  70           H        THR  70 -18.560  -6.010  -2.140
  155    HG1  THR  70           HG1      THR  70 -20.090  -5.280  -4.950
  156    H    ASN  71           H        ASN  71 -16.000  -4.720  -3.140
  157   1HD2  ASN  71           HD2      ASN  71 -16.817  -1.331  -0.852
  158   2HD2  ASN  71           HD2      ASN  71 -17.997  -1.434  -2.135
  159    H    CYS  72           H        CYS  72 -14.100  -5.170  -5.450
  160    OH   TYR  73           OH       TYR  73 -15.820  -1.610  -8.390
  161    H    TYR  73           H        TYR  73 -10.090  -4.090  -6.590
  162    HH   TYR  73           HH       TYR  73 -15.840  -1.240  -7.440
  163    H    GLN  74           H        GLN  74  -9.410  -6.560 -10.070
  164   1HE2  GLN  74           HE2      GLN  74  -6.690 -12.070 -10.590
  165   2HE2  GLN  74           HE2      GLN  74  -6.890 -10.500 -11.330
  166    H    SER  75           H        SER  75  -4.870  -6.160 -10.180
  167    HG   SER  75           HG       SER  75  -1.690  -6.040 -11.810
  168    OH   TYR  76           OH       TYR  76  -8.140  -8.390 -12.670
  169    H    TYR  76           H        TYR  76  -4.570  -6.610 -14.760
  170    HH   TYR  76           HH       TYR  76  -8.020  -7.400 -12.470
  171    H    SER  77           H        SER  77  -1.960  -6.970 -14.420
  172    HG   SER  77           HG       SER  77   2.020  -8.330 -16.790
  173    H    THR  78           H        THR  78   2.350  -7.520 -14.040
  174    HG1  THR  78           HG1      THR  78   4.760  -6.530 -13.070
  175    H    MET  79           H        MET  79   2.750  -5.820  -9.880
  176    H    SER  80           H        SER  80   5.290  -2.230  -9.520
  177    HG   SER  80           HG       SER  80   9.260  -1.390  -7.450
  178    H    ILE  81           H        ILE  81   6.090  -4.750  -5.970
  179    H    THR  82           H        THR  82   5.510  -2.650  -2.200
  180    HG1  THR  82           HG1      THR  82   8.760  -3.210  -2.510
  181    H    ASP  83           H        ASP  83   6.900  -5.860  -0.190
  182    H    CYS  84           H        CYS  84   4.650  -5.200   3.640
  183    NH1  ARG  85           NH2      ARG  85   1.240  -8.510  11.070
  184    NH2  ARG  85           NH1      ARG  85   2.440  -9.100  12.860
  185    H    ARG  85           H        ARG  85   7.280  -6.540   6.900
  186    HE   ARG  85           HE       ARG  85   4.140  -9.750  11.180
  187   1HH1  ARG  85           HH2      ARG  85   1.150  -8.520  10.070
  188   2HH1  ARG  85           HH2      ARG  85   0.480  -8.280  11.680
  189   1HH2  ARG  85           HH1      ARG  85   3.240  -9.540  13.260
  190   2HH2  ARG  85           HH1      ARG  85   1.620  -8.920  13.400
  191    H    GLU  86           H        GLU  86   4.880  -6.210  10.480
  192    H    THR  87           H        THR  87   8.730  -5.370  12.770
  193    HG1  THR  87           HG1      THR  87  10.630  -4.890  13.270
  194    H    GLY  88           H        GLY  88  10.490  -8.500  15.700
  195    H    SER  89           H        SER  89  11.620  -6.060  16.610
  196    HG   SER  89           HG       SER  89  13.580  -4.200  15.620
  197    H    SER  90           H        SER  90   9.430  -3.990  17.420
  198    HG   SER  90           HG       SER  90   7.010  -2.540  17.770
  199    H    LYS  91           H        LYS  91  10.490   0.160  17.110
  200   1HZ   LYS  91           HZ2      LYS  91  15.450   2.670  19.610
  201   2HZ   LYS  91           HZ3      LYS  91  16.250   2.100  18.290
  202   3HZ   LYS  91           HZ1      LYS  91  14.910   3.020  18.110
  203    OH   TYR  92           OH       TYR  92   3.510   9.410  18.230
  204    H    TYR  92           H        TYR  92   7.640   2.680  19.300
  205    HH   TYR  92           HH       TYR  92   3.070   9.390  17.310
  206    H    ASN  94           H        ASN  94  10.020   4.970  16.140
  207   1HD2  ASN  94           HD2      ASN  94  12.890   4.570  17.770
  208   2HD2  ASN  94           HD2      ASN  94  12.630   3.580  16.340
  209    H    CYS  95           H        CYS  95   9.320   3.060  13.210
  210    H    ALA  96           H        ALA  96   9.890  -1.410  13.950
  211    OH   TYR  97           OH       TYR  97   5.480  -0.360  11.270
  212    H    TYR  97           H        TYR  97  11.720  -2.680  10.160
  213    HH   TYR  97           HH       TYR  97   4.720  -1.020  11.390
  214    H    LYS  98           H        LYS  98   9.420  -6.270   8.980
  215   1HZ   LYS  98           HZ3      LYS  98  12.410 -11.560   6.930
  216   2HZ   LYS  98           HZ1      LYS  98  11.980 -12.600   8.110
  217   3HZ   LYS  98           HZ2      LYS  98  12.150 -13.140   6.570
  218    H    THR  99           H        THR  99  12.130  -6.390   5.580
  219    HG1  THR  99           HG1      THR  99  12.020  -4.100   5.810
  220    H    THR 100           H        THR 100   9.230  -6.380   2.200
  221    HG1  THR 100           HG1      THR 100  10.630  -9.330   2.210
  222    H    GLN 101           H        GLN 101  11.780  -6.890  -1.230
  223   1HE2  GLN 101           HE2      GLN 101   8.850  -4.120  -6.330
  224   2HE2  GLN 101           HE2      GLN 101   9.780  -5.560  -6.500
  225    H    ALA 102           H        ALA 102   8.260  -6.310  -3.960
  226    H    ASN 103           H        ASN 103   8.080  -8.910  -7.440
  227   1HD2  ASN 103           HD2      ASN 103   9.180  -5.080 -10.650
  228   2HD2  ASN 103           HD2      ASN 103   7.830  -5.970 -11.350
  229    H    LYS 104           H        LYS 104   4.240  -7.290  -7.920
  230   1HZ   LYS 104           HZ2      LYS 104   2.660 -12.080  -2.750
  231   2HZ   LYS 104           HZ3      LYS 104   3.880 -11.360  -1.920
  232   3HZ   LYS 104           HZ1      LYS 104   2.460 -10.580  -2.150
  233    H    HIS 105           H        HIS 105   0.740  -9.900  -8.510
  234    HD1  HIS 105           HD1      HIS 105  -3.270 -10.030 -11.760
  235    HE2  HIS 105           HE2      HIS 105   0.110 -11.640 -13.230
  236    H    ILE 106           H        ILE 106  -2.090  -6.300  -9.160
  237    H    ILE 107           H        ILE 107  -3.890  -6.040  -5.190
  238    H    VAL 108           H        VAL 108  -7.260  -3.670  -6.330
  239    H    ALA 109           H        ALA 109  -8.610  -1.120  -2.970
  240    H    CYS 110           H        CYS 110 -12.590  -0.180  -4.950
  241    H    GLU 111           H        GLU 111 -12.250   4.280  -5.650
  242    H    GLY 112           H        GLY 112 -15.940   6.720  -5.750
  243    H    ASN 113           H        ASN 113 -14.620  10.670  -7.240
  244   1HD2  ASN 113           HD2      ASN 113 -16.830  13.600 -11.840
  245   2HD2  ASN 113           HD2      ASN 113 -17.160  13.490 -10.120
  246    OH   TYR 115           OH       TYR 115 -16.180   1.270  -8.540
  247    H    TYR 115           H        TYR 115 -12.700   7.690 -11.520
  248    HH   TYR 115           HH       TYR 115 -15.820   0.390  -8.870
  249    H    VAL 116           H        VAL 116 -11.610   6.380  -7.640
  250    H    VAL 118           H        VAL 118  -9.490   2.990  -3.310
  251    H    HIS 119           H        HIS 119  -8.700   1.750  -1.780
  252    HD1  HIS 119           HD1      HIS 119  -7.870  -0.550   3.140
  253    HE2  HIS 119           HE2      HIS 119  -8.710  -4.160   1.540
  254    H    PHE 120           H        PHE 120  -5.460   0.060   0.440
  255    H    ASP 121           H        ASP 121  -5.430  -3.840  -1.810
  256    H    ALA 122           H        ALA 122  -5.050  -6.200  -2.230
  257    H    SER 123           H        SER 123  -1.340  -8.180  -1.670
  258    HG   SER 123           HG       SER 123   1.430  -6.590  -2.570
  259    H    VAL 124           H        VAL 124  -1.250  -9.650  -5.830
   
  Start of MODEL          29
 Raw file had 259 H/Q atoms
  Start of MODEL   29
    1   1H    LYS   1           H3       LYS   1  -8.850  17.760   4.850
    2   2H    LYS   1           H1       LYS   1  -8.970  18.180   6.430
    3   3H    LYS   1           H2       LYS   1  -7.560  17.570   5.850
    4   1HZ   LYS   1           HZ1      LYS   1 -11.420  14.330  10.390
    5   2HZ   LYS   1           HZ2      LYS   1 -10.480  15.660  10.300
    6   3HZ   LYS   1           HZ3      LYS   1 -12.030  15.780  10.840
    7    H    GLU   2           H        GLU   2  -8.300  13.920   6.750
    8    H    THR   3           H        THR   3  -8.830  12.840   2.780
    9    HG1  THR   3           HG1      THR   3  -9.620  13.210   0.300
   10    H    ALA   4           H        ALA   4 -11.470   9.170   2.130
   11    H    ALA   5           H        ALA   5 -10.050   8.710  -0.670
   12    H    ALA   6           H        ALA   6  -7.680  10.220   0.100
   13    H    LYS   7           H        LYS   7  -6.640   8.470   1.940
   14   1HZ   LYS   7           HZ2      LYS   7  -6.960   2.450   5.100
   15   2HZ   LYS   7           HZ3      LYS   7  -7.940   2.310   3.780
   16   3HZ   LYS   7           HZ1      LYS   7  -6.480   3.050   3.670
   17    H    PHE   8           H        PHE   8  -5.990   5.870   0.780
   18    H    GLU   9           H        GLU   9  -3.910   7.340  -1.060
   19    NH1  ARG  10           NH1      ARG  10  -0.740   8.970   8.250
   20    NH2  ARG  10           NH2      ARG  10  -2.840   8.110   8.120
   21    H    ARG  10           H        ARG  10  -2.040   8.220   1.190
   22    HE   ARG  10           HE       ARG  10  -2.780   8.800   5.800
   23   1HH1  ARG  10           HH1      ARG  10   0.020   9.470   7.820
   24   2HH1  ARG  10           HH1      ARG  10  -0.670   8.670   9.200
   25   1HH2  ARG  10           HH2      ARG  10  -3.700   7.990   7.620
   26   2HH2  ARG  10           HH2      ARG  10  -2.770   7.810   9.070
   27    H    GLN  11           H        GLN  11  -1.380   5.800   2.450
   28   1HE2  GLN  11           HE2      GLN  11  -3.200   0.460   4.860
   29   2HE2  GLN  11           HE2      GLN  11  -1.550   0.980   4.630
   30    H    HIS  12           H        HIS  12  -0.250   4.450   0.260
   31    HD1  HIS  12           HD1      HIS  12   0.240   0.170   0.380
   32    HE2  HIS  12           HE2      HIS  12  -3.290   1.220   1.900
   33    H    MET  13           H        MET  13   0.950   5.460  -1.630
   34    H    ASP  14           H        ASP  14   4.200   4.510  -4.590
   35    H    SER  15           H        SER  15   5.230   6.980  -5.720
   36    HG   SER  15           HG       SER  15   5.110   9.600  -7.800
