*HEADER    ELECTRON TRANSPORT                      29-DEC-01   1IT1              
*TITLE     SOLUTION STRUCTURES OF FERROCYTOCHROME C3 FROM                        
*TITLE    2 DESULFOVIBRIO VULGARIS MIYAZAKI F                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C3;                                             
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO VULGARIS;                         
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 STRAIN: MIYAZAKI F                                                   
*KEYWDS    ELECTRON TRANSFER, TETRAHEME PROTEIN                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    E.HARADA, Y.FUKUOKA, T.OHMURA, A.FUKUNISHI, G.KAWAI,                  
*AUTHOR   2 T.FUJIWARA, H.AKUTSU                                                 
*REVDAT   1   10-JUL-02 1IT1    0                                                

             1     HA      2     QG        1.8     5.5
             1     HA      2     QD        1.8     3.2
             2     HA      2    1HB        1.8       3
             2     HA      2    1HD        2.5     5.5
             2     HA    201    QMB        2.5     7.8
             2    2HB      2    2HD        2.5     5.5
             2    2HB      3     HN        1.8     4.5
             2    2HB      4     HN        2.5     5.5
             2    2HB    201    HHB        1.8     4.5
             2    2HB    201    QMB        1.8       6
             2    1HB      3     HN        1.8     3.5
             2    1HB    201    QMA        2.5     7.8
             2    1HB    201    QMB        1.8       6
             2     QB     43     QD        1.8     6.1
             2     QG     43     QD        1.8     6.1
             2     QG     43     QE        1.8     6.1
             2     QG    201    HHB        1.8     5.5
             2     QG    201    QMB        1.8     6.6
             2     QD     43     QE        2.5     7.9
             3     HA      4     HN        1.8       3
             3     QB      3     HN        1.8     3.4
             3     QB      4     QB        2.5     8.6
             3     QB      4     HN        1.8       4
             3     QB      5     QG        2.5     7.9
             3     QB    201    HHB        2.5     7.2
             3     QB    201    QMA        1.8     6.6
             4     HA      5    2HG        2.5     5.5
             4     HA      5    2HD        1.8     3.5
             4     HA      5    1HD        1.8       3
             4     HA     22    HE1        2.5     5.5
             4     HA    201    HHB        1.8     4.5
             4     HA    201    QMB        1.8       6
             4     HA    201    QBB        1.8       6
             4     QB      4     HN        1.8     3.4
             4     QB      5     HA        2.5     7.8
             4     QB      5    2HG        2.5     7.8
             4     QB      5    2HD        1.8       6
             4     QB      5    1HD        1.8       6
             4     QB     22     HA        2.5     7.8
             4     QB     22     QB        1.8     4.6
             4     QB     22    HD2        1.8     4.3
             4     QB    201    HAB        1.8       6
             4     QB    201    HHB        1.8       6
             4     QB    201    HHC        2.5     7.8
             4     QB    201    QMA        1.8       7
             4     QB    201    QMB        1.8       7
             4     QB    201    QBB        1.8     3.7
             4     HN      5    2HD        2.5     5.5
             4     HN    201    HHB        2.5     5.5
             4     HN    201    QMB        1.8       6
             5     HA      5    2HB        1.8       3
             5     HA      5     QG        1.8       4
             5     HA      5    2HD        2.5     5.5
             5     HA      6     HN        1.8       3
             5     QB     22    HD1        1.8     6.1
             5    2HB      5    1HG        1.8       3
             5    2HB      5    2HD        2.5     5.5
             5    2HB      6     HN        1.8     3.5
             5    2HB      9    QD1        1.8       6
             5    1HB      5    1HG        1.8       3
             5    1HB      5    2HD        2.5     5.5
             5    1HB      5    1HD        1.8     4.5
             5    1HB      6     HN        1.8     3.5
             5    1HB      9    QD1        1.8     4.3
             5    1HB    201    QMA        2.5     7.8
             5     QG      6     HN        1.8     5.5
             5     QG     22    HE1        1.8       4
             5     QG     22    HD1        1.8     6.1
             5     QG    201    QAA        1.8     4.3
             5     QG    201    QMA        1.8     4.6
             5    2HG      9    QD1        1.8     6.8
             5    2HG    201    HHB        2.5     5.5
             5    2HG    201   1HBA        2.5     5.5
             5    1HG    201    HHA        1.8     4.5
             5    1HG    201    HHB        2.5     5.5
             5     QD      9     QB        2.5     7.9
             5     QD     22     QB        2.5     7.9
             5     QD     22    HD1        1.8     6.1
             5     QD     22    HE1        1.8     5.5
             5     QD    201    QMB        1.8     6.6
             5    2HD    201    HHB        1.8     4.5
             5    2HD    201    QMA        1.8       6
             5    1HD    201    HHB        1.8     4.5
             5    1HD    201    QMA        1.8       6
             6     HA      6     HN        1.8       3
             6     HA      7     HN        1.8       3
             6     QB      6     HN        1.8     3.4
             6     QB      7     HN        1.8     3.4
             6     QB      8     HN        2.5     7.8
             6     HN      7     HN        1.8     4.5
             7     HA      8     HN        1.8       3
             7     HA      8     QA        2.5       7
             7     HA     21    2HB        1.8     4.5
             7     HA     22     HN        1.8     4.5
             7     HA     22    2HB        2.5     5.5
             7     HA     23     HN        1.8     4.5
             7    2HB      7     HN        1.8     3.5
             7    2HB      8     HN        1.8       3
             7    2HB     21   2HD2        1.8     6.1
             7    2HB     23     HN        1.8     4.5
             7    1HB      7     HN        1.8       3
             7    1HB      8     HN        1.8     3.5
             7    1HB     21     HA        1.8     4.5
             7    1HB     23     HN        2.5     5.5
             7     HN      8     HN        1.8     4.5
             8     QA      8     HN        1.8     3.2
             8     QA      9     HN        1.8     3.2
             8     QA     19    QG2        1.8     6.6
             8     QA     19    QG1        1.8     4.6
             8     QA     20     HN        1.8     5.5
             8     QA     21     HA        2.5       7
             8     QA     21    QD2        2.5     7.8
             8     QA     21    1HB        2.5     7.2
             8     HN      9     HN          2       3
             8     HN      9     QB        2.5     7.2
             8     HN     19    QG1        1.8     6.1
             8     HN     21     HA        1.8     4.5
             8     HN     21     QB        1.8     6.1
             8     HN     21    QD2        1.8     6.1
             8     HN     22     HN        1.8     4.5
             9     HA      9    2HB        1.8       3
             9     HA      9     HG        1.8     3.5
             9     HA      9    QD1        1.8       6
             9     HA      9    QD2        1.8     3.4
             9     HA     10     HA        2.5     5.5
             9     HA     10     HN        1.8       3
             9     HA     19     HA        2.5     5.5
             9     HA     20     HN        2.5     5.5
             9     QB      9     HN        1.8       4
             9     QB     10     HN        1.8     5.5
             9     QB     20     QB        1.8       6
             9     QB    201    QAD        2.5     7.8
             9    QD1      9     HN        1.8       6
             9    QD1     11     HN        1.8       6
             9    QD1     20    2HB        1.8       6
             9    QD1     20    1HB        1.8       6
             9    QD1     22    HD1        1.8       6
             9    QD1     22    HE1        1.8       6
             9    QD1     22     HN        2.5     7.8
             9    QD1    201   1HAD        1.8     4.3
             9    QD1    201    QBD        1.8     4.3
             9    QD2      9     HN        1.8       6
             9    QD2     10     HN        1.8     3.7
             9    QD2     12     HN        1.8     6.3
             9    QD2     20    2HB        2.5     7.8
             9    QD2     20    1HB        1.8       6
             9    QD2     20     HN        1.8     6.3
             9    QD2     20    HD2        1.8       6
             9    QD2    201    HHA        2.5     7.8
             9    QD2    201    QBD        1.8     6.6
             9    QD2    201    QMA        1.8       7
             9     HG      9     HN        1.8       4
             9     HG     10     HN        1.8     3.5
             9     HG     20     HN          3     5.5
             9     HG     22    HD1        2.5     5.5
             9     HN     10     HN        1.8     4.5
             9     HN     19    QG1        2.5     7.8
             9     HN     20     HN        1.8     3.5
             9     HN     20    HD2        2.5     5.5
             9     HN     22    HD1          3     5.5
            10     HA     10    1HB        1.8       3
            10     HA     10     QG        1.8       4
            10     HA     11     HN        1.8       3
            10     HA     19    QG1        1.8       6
            10     HA     19    QG2        1.8     4.3
            10     QB     10     HN        1.8     3.2
            10     QB     11     HN        1.8       4
            10     QB     20     HN        2.5     7.2
            10    2HB     19     HA        1.8     4.5
            10    1HB     10     QE        1.8     5.5
            10     QD     19    QG2        1.8     4.6
            10     QG     10     HN        1.8       4
            10     QG     11     HN        1.8     6.7
            10     QG     12     HA        2.5     7.8
            10     QG     18     HA        1.8     5.5
            10     QG     19     HN        1.8     4.5
            10     QG     19    QG2        1.8     6.6