   37    H    SER  16           H        SER  16   7.730   8.330  -6.120
   38    HG   SER  16           HG       SER  16  11.890   9.210  -6.260
   39    H    THR  17           H        THR  17   9.540   5.990  -5.710
   40    HG1  THR  17           HG1      THR  17  10.520   4.100  -2.880
   41    H    SER  18           H        SER  18  12.370   3.450  -7.800
   42    HG   SER  18           HG       SER  18  13.810   1.080  -9.680
   43    H    ALA  19           H        ALA  19  12.160   1.270  -6.180
   44    H    ALA  20           H        ALA  20  11.210  -1.900  -3.500
   45    H    SER  21           H        SER  21  14.800   0.060  -2.300
   46    HG   SER  21           HG       SER  21  17.580   1.790  -1.970
   47    H    SER  22           H        SER  22  15.510  -2.120  -0.500
   48    HG   SER  22           HG       SER  22  18.800  -1.890   3.200
   49    H    SER  23           H        SER  23  17.420  -4.880   2.040
   50    HG   SER  23           HG       SER  23  17.760  -5.520   5.170
   51    H    ASN  24           H        ASN  24  16.370  -3.060   3.940
   52   1HD2  ASN  24           HD2      ASN  24  15.580  -4.750   8.760
   53   2HD2  ASN  24           HD2      ASN  24  14.580  -3.440   8.190
   54    OH   TYR  25           OH       TYR  25  10.050   3.390  -1.220
   55    H    TYR  25           H        TYR  25  14.470  -1.790   3.110
   56    HH   TYR  25           HH       TYR  25   9.060   3.150  -1.170
   57    H    CYS  26           H        CYS  26  11.680  -1.140   4.110
   58    H    ASN  27           H        ASN  27  12.430  -0.020   6.620
   59   1HD2  ASN  27           HD2      ASN  27  14.730  -1.880  10.260
   60   2HD2  ASN  27           HD2      ASN  27  14.850  -0.170  10.590
   61    H    GLN  28           H        GLN  28  13.300   2.850   6.830
   62   1HE2  GLN  28           HE2      GLN  28  15.170   8.420   4.670
   63   2HE2  GLN  28           HE2      GLN  28  13.850   8.240   5.800
   64    H    MET  29           H        MET  29  11.360   3.720   5.370
   65    H    MET  30           H        MET  30   8.810   3.160   6.190
   66    H    LYS  31           H        LYS  31   9.000   4.850   8.360
   67   1HZ   LYS  31           HZ1      LYS  31  11.380   7.710  11.510
   68   2HZ   LYS  31           HZ2      LYS  31  12.500   8.060  12.640
   69   3HZ   LYS  31           HZ3      LYS  31  12.920   7.190  11.310
   70    H    SER  32           H        SER  32   9.430   7.450   7.530
   71    HG   SER  32           HG       SER  32   8.920  11.120   5.480
   72    NH1  ARG  33           NH2      ARG  33   4.860   8.460  -0.230
   73    NH2  ARG  33           NH1      ARG  33   3.280   6.910   0.140
   74    H    ARG  33           H        ARG  33   7.170   7.850   5.990
   75    HE   ARG  33           HE       ARG  33   3.480   7.540   2.520
   76   1HH1  ARG  33           HH2      ARG  33   5.460   9.200   0.090
   77   2HH1  ARG  33           HH2      ARG  33   4.800   8.240  -1.210
   78   1HH2  ARG  33           HH1      ARG  33   2.650   6.420   0.740
   79   2HH2  ARG  33           HH1      ARG  33   3.280   6.740  -0.850
   80    H    ASN  34           H        ASN  34   4.080  10.280   7.320
   81   1HD2  ASN  34           HD2      ASN  34   0.000  11.720   8.180
   82   2HD2  ASN  34           HD2      ASN  34   0.470  11.050   9.720
   83    H    LEU  35           H        LEU  35   3.210   7.170   8.270
   84    H    THR  36           H        THR  36   3.790   6.110  10.530
   85    HG1  THR  36           HG1      THR  36   5.960   5.450  10.600
   86    H    LYS  37           H        LYS  37   2.090   7.260  12.480
   87   1HZ   LYS  37           HZ1      LYS  37  -0.460  11.180  15.090
   88   2HZ   LYS  37           HZ2      LYS  37  -1.080  12.630  14.700
   89   3HZ   LYS  37           HZ3      LYS  37  -2.000  11.270  14.560
   90    H    ASP  38           H        ASP  38   1.420   6.560  15.150
   91    NH1  ARG  39           NH2      ARG  39   0.230  -1.710  19.060
   92    NH2  ARG  39           NH1      ARG  39   1.590  -2.340  17.340
   93    H    ARG  39           H        ARG  39   0.870   4.550  16.250
   94    HE   ARG  39           HE       ARG  39   0.720  -0.300  16.230
   95   1HH1  ARG  39           HH2      ARG  39  -0.430  -1.050  19.430
   96   2HH1  ARG  39           HH2      ARG  39   0.500  -2.510  19.580
   97   1HH2  ARG  39           HH1      ARG  39   2.000  -2.160  16.450
   98   2HH2  ARG  39           HH1      ARG  39   1.850  -3.140  17.860
   99    H    CYS  40           H        CYS  40   4.050   1.640  16.640
  100    H    LYS  41           H        LYS  41   3.220   1.130  12.210
  101   1HZ   LYS  41           HZ3      LYS  41  -1.290   1.850   6.960
  102   2HZ   LYS  41           HZ1      LYS  41  -2.120   2.980   7.800
  103   3HZ   LYS  41           HZ2      LYS  41  -0.500   3.060   7.740
  104    H    VAL  43           H        VAL  43   0.540  -3.530   9.880
  105    H    ASN  44           H        ASN  44   2.770  -3.690   6.270
  106   1HD2  ASN  44           HD2      ASN  44   2.060   1.450   3.290
  107   2HD2  ASN  44           HD2      ASN  44   3.350   0.720   4.190
  108    H    THR  45           H        THR  45   1.020  -1.590   2.920
  109    HG1  THR  45           HG1      THR  45   0.840  -5.090   1.450
  110    H    PHE  46           H        PHE  46   4.560  -1.430   0.640
  111    H    VAL  47           H        VAL  47   3.440   1.600  -2.390
  112    H    HIS  48           H        HIS  48   5.130  -0.010  -5.910
  113    HD1  HIS  48           HD1      HIS  48   9.100   2.760  -4.980
  114    HE2  HIS  48           HE2      HIS  48   9.140  -0.490  -2.560
  115    H    GLU  49           H        GLU  49   3.900   2.790  -7.100
  116    H    SER  50           H        SER  50   3.380   4.920 -10.880
  117    HG   SER  50           HG       SER  50   2.270   5.290 -12.550
  118    H    LEU  51           H        LEU  51   0.250   7.840  -8.980
  119    H    ALA  52           H        ALA  52  -1.550   8.040 -11.410
  120    H    ASP  53           H        ASP  53  -0.600   5.400 -12.750
  121    H    VAL  54           H        VAL  54  -1.900   3.750 -10.830
  122    H    GLN  55           H        GLN  55  -4.270   4.290 -10.810
  123   1HE2  GLN  55           HE2      GLN  55  -8.070   8.960 -10.560
  124   2HE2  GLN  55           HE2      GLN  55  -8.540   7.310 -10.230
  125    H    ALA  56           H        ALA  56  -4.910   2.910 -13.140
  126    H    VAL  57           H        VAL  57  -5.840   0.460 -11.740
  127    H    CYS  58           H        CYS  58  -8.170   0.590 -11.150
  128    H    SER  59           H        SER  59  -9.480  -0.070 -13.420
  129    HG   SER  59           HG       SER  59 -11.530   1.980 -14.890
  130    H    GLN  60           H        GLN  60 -10.080  -2.490 -13.420
  131   1HE2  GLN  60           HE2      GLN  60  -4.640  -3.110 -15.040
  132   2HE2  GLN  60           HE2      GLN  60  -6.040  -2.150 -15.480
  133    H    LYS  61           H        LYS  61  -9.970  -6.670 -13.610
  134   1HZ   LYS  61           HZ1      LYS  61 -15.450  -9.960 -16.700
  135   2HZ   LYS  61           HZ2      LYS  61 -15.480  -8.340 -16.940
  136   3HZ   LYS  61           HZ3      LYS  61 -15.240  -9.360 -18.200
  137    H    ASN  62           H        ASN  62 -14.110  -6.760 -12.190
  138   1HD2  ASN  62           HD2      ASN  62 -16.240  -6.030  -6.930
  139   2HD2  ASN  62           HD2      ASN  62 -14.960  -5.360  -7.900
  140    H    VAL  63           H        VAL  63 -13.440  -7.080  -7.720
  141    H    ALA  64           H        ALA  64 -13.120 -10.520  -5.020
  142    H    CYS  65           H        CYS  65 -13.730  -7.520  -1.750
  143    H    LYS  66           H        LYS  66  -9.800  -8.400   0.460
  144   1HZ   LYS  66           HZ2      LYS  66  -4.190  -9.650   3.530
  145   2HZ   LYS  66           HZ3      LYS  66  -4.830 -10.140   4.960
  146   3HZ   LYS  66           HZ1      LYS  66  -3.890 -11.150   4.100
  147    H    ASN  67           H        ASN  67 -11.630  -7.990   3.040
  148   1HD2  ASN  67           HD2      ASN  67 -13.870  -4.380   3.880
  149   2HD2  ASN  67           HD2      ASN  67 -13.520  -5.020   5.450
  150    H    GLY  68           H        GLY  68 -13.840  -9.330   1.950
  151    H    GLN  69           H        GLN  69 -15.070  -7.180   1.680
  152   1HE2  GLN  69           HE2      GLN  69 -15.970  -1.160   2.500
  153   2HE2  GLN  69           HE2      GLN  69 -17.280  -1.980   1.680
  154    H    THR  70           H        THR  70 -18.280  -5.960  -1.300
  155    HG1  THR  70           HG1      THR  70 -20.660  -5.440  -3.460
  156    H    ASN  71           H        ASN  71 -16.480  -4.180  -2.620
  157   1HD2  ASN  71           HD2      ASN  71 -14.995   0.099  -1.839
  158   2HD2  ASN  71           HD2      ASN  71 -15.677   0.454  -3.365
  159    H    CYS  72           H        CYS  72 -14.230  -5.300  -5.080
  160    OH   TYR  73           OH       TYR  73 -15.750  -1.180  -9.670
  161    H    TYR  73           H        TYR  73 -10.290  -4.010  -6.530
  162    HH   TYR  73           HH       TYR  73 -16.240  -1.670 -10.400
  163    H    GLN  74           H        GLN  74  -9.570  -6.550 -10.040
  164   1HE2  GLN  74           HE2      GLN  74  -6.440 -12.060  -8.560
  165   2HE2  GLN  74           HE2      GLN  74  -6.730 -10.580  -7.690
  166    H    SER  75           H        SER  75  -5.010  -6.260 -10.140
  167    HG   SER  75           HG       SER  75  -1.740  -5.890 -11.560
  168    OH   TYR  76           OH       TYR  76  -8.870  -8.280 -12.480
  169    H    TYR  76           H        TYR  76  -4.790  -7.070 -14.550
  170    HH   TYR  76           HH       TYR  76  -8.840  -9.030 -11.810
  171    H    SER  77           H        SER  77  -2.180  -7.640 -13.980
  172    HG   SER  77           HG       SER  77   1.970  -8.430 -16.690
  173    H    THR  78           H        THR  78   2.170  -8.040 -13.850
  174    HG1  THR  78           HG1      THR  78   4.490  -7.000 -12.930
  175    H    MET  79           H        MET  79   2.450  -6.060  -9.760
  176    H    SER  80           H        SER  80   5.010  -2.410  -9.600
  177    HG   SER  80           HG       SER  80   8.990  -1.410  -7.650
  178    H    ILE  81           H        ILE  81   5.830  -4.770  -6.010
  179    H    THR  82           H        THR  82   5.450  -2.510  -2.260
  180    HG1  THR  82           HG1      THR  82   8.570  -2.920  -2.750
  181    H    ASP  83           H        ASP  83   6.820  -5.650  -0.100
  182    H    CYS  84           H        CYS  84   4.590  -4.670   3.650
  183    NH1  ARG  85           NH2      ARG  85   1.700  -7.960  11.800
  184    NH2  ARG  85           NH1      ARG  85   3.010  -8.120  13.640
  185    H    ARG  85           H        ARG  85   7.280  -5.920   6.930
  186    HE   ARG  85           HE       ARG  85   4.900  -8.220  12.010
  187   1HH1  ARG  85           HH2      ARG  85   1.610  -7.950  10.800
  188   2HH1  ARG  85           HH2      ARG  85   0.910  -7.910  12.390
  189   1HH2  ARG  85           HH1      ARG  85   3.900  -8.250  14.080
  190   2HH2  ARG  85           HH1      ARG  85   2.180  -8.080  14.190
  191    H    GLU  86           H        GLU  86   5.110  -5.180  10.610
  192    H    THR  87           H        THR  87   9.230  -4.690  12.510
  193    HG1  THR  87           HG1      THR  87  11.000  -4.160  13.320
  194    H    GLY  88           H        GLY  88  10.580  -8.200  15.340
  195    H    SER  89           H        SER  89  11.960  -5.920  16.360
  196    HG   SER  89           HG       SER  89  13.310  -4.110  15.160
  197    H    SER  90           H        SER  90   9.600  -3.830  16.800
  198    HG   SER  90           HG       SER  90   6.990  -2.690  16.540
  199    H    LYS  91           H        LYS  91  10.530  -0.080  17.540
  200   1HZ   LYS  91           HZ3      LYS  91  14.720   1.380  19.320
  201   2HZ   LYS  91           HZ1      LYS  91  14.960   0.740  20.810
  202   3HZ   LYS  91           HZ2      LYS  91  15.770   0.130  19.530
  203    OH   TYR  92           OH       TYR  92   4.140   9.250  18.620
  204    H    TYR  92           H        TYR  92   7.320   1.910  18.960
  205    HH   TYR  92           HH       TYR  92   3.630   9.310  17.750
  206    H    ASN  94           H        ASN  94  10.790   4.200  17.770
  207   1HD2  ASN  94           HD2      ASN  94  13.550   4.900  19.720
  208   2HD2  ASN  94           HD2      ASN  94  12.730   3.410  19.350
  209    H    CYS  95           H        CYS  95  10.230   3.550  14.080
  210    H    ALA  96           H        ALA  96  10.620  -0.730  14.090
  211    OH   TYR  97           OH       TYR  97   5.170  -0.250  11.260
  212    H    TYR  97           H        TYR  97  11.850  -1.910   9.900
  213    HH   TYR  97           HH       TYR  97   4.420  -0.940  11.200
  214    H    LYS  98           H        LYS  98   9.590  -5.590   8.840
  215   1HZ   LYS  98           HZ2      LYS  98   9.250 -10.830   4.480
  216   2HZ   LYS  98           HZ3      LYS  98   7.740 -10.520   5.030
  217   3HZ   LYS  98           HZ1      LYS  98   8.670  -9.320   4.450
  218    H    THR  99           H        THR  99  12.180  -6.240   5.290
  219    HG1  THR  99           HG1      THR  99  12.060  -3.720   5.500
  220    H    THR 100           H        THR 100   9.120  -6.170   2.170
  221    HG1  THR 100           HG1      THR 100  10.320  -9.220   2.190
  222    H    GLN 101           H        GLN 101  11.530  -6.930  -1.330
  223   1HE2  GLN 101           HE2      GLN 101   8.440  -4.170  -6.280
  224   2HE2  GLN 101           HE2      GLN 101   9.400  -5.610  -6.400
  225    H    ALA 102           H        ALA 102   8.040  -6.380  -3.920
  226    H    ASN 103           H        ASN 103   7.670  -9.100  -7.340
  227   1HD2  ASN 103           HD2      ASN 103   8.430  -4.920 -10.460
  228   2HD2  ASN 103           HD2      ASN 103   7.040  -5.770 -11.090
  229    H    LYS 104           H        LYS 104   3.890  -7.490  -7.720
  230   1HZ   LYS 104           HZ1      LYS 104   3.630 -13.850  -6.430
  231   2HZ   LYS 104           HZ2      LYS 104   4.430 -14.460  -5.140
  232   3HZ   LYS 104           HZ3      LYS 104   2.870 -13.920  -4.980
  233    H    HIS 105           H        HIS 105   0.450 -10.220  -8.350
  234    HD1  HIS 105           HD1      HIS 105  -3.750 -10.950 -11.080
  235    HE2  HIS 105           HE2      HIS 105  -0.380 -11.740 -13.160
  236    H    ILE 106           H        ILE 106  -2.360  -6.600  -9.010
  237    H    ILE 107           H        ILE 107  -4.030  -6.130  -5.040
  238    H    VAL 108           H        VAL 108  -7.420  -3.690  -6.230
  239    H    ALA 109           H        ALA 109  -8.800  -1.070  -2.920
  240    H    CYS 110           H        CYS 110 -12.780  -0.050  -5.010
  241    H    GLU 111           H        GLU 111 -12.320   4.320  -5.760
  242    H    GLY 112           H        GLY 112 -16.080   6.580  -5.770
  243    H    ASN 113           H        ASN 113 -14.520  10.540  -7.290
  244   1HD2  ASN 113           HD2      ASN 113 -17.100  13.100 -12.140
  245   2HD2  ASN 113           HD2      ASN 113 -17.690  12.920 -10.500
  246    OH   TYR 115           OH       TYR 115 -15.890   1.120  -8.420
  247    H    TYR 115           H        TYR 115 -12.930   7.780 -11.600
  248    HH   TYR 115           HH       TYR 115 -15.690   0.270  -8.960
  249    H    VAL 116           H        VAL 116 -11.660   6.470  -7.730
  250    H    VAL 118           H        VAL 118  -9.510   3.010  -3.500
  251    H    HIS 119           H        HIS 119  -8.680   1.830  -1.970
  252    HD1  HIS 119           HD1      HIS 119  -8.020  -0.220   3.120
  253    HE2  HIS 119           HE2      HIS 119  -8.980  -3.880   1.700
  254    H    PHE 120           H        PHE 120  -5.570   0.090   0.380
  255    H    ASP 121           H        ASP 121  -5.330  -3.830  -1.700
  256    H    ALA 122           H        ALA 122  -5.100  -6.300  -1.960
  257    H    SER 123           H        SER 123  -1.170  -7.970  -1.510
  258    HG   SER 123           HG       SER 123   1.800  -7.340  -1.890
  259    H    VAL 124           H        VAL 124  -1.270  -9.850  -5.560
   
  Start of MODEL          30
 Raw file had 259 H/Q atoms
  Start of MODEL   30
    1   1H    LYS   1           H2       LYS   1 -10.150  16.730   5.080
    2   2H    LYS   1           H3       LYS   1 -10.430  17.090   6.670
    3   3H    LYS   1           H1       LYS   1  -8.910  16.720   6.160
    4   1HZ   LYS   1           HZ2      LYS   1 -15.700  13.480   8.210
    5   2HZ   LYS   1           HZ3      LYS   1 -15.400  12.100   7.380
    6   3HZ   LYS   1           HZ1      LYS   1 -15.560  12.060   9.010
    7    H    GLU   2           H        GLU   2  -8.970  13.090   6.840
    8    H    THR   3           H        THR   3  -9.480  12.260   2.960
    9    HG1  THR   3           HG1      THR   3 -10.390  12.450   0.220
   10    H    ALA   4           H        ALA   4 -11.840   8.390   2.300
   11    H    ALA   5           H        ALA   5 -10.450   8.200  -0.660
   12    H    ALA   6           H        ALA   6  -8.180   9.790   0.050
   13    H    LYS   7           H        LYS   7  -7.130   8.190   2.070
   14   1HZ   LYS   7           HZ2      LYS   7  -8.290   5.990   7.710
   15   2HZ   LYS   7           HZ3      LYS   7  -7.560   7.420   7.390
   16   3HZ   LYS   7           HZ1      LYS   7  -8.960   7.390   8.230
   17    H    PHE   8           H        PHE   8  -6.320   5.740   0.670
   18    H    GLU   9           H        GLU   9  -4.210   7.000  -1.140
   19    NH1  ARG  10           NH1      ARG  10  -0.900   8.140   8.560
   20    NH2  ARG  10           NH2      ARG  10  -3.160   8.250   8.670
   21    H    ARG  10           H        ARG  10  -2.540   8.010   1.190
   22    HE   ARG  10           HE       ARG  10  -3.080   8.080   6.190
   23   1HH1  ARG  10           HH1      ARG  10  -0.070   8.030   8.030
   24   2HH1  ARG  10           HH1      ARG  10  -0.870   8.220   9.560
   25   1HH2  ARG  10           HH2      ARG  10  -4.060   8.310   8.240
   26   2HH2  ARG  10           HH2      ARG  10  -3.070   8.300   9.660
   27    H    GLN  11           H        GLN  11  -1.940   5.610   2.650
   28   1HE2  GLN  11           HE2      GLN  11  -3.720   0.430   5.240
   29   2HE2  GLN  11           HE2      GLN  11  -2.060   0.900   5.000
   30    H    HIS  12           H        HIS  12  -0.670   4.290   0.550
   31    HD1  HIS  12           HD1      HIS  12   0.050  -0.160   0.570
   32    HE2  HIS  12           HE2      HIS  12  -3.370   0.700   2.420
   33    H    MET  13           H        MET  13   0.600   5.300  -1.270
   34    H    ASP  14           H        ASP  14   3.940   4.550  -4.220
   35    H    SER  15           H        SER  15   4.800   6.950  -5.040
   36    HG   SER  15           HG       SER  15   3.420   6.500  -7.230
   37    H    SER  16           H        SER  16   7.360   8.480  -5.560
   38    HG   SER  16           HG       SER  16   8.970  11.180  -4.820
   39    H    THR  17           H        THR  17   9.150   6.070  -5.440
   40    HG1  THR  17           HG1      THR  17  10.340   4.120  -2.680
   41    H    SER  18           H        SER  18  12.000   3.580  -7.590
   42    HG   SER  18           HG       SER  18  11.930   3.050 -10.520
   43    H    ALA  19           H        ALA  19  11.900   1.520  -5.860
   44    H    ALA  20           H        ALA  20  11.270  -1.740  -3.280
   45    H    SER  21           H        SER  21  14.700   0.310  -2.050
   46    HG   SER  21           HG       SER  21  17.250   2.130  -1.500
   47    H    SER  22           H        SER  22  15.480  -1.860  -0.260
   48    HG   SER  22           HG       SER  22  18.800  -1.710   3.290
   49    H    SER  23           H        SER  23  17.470  -4.370   2.390
   50    HG   SER  23           HG       SER  23  17.690  -5.000   5.650
   51    H    ASN  24           H        ASN  24  16.360  -2.670   4.340
   52   1HD2  ASN  24           HD2      ASN  24  15.680  -4.500   9.030
   53   2HD2  ASN  24           HD2      ASN  24  14.570  -3.280   8.500
   54    OH   TYR  25           OH       TYR  25  10.070   3.430  -1.120
   55    H    TYR  25           H        TYR  25  14.380  -1.540   3.470
   56    HH   TYR  25           HH       TYR  25   9.090   3.280  -0.900
   57    H    CYS  26           H        CYS  26  11.590  -0.780   4.320
   58    H    ASN  27           H        ASN  27  12.260   0.410   6.840
   59   1HD2  ASN  27           HD2      ASN  27  14.700  -1.290  10.560
   60   2HD2  ASN  27           HD2      ASN  27  14.670   0.430  10.850
   61    H    GLN  28           H        GLN  28  13.110   3.330   7.170
   62   1HE2  GLN  28           HE2      GLN  28  12.340   9.250   5.280
   63   2HE2  GLN  28           HE2      GLN  28  12.170   8.720   6.930