            10    2HG     19    QG1        1.8     6.6
            10    1HG     19    QG1        1.8     6.6
            10     HN     11     HN        2.5     5.5
            10     HN     19    QG1        2.5     7.8
            10     HN     20     HN        2.5     5.5
            11     HA     11     QB        1.8     3.2
            11     HA     12     HN        1.8       3
            11     HA     12     HA        2.5     5.5
            11     HA     13     HN        1.8     3.5
            11     HA    201    QBD        1.8     5.5
            11     QB     11     HN        1.8       4
            11     QB     18     HN        1.8     5.5
            11     QB     18     HB        1.8       4
            11     QB     18    QG2        1.8     6.6
            11     QB     20    2HB        1.8     5.5
            11     QB     65     QD        2.5     7.9
            11     QB     65     QE        2.5     7.2
            11     QB    204   2HBD        1.8       4
            11     QG     20     HN        1.8     5.5
            11     QB     65     QE        2.5     7.2
            11     QG     65     QE        2.5     7.2
            11     QE     65     QE        1.8     6.6
            11     HN     12     HN        1.8     4.5
            11     HN     17    2HB        2.5     5.5
            11     HN     18     HN        1.8     4.5
            11     HN     18     HB        2.5     5.5
            11     HN     19    QG2        1.8       6
            11     HN     20     HN        1.8     4.5
            11     HN     20    2HB        2.5     5.5
            11     HN     65     QE        2.5     7.2
            12     HA     12    2HB        1.8       3
            12     HA     12    1HB        1.8       3
            12     HA     13     HN        1.8     3.5
            12     HA     17     HA        1.8     3.5
            12     HA     17     QB        1.8       4
            12     HA     17    2HD        2.5     5.5
            12     HA     17     QG        1.8     5.5
            12     HA     18     HN        1.8     4.5
            12     HA     65     QE        2.5     7.2
            12     HA    204   2HAD        2.5     5.5
            12     QB     17     QB        1.8     3.4
            12     QB     17     QD        1.8       6
            12    2HB     13     HN        1.8     4.5
            12    2HB     14     HN        2.5     5.5
            12    2HB     17     HA        2.5     4.5
            12    2HB     17     QG        1.8     5.5
            12    2HB     12     HN        1.8       4
            12    1HB     12     HN        1.8     3.5
            12     HN     13     HN        1.8     3.5
            12     HN     13     HA        2.5     5.5
            12     HN     13     QG        1.8       4
            12     HN     13     QD        1.8     5.5
            12     HN     17     HA        2.5     5.5
            12     HN     65     QE        2.5     7.2
            12     HN    204   2HBD        2.5     5.5
            13     HA     13     QD        1.8       4
            13     HA     14     HA        2.5     5.5
            13     HA     14     HN        1.8     3.5
            13     HA     65     QE        2.5     7.2
            13     QB     17     HA        2.5     7.2
            13    2HB     13     HN        1.8     3.5
            13    2HB     13     QD        1.8       4
            13    2HB     14     HN        1.8     3.5
            13    2HB     47     QB        1.8       6
            13    2HB     65    2HB        2.5     5.5
            13    2HB     65     QD        1.8       4
            13    2HB     65     QE        1.8       4
            13    1HB     13     HN        1.8       3
            13    1HB     14     HA        2.5     5.5
            13    1HB     47     QB        1.8       6
            13    1HB     65     QD        1.8     5.5
            13    1HB     65     QE        1.8       4
            13    1HB    204   1HAD        1.8     4.5
            13     QG     13     HN        1.8     3.2
            13     QG     47     HN        2.5     7.2
            13     QG     65     QD        1.8     6.1
            13     QG     65     QE        1.8     6.1
            13    2HG     14     HN        2.5     5.5
            13    1HG     14     HN        2.5     7.2
            13     QD     13     HN        1.8       4
            13     QD     14     HN        2.5     7.2
            13     HN     65     QD        1.8     5.5
            13     HN     65     QE        2.5     7.2
            14     HA     15     HA        2.5     5.5
            14     HA     15     QG        1.8     5.5
            14     HA     15     QD        1.8     6.1
            14     HA     15     HN        1.8       3
            14     HA     55     HA        2.5     5.5
            14     HA     65     QE        2.5     7.2
            14     HA    204    HHA        2.5     5.5
            14     HA    204   2HAA        1.8     4.5
            14     HA    204   1HAA        2.5     5.5
            14     HB     15     HA        2.5     5.5
            14     HB     15     HN        1.8       3
            14     HB     16     HN        1.8       3
            14     HB     16    2HB        2.5     5.5
            14     HB    204    HHA        1.8     4.5