   64    H    MET  29           H        MET  29  11.460   4.180   5.360
   65    H    MET  30           H        MET  30   8.670   3.550   6.320
   66    H    LYS  31           H        LYS  31   8.550   5.650   8.130
   67   1HZ   LYS  31           HZ1      LYS  31  12.490   7.910  12.580
   68   2HZ   LYS  31           HZ2      LYS  31  12.740   6.320  12.820
   69   3HZ   LYS  31           HZ3      LYS  31  13.690   7.150  11.780
   70    H    SER  32           H        SER  32   8.820   7.910   6.850
   71    HG   SER  32           HG       SER  32   8.190  10.880   3.880
   72    NH1  ARG  33           NH2      ARG  33   7.240   9.400   1.270
   73    NH2  ARG  33           NH1      ARG  33   7.560   7.250   0.750
   74    H    ARG  33           H        ARG  33   6.400   7.840   5.260
   75    HE   ARG  33           HE       ARG  33   5.190   6.920   1.170
   76   1HH1  ARG  33           HH2      ARG  33   6.660  10.130   1.620
   77   2HH1  ARG  33           HH2      ARG  33   8.200   9.550   1.050
   78   1HH2  ARG  33           HH1      ARG  33   7.220   6.310   0.650
   79   2HH2  ARG  33           HH1      ARG  33   8.510   7.470   0.570
   80    H    ASN  34           H        ASN  34   4.880   9.570   7.290
   81   1HD2  ASN  34           HD2      ASN  34   2.880  12.820   5.710
   82   2HD2  ASN  34           HD2      ASN  34   2.230  11.210   5.510
   83    H    LEU  35           H        LEU  35   3.210   7.120   7.820
   84    H    THR  36           H        THR  36   4.240   6.400  10.420
   85    HG1  THR  36           HG1      THR  36   7.200   6.150  12.110
   86    H    LYS  37           H        LYS  37   3.120   7.920  12.210
   87   1HZ   LYS  37           HZ2      LYS  37   4.330  13.340  10.010
   88   2HZ   LYS  37           HZ3      LYS  37   5.890  13.870   9.880
   89   3HZ   LYS  37           HZ1      LYS  37   5.270  12.760   8.840
   90    H    ASP  38           H        ASP  38   2.150   7.220  14.760
   91    NH1  ARG  39           NH2      ARG  39  -1.580  -0.010  16.020
   92    NH2  ARG  39           NH1      ARG  39  -3.640   0.960  15.860
   93    H    ARG  39           H        ARG  39   1.240   5.300  15.760
   94    HE   ARG  39           HE       ARG  39  -2.630   2.780  17.180
   95   1HH1  ARG  39           HH2      ARG  39  -0.630   0.060  16.330
   96   2HH1  ARG  39           HH2      ARG  39  -1.890  -0.780  15.470
   97   1HH2  ARG  39           HH1      ARG  39  -4.270   1.710  16.050
   98   2HH2  ARG  39           HH1      ARG  39  -3.950   0.180  15.300
   99    H    CYS  40           H        CYS  40   4.250   2.400  16.890
  100    H    LYS  41           H        LYS  41   3.750   1.610  12.520
  101   1HZ   LYS  41           HZ1      LYS  41  -1.240   2.320   7.750
  102   2HZ   LYS  41           HZ2      LYS  41  -0.570   1.260   6.710
  103   3HZ   LYS  41           HZ3      LYS  41  -2.140   1.100   7.170
  104    H    VAL  43           H        VAL  43   1.090  -3.110  10.300
  105    H    ASN  44           H        ASN  44   2.960  -3.490   6.580
  106   1HD2  ASN  44           HD2      ASN  44   1.810   1.550   3.600
  107   2HD2  ASN  44           HD2      ASN  44   3.080   0.880   4.560
  108    H    THR  45           H        THR  45   0.790  -1.950   3.200
  109    HG1  THR  45           HG1      THR  45   0.990  -5.400   1.280
  110    H    PHE  46           H        PHE  46   4.450  -1.560   0.840
  111    H    VAL  47           H        VAL  47   3.160   1.440  -2.150
  112    H    HIS  48           H        HIS  48   5.000  -0.070  -5.590
  113    HD1  HIS  48           HD1      HIS  48   8.840   2.810  -4.560
  114    HE2  HIS  48           HE2      HIS  48   8.980  -0.540  -2.300
  115    H    GLU  49           H        GLU  49   3.650   2.660  -6.940
  116    H    SER  50           H        SER  50   3.330   4.920 -10.720
  117    HG   SER  50           HG       SER  50   2.100   5.430 -12.530
  118    H    LEU  51           H        LEU  51   0.110   7.800  -8.850
  119    H    ALA  52           H        ALA  52  -1.530   7.810 -11.290
  120    H    ASP  53           H        ASP  53  -0.490   5.120 -12.330
  121    H    VAL  54           H        VAL  54  -1.890   3.530 -10.570
  122    H    GLN  55           H        GLN  55  -4.250   4.080 -10.570
  123   1HE2  GLN  55           HE2      GLN  55  -8.060   8.850 -10.860
  124   2HE2  GLN  55           HE2      GLN  55  -8.610   7.260 -10.400
  125    H    ALA  56           H        ALA  56  -4.710   2.720 -13.020
  126    H    VAL  57           H        VAL  57  -5.690   0.240 -11.700
  127    H    CYS  58           H        CYS  58  -7.890   0.230 -11.100
  128    H    SER  59           H        SER  59  -9.090  -0.460 -13.440
  129    HG   SER  59           HG       SER  59  -8.600  -0.550 -16.330
  130    H    GLN  60           H        GLN  60  -9.800  -3.050 -13.460
  131   1HE2  GLN  60           HE2      GLN  60  -4.080  -3.350 -15.300
  132   2HE2  GLN  60           HE2      GLN  60  -5.540  -2.390 -15.460
  133    H    LYS  61           H        LYS  61  -9.450  -7.050 -13.640
  134   1HZ   LYS  61           HZ1      LYS  61 -13.450 -11.430 -12.020
  135   2HZ   LYS  61           HZ2      LYS  61 -14.940 -10.790 -12.120
  136   3HZ   LYS  61           HZ3      LYS  61 -14.720 -12.410 -12.240
  137    H    ASN  62           H        ASN  62 -13.630  -7.150 -12.630
  138   1HD2  ASN  62           HD2      ASN  62 -16.230  -6.330  -7.590
  139   2HD2  ASN  62           HD2      ASN  62 -14.850  -5.640  -8.420
  140    H    VAL  63           H        VAL  63 -13.340  -7.360  -8.090
  141    H    ALA  64           H        ALA  64 -13.050 -10.780  -5.360
  142    H    CYS  65           H        CYS  65 -14.310  -7.830  -2.280
  143    H    LYS  66           H        LYS  66 -11.010  -7.890   0.920
  144   1HZ   LYS  66           HZ3      LYS  66 -10.980  -7.530   6.490
  145   2HZ   LYS  66           HZ1      LYS  66 -10.140  -8.930   6.690
  146   3HZ   LYS  66           HZ2      LYS  66  -9.480  -7.530   7.230
  147    H    ASN  67           H        ASN  67 -13.330  -7.930   2.820
  148   1HD2  ASN  67           HD2      ASN  67 -15.920  -4.640   3.630
  149   2HD2  ASN  67           HD2      ASN  67 -16.320  -5.580   5.030
  150    H    GLY  68           H        GLY  68 -14.860  -9.660   1.360
  151    H    GLN  69           H        GLN  69 -16.140  -7.710   0.520
  152   1HE2  GLN  69           HE2      GLN  69 -19.100  -2.400  -2.320
  153   2HE2  GLN  69           HE2      GLN  69 -19.060  -2.280  -0.580
  154    H    THR  70           H        THR  70 -18.660  -6.330  -3.070
  155    HG1  THR  70           HG1      THR  70 -18.240  -7.610  -7.530
  156    H    ASN  71           H        ASN  71 -16.030  -4.990  -3.700
  157   1HD2  ASN  71           HD2      ASN  71 -14.064  -1.956  -1.793
  158   2HD2  ASN  71           HD2      ASN  71 -13.869  -2.347  -3.481
  159    H    CYS  72           H        CYS  72 -14.180  -5.350  -5.680
  160    OH   TYR  73           OH       TYR  73 -15.750  -1.720  -8.820
  161    H    TYR  73           H        TYR  73 -10.140  -4.330  -6.710
  162    HH   TYR  73           HH       TYR  73 -15.700  -0.700  -8.910
  163    H    GLN  74           H        GLN  74  -9.330  -6.840 -10.130
  164   1HE2  GLN  74           HE2      GLN  74  -5.170 -12.370  -9.880
  165   2HE2  GLN  74           HE2      GLN  74  -4.200 -11.040  -9.280
  166    H    SER  75           H        SER  75  -4.830  -6.300 -10.150
  167    HG   SER  75           HG       SER  75  -1.510  -6.250 -11.640
  168    OH   TYR  76           OH       TYR  76  -8.380  -8.850 -12.540
  169    H    TYR  76           H        TYR  76  -4.320  -7.180 -14.640
  170    HH   TYR  76           HH       TYR  76  -8.230  -9.620 -11.910
  171    H    SER  77           H        SER  77  -1.750  -7.530 -14.420
  172    HG   SER  77           HG       SER  77   0.610  -6.390 -16.730
  173    H    THR  78           H        THR  78   2.540  -8.180 -13.660
  174    HG1  THR  78           HG1      THR  78   4.840  -6.970 -12.730
  175    H    MET  79           H        MET  79   2.680  -6.140  -9.600
  176    H    SER  80           H        SER  80   5.340  -2.630  -9.530
  177    HG   SER  80           HG       SER  80   8.970  -1.360  -7.170
  178    H    ILE  81           H        ILE  81   5.830  -4.780  -5.720
  179    H    THR  82           H        THR  82   5.350  -2.530  -2.020
  180    HG1  THR  82           HG1      THR  82   8.570  -3.220  -2.310
  181    H    ASP  83           H        ASP  83   6.790  -5.610   0.150
  182    H    CYS  84           H        CYS  84   4.770  -4.590   4.010
  183    NH1  ARG  85           NH2      ARG  85   5.720 -12.400  10.970
  184    NH2  ARG  85           NH1      ARG  85   7.790 -12.450  10.070
  185    H    ARG  85           H        ARG  85   7.520  -5.910   7.200
  186    HE   ARG  85           HE       ARG  85   7.140 -10.250   9.070
  187   1HH1  ARG  85           HH2      ARG  85   4.910 -11.870  11.210
  188   2HH1  ARG  85           HH2      ARG  85   5.900 -13.290  11.390
  189   1HH2  ARG  85           HH1      ARG  85   8.530 -12.010   9.560
  190   2HH2  ARG  85           HH1      ARG  85   7.930 -13.320  10.530
  191    H    GLU  86           H        GLU  86   5.370  -5.610  10.940
  192    H    THR  87           H        THR  87   9.460  -4.740  12.690
  193    HG1  THR  87           HG1      THR  87  12.730  -8.240  13.320
  194    H    GLY  88           H        GLY  88  11.520  -7.320  15.880
  195    H    SER  89           H        SER  89  12.740  -4.740  16.470
  196    HG   SER  89           HG       SER  89  14.900  -2.480  15.330
  197    H    SER  90           H        SER  90  10.490  -2.800  17.150
  198    HG   SER  90           HG       SER  90   7.830  -1.760  17.590
  199    H    LYS  91           H        LYS  91  11.330   1.130  17.520
  200   1HZ   LYS  91           HZ2      LYS  91  12.260  -2.020  20.620
  201   2HZ   LYS  91           HZ3      LYS  91  13.900  -2.100  20.680
  202   3HZ   LYS  91           HZ1      LYS  91  13.000  -3.020  21.680
  203    OH   TYR  92           OH       TYR  92   4.460   9.940  18.300
  204    H    TYR  92           H        TYR  92   8.180   2.860  18.970
  205    HH   TYR  92           HH       TYR  92   3.930   9.950  17.430
  206    H    ASN  94           H        ASN  94  11.060   5.280  17.180
  207   1HD2  ASN  94           HD2      ASN  94  15.820   2.850  15.440
  208   2HD2  ASN  94           HD2      ASN  94  14.710   2.900  16.780
  209    H    CYS  95           H        CYS  95  10.490   4.010  13.620
  210    H    ALA  96           H        ALA  96  10.190  -0.540  13.810
  211    OH   TYR  97           OH       TYR  97   6.060   0.230  11.750
  212    H    TYR  97           H        TYR  97  11.990  -1.910  10.090
  213    HH   TYR  97           HH       TYR  97   5.330  -0.440  11.980
  214    H    LYS  98           H        LYS  98   9.850  -5.630   9.180
  215   1HZ   LYS  98           HZ1      LYS  98   8.450  -9.570  11.990
  216   2HZ   LYS  98           HZ2      LYS  98   8.660 -11.120  11.530
  217   3HZ   LYS  98           HZ3      LYS  98   9.280 -10.580  12.960
  218    H    THR  99           H        THR  99  12.350  -5.890   5.600
  219    HG1  THR  99           HG1      THR  99  12.080  -3.440   5.870
  220    H    THR 100           H        THR 100   9.310  -5.920   2.400
  221    HG1  THR 100           HG1      THR 100  10.460  -8.650   2.740
  222    H    GLN 101           H        GLN 101  11.680  -6.570  -1.160
  223   1HE2  GLN 101           HE2      GLN 101   9.200  -5.470  -6.980
  224   2HE2  GLN 101           HE2      GLN 101   8.790  -4.510  -5.610
  225    H    ALA 102           H        ALA 102   8.040  -6.340  -3.570
  226    H    ASN 103           H        ASN 103   7.900  -9.060  -7.000
  227   1HD2  ASN 103           HD2      ASN 103   9.950  -6.140  -9.930
  228   2HD2  ASN 103           HD2      ASN 103   9.450  -7.770 -10.350
  229    H    LYS 104           H        LYS 104   4.110  -7.480  -7.530
  230   1HZ   LYS 104           HZ3      LYS 104   4.680 -10.580  -2.400
  231   2HZ   LYS 104           HZ1      LYS 104   3.730 -11.850  -2.010
  232   3HZ   LYS 104           HZ2      LYS 104   5.360 -12.060  -2.090
  233    H    HIS 105           H        HIS 105   0.780 -10.250  -8.250
  234    HD1  HIS 105           HD1      HIS 105  -3.300 -10.670 -11.370
  235    HE2  HIS 105           HE2      HIS 105   0.080 -12.070 -13.010
  236    H    ILE 106           H        ILE 106  -2.140  -6.740  -8.930
  237    H    ILE 107           H        ILE 107  -4.030  -6.320  -4.980
  238    H    VAL 108           H        VAL 108  -7.290  -3.880  -6.430
  239    H    ALA 109           H        ALA 109  -8.790  -1.310  -3.140
  240    H    CYS 110           H        CYS 110 -12.690  -0.430  -5.350
  241    H    GLU 111           H        GLU 111 -12.370   4.020  -6.050
  242    H    GLY 112           H        GLY 112 -16.140   6.240  -6.450
  243    H    ASN 113           H        ASN 113 -14.720  10.330  -7.630
  244   1HD2  ASN 113           HD2      ASN 113 -16.850  13.060 -12.500
  245   2HD2  ASN 113           HD2      ASN 113 -17.140  13.150 -10.780
  246    OH   TYR 115           OH       TYR 115 -15.830   0.890  -8.910
  247    H    TYR 115           H        TYR 115 -12.810   7.530 -11.890
  248    HH   TYR 115           HH       TYR 115 -16.610   1.280  -8.410
  249    H    VAL 116           H        VAL 116 -11.700   6.170  -7.970
  250    H    VAL 118           H        VAL 118  -9.610   2.630  -3.680
  251    H    HIS 119           H        HIS 119  -8.680   1.520  -2.120
  252    HD1  HIS 119           HD1      HIS 119  -8.390  -0.670   3.020
  253    HE2  HIS 119           HE2      HIS 119  -9.040  -4.270   1.300
  254    H    PHE 120           H        PHE 120  -5.870  -0.330   0.530
  255    H    ASP 121           H        ASP 121  -5.510  -4.110  -1.780
  256    H    ALA 122           H        ALA 122  -5.150  -6.480  -2.130
  257    H    SER 123           H        SER 123  -1.360  -8.300  -1.450
  258    HG   SER 123           HG       SER 123   1.310  -8.600  -1.630
  259    H    VAL 124           H        VAL 124  -1.110  -9.940  -5.570
   
  Start of MODEL          31
 Raw file had 259 H/Q atoms
  Start of MODEL   31
    1   1H    LYS   1           H2       LYS   1  -7.170  17.390   4.100
    2   2H    LYS   1           H3       LYS   1  -8.620  17.800   3.420
    3   3H    LYS   1           H1       LYS   1  -8.360  18.060   5.020
    4   1HZ   LYS   1           HZ1      LYS   1 -12.470  19.980   5.390
    5   2HZ   LYS   1           HZ2      LYS   1 -11.840  20.910   6.600
    6   3HZ   LYS   1           HZ3      LYS   1 -10.900  20.420   5.310
    7    H    GLU   2           H        GLU   2  -7.700  14.370   5.530
    8    H    THR   3           H        THR   3  -9.000  12.610   2.280
    9    HG1  THR   3           HG1      THR   3 -10.550  12.740   0.160
   10    H    ALA   4           H        ALA   4 -11.460   8.810   2.330
   11    H    ALA   5           H        ALA   5 -10.060   8.500  -0.680
   12    H    ALA   6           H        ALA   6  -7.790   9.930  -0.200
   13    H    LYS   7           H        LYS   7  -6.760   8.560   1.750
   14   1HZ   LYS   7           HZ1      LYS   7  -7.450   7.180   7.540
   15   2HZ   LYS   7           HZ2      LYS   7  -6.930   8.540   6.810
   16   3HZ   LYS   7           HZ3      LYS   7  -8.090   8.620   7.970
   17    H    PHE   8           H        PHE   8  -6.100   5.960   0.590
   18    H    GLU   9           H        GLU   9  -3.960   7.210  -1.290
   19    NH1  ARG  10           NH1      ARG  10  -0.590   8.530   8.130
   20    NH2  ARG  10           NH2      ARG  10  -2.840   8.460   8.310
   21    H    ARG  10           H        ARG  10  -2.170   8.190   0.910
   22    HE   ARG  10           HE       ARG  10  -2.790   8.050   5.850
   23   1HH1  ARG  10           HH1      ARG  10   0.240   8.420   7.580
   24   2HH1  ARG  10           HH1      ARG  10  -0.540   8.740   9.110
   25   1HH2  ARG  10           HH2      ARG  10  -3.750   8.320   7.920
   26   2HH2  ARG  10           HH2      ARG  10  -2.730   8.650   9.280
   27    H    GLN  11           H        GLN  11  -1.570   5.880   2.590
   28   1HE2  GLN  11           HE2      GLN  11  -3.700   0.910   5.150
   29   2HE2  GLN  11           HE2      GLN  11  -2.000   1.250   4.960
   30    H    HIS  12           H        HIS  12  -0.440   4.460   0.470
   31    HD1  HIS  12           HD1      HIS  12   0.120   0.230   0.730
   32    HE2  HIS  12           HE2      HIS  12  -3.480   1.110   2.240
   33    H    MET  13           H        MET  13   0.740   5.420  -1.580
   34    H    ASP  14           H        ASP  14   4.150   4.390  -4.420
   35    H    SER  15           H        SER  15   5.090   6.880  -5.360
   36    HG   SER  15           HG       SER  15   5.120   9.530  -7.390
   37    H    SER  16           H        SER  16   7.520   8.360  -5.510
   38    HG   SER  16           HG       SER  16  11.560   9.590  -5.160
   39    H    THR  17           H        THR  17   9.430   6.200  -5.140
   40    HG1  THR  17           HG1      THR  17  10.480   4.270  -2.370
   41    H    SER  18           H        SER  18  12.350   3.640  -7.150
   42    HG   SER  18           HG       SER  18  13.730   1.340  -8.920
   43    H    ALA  19           H        ALA  19  11.730   1.660  -5.440
   44    H    ALA  20           H        ALA  20  11.250  -1.710  -2.970
   45    H    SER  21           H        SER  21  14.780   0.380  -1.630
   46    HG   SER  21           HG       SER  21  17.550   1.920  -0.720
   47    H    SER  22           H        SER  22  15.540  -1.740   0.140
   48    HG   SER  22           HG       SER  22  18.220  -1.440   4.240
   49    H    SER  23           H        SER  23  17.280  -4.620   2.700
   50    HG   SER  23           HG       SER  23  17.910  -6.780   5.080
   51    H    ASN  24           H        ASN  24  16.360  -2.900   4.670
   52   1HD2  ASN  24           HD2      ASN  24  17.130   1.330   6.320
   53   2HD2  ASN  24           HD2      ASN  24  15.900   0.740   7.380
   54    OH   TYR  25           OH       TYR  25  10.220   3.470  -0.840
   55    H    TYR  25           H        TYR  25  14.430  -1.590   3.790
   56    HH   TYR  25           HH       TYR  25   9.220   3.290  -0.750
   57    H    CYS  26           H        CYS  26  11.270  -0.910   4.580
   58    H    ASN  27           H        ASN  27  11.870   0.350   7.170
   59   1HD2  ASN  27           HD2      ASN  27  13.090   2.620  12.220
   60   2HD2  ASN  27           HD2      ASN  27  11.720   1.870  11.430
   61    H    GLN  28           H        GLN  28  12.790   3.120   6.860
   62   1HE2  GLN  28           HE2      GLN  28  15.640   3.390   9.560
   63   2HE2  GLN  28           HE2      GLN  28  15.200   5.070   9.530
   64    H    MET  29           H        MET  29  11.130   4.050   5.230
   65    H    MET  30           H        MET  30   8.500   3.730   6.050
   66    H    LYS  31           H        LYS  31   8.690   5.600   8.170
   67   1HZ   LYS  31           HZ2      LYS  31  11.850   8.460  12.690
   68   2HZ   LYS  31           HZ3      LYS  31  10.670   7.370  13.050
   69   3HZ   LYS  31           HZ1      LYS  31  12.100   7.350  13.860
   70    H    SER  32           H        SER  32   8.700   8.190   6.890
   71    HG   SER  32           HG       SER  32   7.800  11.830   4.940
   72    NH1  ARG  33           NH2      ARG  33   3.500   7.690   0.120
   73    NH2  ARG  33           NH1      ARG  33   5.440   8.330  -0.840
   74    H    ARG  33           H        ARG  33   6.090   8.280   5.940
   75    HE   ARG  33           HE       ARG  33   6.020   9.150   1.440
   76   1HH1  ARG  33           HH2      ARG  33   2.940   7.550   0.940
   77   2HH1  ARG  33           HH2      ARG  33   3.220   7.320  -0.760
   78   1HH2  ARG  33           HH1      ARG  33   6.380   8.660  -0.790
   79   2HH2  ARG  33           HH1      ARG  33   5.070   7.940  -1.680
   80    H    ASN  34           H        ASN  34   4.790   9.730   8.080
   81   1HD2  ASN  34           HD2      ASN  34   2.940  13.340   7.660
   82   2HD2  ASN  34           HD2      ASN  34   2.180  11.850   7.150
   83    H    LEU  35           H        LEU  35   3.020   7.320   8.240
   84    H    THR  36           H        THR  36   4.460   6.250  10.560
   85    HG1  THR  36           HG1      THR  36   7.660   5.590  11.970
   86    H    LYS  37           H        LYS  37   4.270   7.920  12.160
   87   1HZ   LYS  37           HZ3      LYS  37   9.520  10.200  13.730
   88   2HZ   LYS  37           HZ1      LYS  37  10.340  10.730  12.410
   89   3HZ   LYS  37           HZ2      LYS  37   9.440  11.780  13.270
   90    H    ASP  38           H        ASP  38   2.620   7.470  14.220
   91    NH1  ARG  39           NH2      ARG  39  -2.240   0.150  17.740
   92    NH2  ARG  39           NH1      ARG  39  -0.560  -1.060  16.750
   93    H    ARG  39           H        ARG  39   1.490   5.520  15.180
   94    HE   ARG  39           HE       ARG  39   0.150   1.160  15.940
   95   1HH1  ARG  39           HH2      ARG  39  -2.650   1.050  17.830
   96   2HH1  ARG  39           HH2      ARG  39  -2.670  -0.660  18.120
   97   1HH2  ARG  39           HH1      ARG  39   0.250  -1.090  16.160
   98   2HH2  ARG  39           HH1      ARG  39  -0.970  -1.900  17.090
   99    H    CYS  40           H        CYS  40   3.780   2.360  16.920
  100    H    LYS  41           H        LYS  41   3.310   1.490  12.640
  101   1HZ   LYS  41           HZ1      LYS  41  -1.370   2.680   7.910
  102   2HZ   LYS  41           HZ2      LYS  41  -0.690   1.730   6.770
  103   3HZ   LYS  41           HZ3      LYS  41  -2.300   1.590   7.130
  104    H    VAL  43           H        VAL  43   0.690  -3.130  10.130
  105    H    ASN  44           H        ASN  44   2.820  -3.480   6.570
  106   1HD2  ASN  44           HD2      ASN  44   2.220   1.760   3.650
  107   2HD2  ASN  44           HD2      ASN  44   3.520   0.970   4.500
  108    H    THR  45           H        THR  45   0.910  -1.480   3.190
  109    HG1  THR  45           HG1      THR  45   1.140  -5.070   1.130
  110    H    PHE  46           H        PHE  46   4.480  -1.320   0.830
  111    H    VAL  47           H        VAL  47   3.120   1.520  -2.200
  112    H    HIS  48           H        HIS  48   5.120  -0.010  -5.520
  113    HD1  HIS  48           HD1      HIS  48   8.940   2.940  -4.420
  114    HE2  HIS  48           HE2      HIS  48   8.990  -0.350  -2.050
  115    H    GLU  49           H        GLU  49   3.840   2.750  -6.880
  116    H    SER  50           H        SER  50   3.540   4.820 -10.770
  117    HG   SER  50           HG       SER  50   2.040   4.860 -12.180
  118    H    LEU  51           H        LEU  51   0.240   7.710  -9.060
  119    H    ALA  52           H        ALA  52  -1.650   7.930 -11.410
  120    H    ASP  53           H        ASP  53  -0.690   5.230 -12.580
  121    H    VAL  54           H        VAL  54  -1.780   3.590 -10.760
  122    H    GLN  55           H        GLN  55  -4.190   4.080 -10.680
  123   1HE2  GLN  55           HE2      GLN  55  -8.420   8.460 -10.830
  124   2HE2  GLN  55           HE2      GLN  55  -8.760   6.770 -10.550
  125    H    ALA  56           H        ALA  56  -4.840   2.620 -13.010
  126    H    VAL  57           H        VAL  57  -5.650   0.180 -11.620
  127    H    CYS  58           H        CYS  58  -8.060   0.080 -11.100
  128    H    SER  59           H        SER  59  -9.290  -1.020 -13.360
  129    HG   SER  59           HG       SER  59 -11.560  -1.730 -16.820
  130    H    GLN  60           H        GLN  60  -9.620  -3.540 -13.350
  131   1HE2  GLN  60           HE2      GLN  60  -3.820  -3.310 -15.110
  132   2HE2  GLN  60           HE2      GLN  60  -5.290  -2.410 -15.390
  133    H    LYS  61           H        LYS  61  -9.090  -6.570 -12.790
  134   1HZ   LYS  61           HZ2      LYS  61  -8.070 -13.710 -12.590
  135   2HZ   LYS  61           HZ3      LYS  61  -8.030 -13.680 -10.950
  136   3HZ   LYS  61           HZ1      LYS  61  -9.070 -14.670 -11.720
  137    H    ASN  62           H        ASN  62 -13.150  -8.190 -12.400
  138   1HD2  ASN  62           HD2      ASN  62 -16.060  -6.290  -7.690
  139   2HD2  ASN  62           HD2      ASN  62 -14.560  -5.860  -8.450
  140    H    VAL  63           H        VAL  63 -13.280  -7.640  -7.880
  141    H    ALA  64           H        ALA  64 -13.090 -10.870  -4.950
  142    H    CYS  65           H        CYS  65 -14.730  -7.860  -2.060
  143    H    LYS  66           H        LYS  66 -11.470  -7.400   1.180
  144   1HZ   LYS  66           HZ1      LYS  66 -12.260  -3.830   1.670
  145   2HZ   LYS  66           HZ2      LYS  66 -13.190  -2.880   2.620
  146   3HZ   LYS  66           HZ3      LYS  66 -11.550  -2.900   2.820
  147    H    ASN  67           H        ASN  67 -14.120  -7.400   2.780
  148   1HD2  ASN  67           HD2      ASN  67 -16.890  -4.240   2.850
  149   2HD2  ASN  67           HD2      ASN  67 -16.510  -4.590   4.500
  150    H    GLY  68           H        GLY  68 -15.430  -9.300   1.550
  151    H    GLN  69           H        GLN  69 -16.840  -7.490   0.470
  152   1HE2  GLN  69           HE2      GLN  69 -19.640  -6.160   3.430
  153   2HE2  GLN  69           HE2      GLN  69 -20.050  -7.160   2.070
  154    H    THR  70           H        THR  70 -19.010  -6.590  -3.480
  155    HG1  THR  70           HG1      THR  70 -17.590  -8.300  -7.650
  156    H    ASN  71           H        ASN  71 -16.230  -5.130  -3.660
  157   1HD2  ASN  71           HD2      ASN  71 -14.208  -1.704  -1.779
  158   2HD2  ASN  71           HD2      ASN  71 -14.141  -1.822  -3.517
  159    H    CYS  72           H        CYS  72 -14.120  -5.360  -5.650
  160    OH   TYR  73           OH       TYR  73 -15.770  -2.110  -8.780
  161    H    TYR  73           H        TYR  73 -10.050  -4.390  -6.360
  162    HH   TYR  73           HH       TYR  73 -15.730  -1.090  -8.680
  163    H    GLN  74           H        GLN  74  -9.220  -7.020  -9.720
  164   1HE2  GLN  74           HE2      GLN  74  -6.060 -12.520  -8.540
  165   2HE2  GLN  74           HE2      GLN  74  -6.480 -11.130  -7.560
  166    H    SER  75           H        SER  75  -4.810  -6.230  -9.950
  167    HG   SER  75           HG       SER  75  -1.540  -6.090 -11.360
  168    OH   TYR  76           OH       TYR  76  -9.920  -9.390 -16.400
  169    H    TYR  76           H        TYR  76  -4.680  -7.070 -14.440
  170    HH   TYR  76           HH       TYR  76 -10.270  -8.440 -16.470
  171    H    SER  77           H        SER  77  -2.030  -7.550 -13.800
  172    HG   SER  77           HG       SER  77   2.050  -8.780 -16.260
  173    H    THR  78           H        THR  78   2.270  -8.090 -13.450
  174    HG1  THR  78           HG1      THR  78   4.440  -6.840 -12.550
  175    H    MET  79           H        MET  79   2.510  -6.180  -9.310
  176    H    SER  80           H        SER  80   5.230  -2.720  -9.420
  177    HG   SER  80           HG       SER  80   7.170  -0.210  -8.610
  178    H    ILE  81           H        ILE  81   5.860  -4.790  -5.670
  179    H    THR  82           H        THR  82   5.500  -2.430  -2.040
  180    HG1  THR  82           HG1      THR  82   8.510  -2.700  -2.480
  181    H    ASP  83           H        ASP  83   6.730  -5.550   0.220
  182    H    CYS  84           H        CYS  84   4.640  -4.460   4.000
  183    NH1  ARG  85           NH2      ARG  85   4.660 -10.970   4.500
  184    NH2  ARG  85           NH1      ARG  85   6.910 -10.800   4.570
  185    H    ARG  85           H        ARG  85   7.080  -6.280   6.940
  186    HE   ARG  85           HE       ARG  85   6.410  -9.480   6.640
  187   1HH1  ARG  85           HH2      ARG  85   3.790 -10.740   4.930
  188   2HH1  ARG  85           HH2      ARG  85   4.730 -11.440   3.630
  189   1HH2  ARG  85           HH1      ARG  85   7.740 -10.370   4.930
  190   2HH2  ARG  85           HH1      ARG  85   6.940 -11.370   3.760
  191    H    GLU  86           H        GLU  86   4.870  -5.980  10.710
  192    H    THR  87           H        THR  87   8.950  -5.360  12.590
  193    HG1  THR  87           HG1      THR  87  12.110  -9.040  12.720
  194    H    GLY  88           H        GLY  88  10.820  -8.330  15.530
  195    H    SER  89           H        SER  89  12.210  -5.900  16.330
  196    HG   SER  89           HG       SER  89  14.640  -4.180  15.230
  197    H    SER  90           H        SER  90  10.070  -3.860  17.320
  198    HG   SER  90           HG       SER  90   7.670  -2.710  17.880
  199    H    LYS  91           H        LYS  91  10.990   0.230  17.240
  200   1HZ   LYS  91           HZ2      LYS  91  15.610   1.570  20.130
  201   2HZ   LYS  91           HZ3      LYS  91  15.820   0.030  20.660
  202   3HZ   LYS  91           HZ1      LYS  91  16.170   0.410  19.110
  203    OH   TYR  92           OH       TYR  92   4.790   9.860  18.460
  204    H    TYR  92           H        TYR  92   8.940   3.250  19.970
  205    HH   TYR  92           HH       TYR  92   4.320   9.860  17.560
  206    H    ASN  94           H        ASN  94  10.780   4.850  16.610
  207   1HD2  ASN  94           HD2      ASN  94  14.020   2.900  18.340
  208   2HD2  ASN  94           HD2      ASN  94  14.530   2.660  16.690
  209    H    CYS  95           H        CYS  95   9.730   3.150  13.630
  210    H    ALA  96           H        ALA  96  10.480  -1.250  14.300
  211    OH   TYR  97           OH       TYR  97   5.590  -0.180  11.630
  212    H    TYR  97           H        TYR  97  11.710  -2.610  10.130
  213    HH   TYR  97           HH       TYR  97   4.800  -0.790  11.810
  214    H    LYS  98           H        LYS  98   9.330  -6.160   9.060
  215   1HZ   LYS  98           HZ3      LYS  98  14.770  -9.920   7.360
  216   2HZ   LYS  98           HZ1      LYS  98  14.410 -11.180   8.340
  217   3HZ   LYS  98           HZ2      LYS  98  14.850 -11.460   6.790
  218    H    THR  99           H        THR  99  12.010  -6.000   5.810
  219    HG1  THR  99           HG1      THR  99  11.760  -3.750   6.240
  220    H    THR 100           H        THR 100   9.160  -5.970   2.460
  221    HG1  THR 100           HG1      THR 100  10.650  -8.610   2.720
  222    H    GLN 101           H        GLN 101  11.610  -6.520  -1.000
  223   1HE2  GLN 101           HE2      GLN 101   8.550  -4.700  -6.110
  224   2HE2  GLN 101           HE2      GLN 101   9.960  -5.700  -6.190
  225    H    ALA 102           H        ALA 102   8.080  -6.320  -3.590
  226    H    ASN 103           H        ASN 103   7.960  -8.980  -7.050
  227   1HD2  ASN 103           HD2      ASN 103   8.180  -5.060 -10.710
  228   2HD2  ASN 103           HD2      ASN 103   7.090  -6.320 -11.240
  229    H    LYS 104           H        LYS 104   4.070  -7.430  -7.370
  230   1HZ   LYS 104           HZ1      LYS 104   4.180 -11.690  -2.930
  231   2HZ   LYS 104           HZ2      LYS 104   5.470 -12.710  -3.040
  232   3HZ   LYS 104           HZ3      LYS 104   5.560 -11.150  -3.600
  233    H    HIS 105           H        HIS 105   0.700 -10.280  -7.970
  234    HD1  HIS 105           HD1      HIS 105  -3.480 -11.020 -10.880
  235    HE2  HIS 105           HE2      HIS 105  -0.030 -12.000 -12.740
  236    H    ILE 106           H        ILE 106  -2.220  -6.780  -8.660
  237    H    ILE 107           H        ILE 107  -4.040  -6.290  -4.690
  238    H    VAL 108           H        VAL 108  -7.220  -3.830  -6.120
  239    H    ALA 109           H        ALA 109  -8.820  -1.280  -2.800
  240    H    CYS 110           H        CYS 110 -12.730  -0.570  -5.000
  241    H    GLU 111           H        GLU 111 -12.460   3.840  -5.840
  242    H    GLY 112           H        GLY 112 -16.260   6.030  -6.190
  243    H    ASN 113           H        ASN 113 -15.030  10.080  -7.620
  244   1HD2  ASN 113           HD2      ASN 113 -17.770  12.480 -12.420
  245   2HD2  ASN 113           HD2      ASN 113 -18.000  12.520 -10.690
  246    OH   TYR 115           OH       TYR 115 -15.910   0.540  -8.470
  247    H    TYR 115           H        TYR 115 -13.090   7.080 -11.820
  248    HH   TYR 115           HH       TYR 115 -16.590   0.970  -7.870
  249    H    VAL 116           H        VAL 116 -11.850   5.940  -7.860
  250    H    VAL 118           H        VAL 118  -9.710   2.690  -3.470
  251    H    HIS 119           H        HIS 119  -8.860   1.580  -1.920
  252    HD1  HIS 119           HD1      HIS 119  -8.150  -0.310   3.050
  253    HE2  HIS 119           HE2      HIS 119  -8.990  -4.100   1.900
  254    H    PHE 120           H        PHE 120  -5.860  -0.180   0.730
  255    H    ASP 121           H        ASP 121  -5.550  -3.940  -1.500
  256    H    ALA 122           H        ALA 122  -5.170  -6.500  -1.760
  257    H    SER 123           H        SER 123  -1.250  -8.110  -1.150
  258    HG   SER 123           HG       SER 123   1.890  -7.970  -1.390
  259    H    VAL 124           H        VAL 124  -1.030  -9.910  -5.210
   
  Start of MODEL          32
 Raw file had 259 H/Q atoms
  Start of MODEL   32
    1   1H    LYS   1           H2       LYS   1  -9.450  17.390   3.950
    2   2H    LYS   1           H3       LYS   1  -9.960  18.120   5.330
    3   3H    LYS   1           H1       LYS   1  -8.370  17.800   5.100
    4   1HZ   LYS   1           HZ1      LYS   1 -14.460  16.820   4.840
    5   2HZ   LYS   1           HZ2      LYS   1 -15.080  18.070   5.710
    6   3HZ   LYS   1           HZ3      LYS   1 -14.290  18.350   4.280
    7    H    GLU   2           H        GLU   2  -8.820  14.000   6.450
    8    H    THR   3           H        THR   3  -9.300  12.570   2.700
    9    HG1  THR   3           HG1      THR   3 -10.210  12.490  -0.190
   10    H    ALA   4           H        ALA   4 -11.820   8.890   1.860
   11    H    ALA   5           H        ALA   5 -10.270   8.370  -0.740
   12    H    ALA   6           H        ALA   6  -8.010   9.760   0.300
   13    H    LYS   7           H        LYS   7  -6.990   8.200   2.160
   14   1HZ   LYS   7           HZ1      LYS   7  -9.830   6.700   7.300
   15   2HZ   LYS   7           HZ2      LYS   7 -10.580   8.140   7.000
   16   3HZ   LYS   7           HZ3      LYS   7 -10.700   6.880   5.930
   17    H    PHE   8           H        PHE   8  -6.230   5.730   0.830
   18    H    GLU   9           H        GLU   9  -4.180   7.140  -0.770
   19    NH1  ARG  10           NH1      ARG  10  -1.140   8.140   8.430
   20    NH2  ARG  10           NH2      ARG  10  -3.120   7.040   8.170
   21    H    ARG  10           H        ARG  10  -2.350   8.010   1.470
   22    HE   ARG  10           HE       ARG  10  -3.400   8.380   6.180
   23   1HH1  ARG  10           HH1      ARG  10  -0.410   8.660   8.000
   24   2HH1  ARG  10           HH1      ARG  10  -1.020   7.740   9.330
   25   1HH2  ARG  10           HH2      ARG  10  -3.830   6.720   7.550
   26   2HH2  ARG  10           HH2      ARG  10  -3.020   6.640   9.070
   27    H    GLN  11           H        GLN  11  -1.680   5.630   2.770
   28   1HE2  GLN  11           HE2      GLN  11  -3.450   0.530   5.510
   29   2HE2  GLN  11           HE2      GLN  11  -1.790   0.980   5.190
   30    H    HIS  12           H        HIS  12  -0.520   4.290   0.660
   31    HD1  HIS  12           HD1      HIS  12  -0.120  -0.140   0.740
   32    HE2  HIS  12           HE2      HIS  12  -3.470   0.970   2.590
   33    H    MET  13           H        MET  13   0.690   5.210  -1.130
   34    H    ASP  14           H        ASP  14   3.930   4.340  -4.120
   35    H    SER  15           H        SER  15   4.920   6.770  -4.920
   36    HG   SER  15           HG       SER  15   3.280   6.140  -7.150
   37    H    SER  16           H        SER  16   7.460   7.860  -5.510
   38    HG   SER  16           HG       SER  16   9.950   8.510  -3.620
   39    H    THR  17           H        THR  17   9.150   5.770  -5.350
   40    HG1  THR  17           HG1      THR  17  10.240   3.950  -2.560
   41    H    SER  18           H        SER  18  12.030   3.180  -7.430
   42    HG   SER  18           HG       SER  18  13.660   1.080  -9.300
   43    H    ALA  19           H        ALA  19  11.960   0.970  -5.830
   44    H    ALA  20           H        ALA  20  11.110  -2.230  -3.140
   45    H    SER  21           H        SER  21  14.730  -0.330  -2.100
   46    HG   SER  21           HG       SER  21  17.310   1.490  -1.740
   47    H    SER  22           H        SER  22  15.420  -2.300  -0.170
   48    HG   SER  22           HG       SER  22  17.760  -1.210   3.620
   49    H    SER  23           H        SER  23  17.200  -5.100   2.470
   50    HG   SER  23           HG       SER  23  18.280  -6.920   4.720
   51    H    ASN  24           H        ASN  24  16.290  -3.180   4.270
   52   1HD2  ASN  24           HD2      ASN  24  19.380  -2.890   5.700
   53   2HD2  ASN  24           HD2      ASN  24  18.200  -3.890   6.500
   54    OH   TYR  25           OH       TYR  25   9.990   3.110  -1.000
   55    H    TYR  25           H        TYR  25  14.470  -1.940   3.470
   56    HH   TYR  25           HH       TYR  25   9.010   2.880  -0.830
   57    H    CYS  26           H        CYS  26  11.670  -1.100   4.340
   58    H    ASN  27           H        ASN  27  12.460   0.230   6.810
   59   1HD2  ASN  27           HD2      ASN  27  14.760  -1.210  10.680
   60   2HD2  ASN  27           HD2      ASN  27  14.970   0.520  10.660
   61    H    GLN  28           H        GLN  28  13.270   3.190   6.780
   62   1HE2  GLN  28           HE2      GLN  28  12.460   8.680   4.280
   63   2HE2  GLN  28           HE2      GLN  28  12.010   8.120   5.850
   64    H    MET  29           H        MET  29  11.410   3.870   5.170
   65    H    MET  30           H        MET  30   8.740   3.370   6.160
   66    H    LYS  31           H        LYS  31   8.720   5.470   8.150
   67   1HZ   LYS  31           HZ2      LYS  31  13.350   8.360  11.430
   68   2HZ   LYS  31           HZ3      LYS  31  12.820   9.060  12.810
   69   3HZ   LYS  31           HZ1      LYS  31  13.050   7.450  12.750
   70    H    SER  32           H        SER  32   8.900   7.840   6.670
   71    HG   SER  32           HG       SER  32  10.420  10.270   5.300
   72    NH1  ARG  33           NH2      ARG  33   2.690   9.740  -0.250
   73    NH2  ARG  33           NH1      ARG  33   2.900  11.400   1.290
   74    H    ARG  33           H        ARG  33   6.310   7.670   5.340
   75    HE   ARG  33           HE       ARG  33   3.810   9.600   2.740
   76   1HH1  ARG  33           HH2      ARG  33   2.750   8.760  -0.460
   77   2HH1  ARG  33           HH2      ARG  33   2.300  10.390  -0.890
   78   1HH2  ARG  33           HH1      ARG  33   3.100  11.700   2.230
   79   2HH2  ARG  33           HH1      ARG  33   2.490  12.030   0.640
   80    H    ASN  34           H        ASN  34   4.850   9.710   7.080
   81   1HD2  ASN  34           HD2      ASN  34   2.260  13.780   8.600
   82   2HD2  ASN  34           HD2      ASN  34   1.270  12.540   9.340
   83    H    LEU  35           H        LEU  35   3.400   7.060   7.860
   84    H    THR  36           H        THR  36   4.660   6.110  10.270
   85    HG1  THR  36           HG1      THR  36   7.560   6.030  12.310
   86    H    LYS  37           H        LYS  37   3.620   7.920  11.960
   87   1HZ   LYS  37           HZ1      LYS  37   8.860  11.090  13.380
   88   2HZ   LYS  37           HZ2      LYS  37   9.570  11.690  12.040
   89   3HZ   LYS  37           HZ3      LYS  37   8.430  12.560  12.830
   90    H    ASP  38           H        ASP  38   2.500   7.360  14.330
   91    NH1  ARG  39           NH2      ARG  39  -1.050   0.120  17.730
   92    NH2  ARG  39           NH1      ARG  39  -2.240   0.760  15.960
   93    H    ARG  39           H        ARG  39   1.380   5.500  15.320
   94    HE   ARG  39           HE       ARG  39  -1.740   3.120  16.800
   95   1HH1  ARG  39           HH2      ARG  39  -0.530   0.300  18.560
   96   2HH1  ARG  39           HH2      ARG  39  -1.190  -0.810  17.400
   97   1HH2  ARG  39           HH1      ARG  39  -2.560   1.430  15.290
   98   2HH2  ARG  39           HH1      ARG  39  -2.360  -0.210  15.800
   99    H    CYS  40           H        CYS  40   4.230   2.700  16.910
  100    H    LYS  41           H        LYS  41   3.560   1.710  12.610
  101   1HZ   LYS  41           HZ2      LYS  41  -1.200   1.760   7.280
  102   2HZ   LYS  41           HZ3      LYS  41  -2.480   2.310   8.130
  103   3HZ   LYS  41           HZ1      LYS  41  -1.030   3.090   8.210
  104    H    VAL  43           H        VAL  43   0.830  -3.150  10.470
  105    H    ASN  44           H        ASN  44   2.800  -3.620   6.740
  106   1HD2  ASN  44           HD2      ASN  44   2.020   1.500   3.680
  107   2HD2  ASN  44           HD2      ASN  44   3.300   0.840   4.670
  108    H    THR  45           H        THR  45   0.720  -2.040   3.370
  109    HG1  THR  45           HG1      THR  45   1.120  -5.480   1.350
  110    H    PHE  46           H        PHE  46   4.330  -1.680   1.010
  111    H    VAL  47           H        VAL  47   3.180   1.340  -2.050
  112    H    HIS  48           H        HIS  48   4.920  -0.270  -5.520
  113    HD1  HIS  48           HD1      HIS  48   8.850   2.510  -4.440
  114    HE2  HIS  48           HE2      HIS  48   8.980  -0.810  -2.130
  115    H    GLU  49           H        GLU  49   3.830   2.580  -6.940
  116    H    SER  50           H        SER  50   3.620   4.590 -10.830
  117    HG   SER  50           HG       SER  50   1.890   4.830 -12.160
  118    H    LEU  51           H        LEU  51   0.490   7.640  -8.980
  119    H    ALA  52           H        ALA  52  -1.320   7.820 -11.370
  120    H    ASP  53           H        ASP  53  -0.460   5.140 -12.650
  121    H    VAL  54           H        VAL  54  -1.870   3.700 -10.770
  122    H    GLN  55           H        GLN  55  -4.240   4.220 -10.440
  123   1HE2  GLN  55           HE2      GLN  55  -8.050   8.810 -10.920
  124   2HE2  GLN  55           HE2      GLN  55  -8.570   7.170 -10.610
  125    H    ALA  56           H        ALA  56  -4.780   2.950 -12.960
  126    H    VAL  57           H        VAL  57  -5.620   0.360 -11.720
  127    H    CYS  58           H        CYS  58  -7.940   0.070 -11.020
  128    H    SER  59           H        SER  59  -9.080  -0.570 -13.640
  129    HG   SER  59           HG       SER  59  -8.760  -0.370 -16.610
  130    H    GLN  60           H        GLN  60  -9.410  -3.200 -13.820
  131   1HE2  GLN  60           HE2      GLN  60  -3.660  -2.770 -15.630
  132   2HE2  GLN  60           HE2      GLN  60  -5.200  -1.940 -15.650
  133    H    LYS  61           H        LYS  61  -9.080  -6.230 -13.290
  134   1HZ   LYS  61           HZ1      LYS  61  -9.690 -10.590 -11.090
  135   2HZ   LYS  61           HZ2      LYS  61  -9.970 -12.190 -10.970
  136   3HZ   LYS  61           HZ3      LYS  61  -8.440 -11.610 -10.800
  137    H    ASN  62           H        ASN  62 -13.210  -7.490 -12.800
  138   1HD2  ASN  62           HD2      ASN  62 -15.750  -5.870  -7.830
  139   2HD2  ASN  62           HD2      ASN  62 -14.340  -5.350  -8.730
  140    H    VAL  63           H        VAL  63 -13.100  -7.420  -8.220
  141    H    ALA  64           H        ALA  64 -12.910 -11.000  -5.690
  142    H    CYS  65           H        CYS  65 -13.960  -8.150  -2.420
  143    H    LYS  66           H        LYS  66 -10.380  -8.620   0.490
  144   1HZ   LYS  66           HZ3      LYS  66  -6.850 -13.380   2.640
  145   2HZ   LYS  66           HZ1      LYS  66  -7.200 -13.430   1.050
  146   3HZ   LYS  66           HZ2      LYS  66  -5.650 -13.260   1.520
  147    H    ASN  67           H        ASN  67 -12.860  -8.560   2.600
  148   1HD2  ASN  67           HD2      ASN  67 -15.470  -5.310   3.450
  149   2HD2  ASN  67           HD2      ASN  67 -15.560  -6.170   4.950
  150    H    GLY  68           H        GLY  68 -14.490 -10.140   1.160
  151    H    GLN  69           H        GLN  69 -15.790  -8.230   0.360
  152   1HE2  GLN  69           HE2      GLN  69 -19.040  -6.210   3.450
  153   2HE2  GLN  69           HE2      GLN  69 -19.770  -6.820   1.980
  154    H    THR  70           H        THR  70 -18.450  -7.290  -3.140
  155    HG1  THR  70           HG1      THR  70 -17.550  -7.870  -7.470
  156    H    ASN  71           H        ASN  71 -15.900  -5.480  -3.670
  157   1HD2  ASN  71           HD2      ASN  71 -16.113  -1.597  -1.346
  158   2HD2  ASN  71           HD2      ASN  71 -17.501  -1.918  -2.323
  159    H    CYS  72           H        CYS  72 -13.700  -5.710  -5.730
  160    OH   TYR  73           OH       TYR  73 -15.510  -1.830  -8.880
  161    H    TYR  73           H        TYR  73  -9.750  -4.520  -6.630
  162    HH   TYR  73           HH       TYR  73 -15.660  -1.620  -7.880
  163    H    GLN  74           H        GLN  74  -9.080  -6.850 -10.160
  164   1HE2  GLN  74           HE2      GLN  74  -4.860 -11.970 -11.000
  165   2HE2  GLN  74           HE2      GLN  74  -4.310 -10.350 -11.360
  166    H    SER  75           H        SER  75  -4.670  -6.300 -10.470
  167    HG   SER  75           HG       SER  75  -1.670  -5.890 -11.630
  168    OH   TYR  76           OH       TYR  76  -9.690  -8.590 -17.350
  169    H    TYR  76           H        TYR  76  -4.550  -6.700 -15.000
  170    HH   TYR  76           HH       TYR  76 -10.040  -7.640 -17.310
  171    H    SER  77           H        SER  77  -1.880  -6.650 -15.030
  172    HG   SER  77           HG       SER  77   0.310  -4.390 -14.700
  173    H    THR  78           H        THR  78   2.180  -8.170 -13.680
  174    HG1  THR  78           HG1      THR  78   5.070  -7.870 -12.220
  175    H    MET  79           H        MET  79   2.390  -6.530  -9.380
  176    H    SER  80           H        SER  80   4.820  -2.870  -9.270
  177    HG   SER  80           HG       SER  80   8.760  -1.720  -7.370
  178    H    ILE  81           H        ILE  81   5.650  -5.040  -5.530
  179    H    THR  82           H        THR  82   5.230  -2.720  -1.830
  180    HG1  THR  82           HG1      THR  82   8.520  -3.580  -2.070
  181    H    ASP  83           H        ASP  83   6.610  -5.800   0.470
  182    H    CYS  84           H        CYS  84   4.630  -4.640   4.330
  183    NH1  ARG  85           NH2      ARG  85   1.600  -8.230  11.720
  184    NH2  ARG  85           NH1      ARG  85   2.710  -9.050  13.520
  185    H    ARG  85           H        ARG  85   7.450  -5.860   7.490
  186    HE   ARG  85           HE       ARG  85   4.720  -8.950  12.070
  187   1HH1  ARG  85           HH2      ARG  85   1.610  -7.890  10.780
  188   2HH1  ARG  85           HH2      ARG  85   0.760  -8.270  12.240
  189   1HH2  ARG  85           HH1      ARG  85   3.560  -9.320  13.970
  190   2HH2  ARG  85           HH1      ARG  85   1.830  -9.090  13.990
  191    H    GLU  86           H        GLU  86   5.310  -5.420  11.250
  192    H    THR  87           H        THR  87   9.380  -4.490  13.150
  193    HG1  THR  87           HG1      THR  87  11.270  -3.800  13.840
  194    H    GLY  88           H        GLY  88  10.450  -7.690  16.400
  195    H    SER  89           H        SER  89  12.170  -5.610  17.270
  196    HG   SER  89           HG       SER  89  14.070  -4.130  16.070
  197    H    SER  90           H        SER  90  10.310  -2.950  18.010
  198    HG   SER  90           HG       SER  90   9.520  -3.210  15.420
  199    H    LYS  91           H        LYS  91  11.470   1.190  17.200
  200   1HZ   LYS  91           HZ3      LYS  91  10.710   2.770  24.230
  201   2HZ   LYS  91           HZ1      LYS  91  10.300   4.300  24.630
  202   3HZ   LYS  91           HZ2      LYS  91   9.410   3.500  23.530
  203    OH   TYR  92           OH       TYR  92   4.560  10.290  17.900
  204    H    TYR  92           H        TYR  92   9.010   3.940  19.730
  205    HH   TYR  92           HH       TYR  92   4.030  10.210  17.040
  206    H    ASN  94           H        ASN  94  11.030   5.770  16.180
  207   1HD2  ASN  94           HD2      ASN  94  13.990   4.720  17.880
  208   2HD2  ASN  94           HD2      ASN  94  13.820   3.790  16.400
  209    H    CYS  95           H        CYS  95  10.050   3.760  13.360
  210    H    ALA  96           H        ALA  96  10.570  -0.790  13.920
  211    OH   TYR  97           OH       TYR  97   5.820   0.050  11.760
  212    H    TYR  97           H        TYR  97  12.110  -1.990   9.980
  213    HH   TYR  97           HH       TYR  97   4.980  -0.520  11.750
  214    H    LYS  98           H        LYS  98   9.780  -5.630   9.370
  215   1HZ   LYS  98           HZ3      LYS  98   9.110 -11.450  11.730
  216   2HZ   LYS  98           HZ1      LYS  98   9.460 -10.910  13.240
  217   3HZ   LYS  98           HZ2      LYS  98   8.310 -10.150  12.350
  218    H    THR  99           H        THR  99  12.160  -5.930   5.840
  219    HG1  THR  99           HG1      THR  99  12.120  -3.630   5.900
  220    H    THR 100           H        THR 100   9.090  -6.190   2.670
  221    HG1  THR 100           HG1      THR 100  10.040  -8.900   3.080
  222    H    GLN 101           H        GLN 101  11.400  -7.260  -0.910
  223   1HE2  GLN 101           HE2      GLN 101   8.420  -5.190  -6.070
  224   2HE2  GLN 101           HE2      GLN 101   8.640  -4.240  -4.650
  225    H    ALA 102           H        ALA 102   7.830  -6.640  -3.430
  226    H    ASN 103           H        ASN 103   7.650  -9.370  -6.810
  227   1HD2  ASN 103           HD2      ASN 103   8.330  -5.270  -9.940
  228   2HD2  ASN 103           HD2      ASN 103   8.990  -6.450  -8.840
  229    H    LYS 104           H        LYS 104   3.930  -7.590  -7.560
  230   1HZ   LYS 104           HZ1      LYS 104   2.940 -12.460  -2.200
  231   2HZ   LYS 104           HZ2      LYS 104   2.370 -13.650  -3.180
  232   3HZ   LYS 104           HZ3      LYS 104   3.820 -13.820  -2.400
  233    H    HIS 105           H        HIS 105   0.360 -10.060  -7.950
  234    HD1  HIS 105           HD1      HIS 105  -1.890  -9.190 -12.400
  235    HE2  HIS 105           HE2      HIS 105  -0.140 -12.820 -12.120
  236    H    ILE 106           H        ILE 106  -2.270  -6.390  -8.770
  237    H    ILE 107           H        ILE 107  -4.280  -6.250  -4.780
  238    H    VAL 108           H        VAL 108  -7.200  -3.750  -6.310
  239    H    ALA 109           H        ALA 109  -8.710  -1.160  -2.980
  240    H    CYS 110           H        CYS 110 -12.630  -0.530  -5.070
  241    H    GLU 111           H        GLU 111 -12.380   3.860  -6.150
  242    H    GLY 112           H        GLY 112 -16.120   6.160  -6.570
  243    H    ASN 113           H        ASN 113 -14.730  10.230  -7.780
  244   1HD2  ASN 113           HD2      ASN 113 -16.960  13.160 -12.470
  245   2HD2  ASN 113           HD2      ASN 113 -17.540  12.980 -10.830
  246    OH   TYR 115           OH       TYR 115 -16.090   0.780  -8.960
  247    H    TYR 115           H        TYR 115 -12.890   7.330 -11.790
  248    HH   TYR 115           HH       TYR 115 -15.680  -0.120  -9.220
  249    H    VAL 116           H        VAL 116 -11.590   6.130  -7.900
  250    H    VAL 118           H        VAL 118  -9.700   2.840  -3.510
  251    H    HIS 119           H        HIS 119  -8.930   1.650  -1.840
  252    HD1  HIS 119           HD1      HIS 119  -8.880   2.630   2.590
  253    HE2  HIS 119           HE2      HIS 119 -12.890   2.300   2.280
  254    H    PHE 120           H        PHE 120  -5.850  -0.040   0.710
  255    H    ASP 121           H        ASP 121  -5.690  -3.980  -1.370
  256    H    ALA 122           H        ALA 122  -5.780  -6.430  -1.750
  257    H    SER 123           H        SER 123  -2.020  -8.810  -1.410
  258    HG   SER 123           HG       SER 123   0.020  -7.300  -5.230
  259    H    VAL 124           H        VAL 124  -1.740 -10.000  -5.580
   
   
  No H/Q in entry =         259