            14     HB    204    QAA        1.8     5.5
            14     HB    204   1HAA        1.8     3.5
            14     HB    204   2HBA        1.8     4.5
            14     HB    204   1HBA        2.5     5.5
            14    QG2     14     HN        1.8     3.4
            14    QG2     15     HN        2.5     7.8
            14    QG2     65    1HB        1.8       6
            14    QG2     65     QD        1.8     4.6
            14    QG2     65     QE        1.8     6.6
            14    QG2     65     HN        2.5     7.8
            14    QG2     66     QD        2.5     8.6
            14    QG2    204    HHA        1.8     4.3
            14    QG2    204   2HAA        1.8     4.3
            14    QG2    204   1HAA        1.8     4.6
            14    QG2    204    QAD        1.8     4.6
            14    QG2    204   1HAD        1.8       6
            14    QG2    204   1HBD        1.8       6
            14    QG2    204   1HBA        1.8       6
            14    QG2    204   2HBD        2.5     7.8
            14     HN     15     HN        1.8     4.5
            14     HN     16     HN        1.8     4.5
            14     HN     65     QD        1.8     5.5
            14     HN     65     QE        1.8     5.5
            14     HN    204    HHA        2.5     5.5
            14     HN    204   2HBD        2.5     5.5
            15     HA     15     HN        1.8       3
            15     HA     15    2HB        1.8       3
            15     HA     15    1HB        1.8       3
            15     HA     15     QG        1.8     3.2
            15     HA     15     QD        1.8       4
            15     HA     16     HN        1.8     4.5
            15     HA     17     QD        1.8       6
            15     QB     15     HN        1.8     3.2
            15    2HB     16     HN        1.8     3.5
            15    1HB     17    2HD        2.5     5.5
            15    1HB    204    QMA        2.5     7.8
            15     QG     15     QE        1.8     4.3
            15     QD     15     QE        1.8     3.4
            15     QD     15     HN        1.8     3.2
            15     HN     16     HN        1.8       3
            15     HN     16     QB        1.8     5.5
            15     HN     17     QD        1.8     5.5
            15     HN    204    QAA        2.5     7.2
            15     HN    204   1HAA        1.8     4.5
            16     HA     16     HN        1.8       3
            16     HA     17     HA        2.5     5.5
            16     HA     17    2HB        2.5     5.5
            16     HA     17     QG        1.8     5.5
            16     HA     17    2HD        1.8     3.5
            16     HA     17    1HD        1.8       3
            16     HA    204    HHA        2.5     5.5
            16     HA    204   2HAA        2.5     5.5
            16     QB     16     HN        1.8     3.2
            16     QB    106    HE1        1.8     3.2
            16    2HB     16     QG        1.8     3.2
            16    2HB     16    QE2        1.8       4
            16    2HB    106    HD1        1.8     4.5
            16    2HB    204    HHA        1.8     4.5
            16    2HB    204   2HAA        1.8     5.5
            16    2HB    204   1HAA        1.8     4.5
            16    1HB     16    QE2        1.8       4
            16    1HB     17    2HD        2.5     5.5
            16    1HB     18    QG2        2.5     7.8
            16    1HB    204    HHA        2.5     5.5
            16    1HB    204   2HAA        2.5     5.5
            16    QE2     16     HN        1.8     5.5
            16     QG    204   2HAA        1.8     5.5
            16     QG    204    QMA        1.8     6.6
            16     QG    204   1HAA        2.5     7.2
            16    2HG     16     HN        1.8     3.5
            16    2HG     16    QE2        1.8     5.5
            16    1HG     16     HN        1.8     4.5
            16    1HG     16    QE2        1.8     5.5
            16     HN     17     QD        1.8       4
            16     HN     17     HA        2.5     5.2
            16     HN    204    HHA        2.5     5.5
            16     HN    204   2HAA        1.8     4.5
            16     HN    204   2HBA        2.5     5.5
            16     HN    204   1HBA        2.5     5.5
            17     HA     17    2HB        1.8       3
            17     HA     17    1HB        1.8       3
            17     HA     17     QG        1.8       4
            17     HA     17    2HD        1.8     4.5
            17     HA     17    1HD        1.8     4.5
            17     HA     18     HA        2.5     5.5
            17     HA     18     HN        1.8       3
            17     HA     18     HB        2.5     5.5
            17     HA     18    QG2        1.8       6
            17     HA    204    HHA        2.5     5.5
            17     HA    204   2HBD        1.8     4.5
            17     HA    204   1HBD        1.8     3.5
            17     HA    204    QMD        1.8       6
            17    2HB     17     QG        1.8     3.2
            17    2HB     17    2HD        1.8     4.5
            17    2HB     17    1HD        1.8     4.5
            17    1HB     17     QG        1.8     3.4
            17    1HB     17    2HD        1.8     4.5
            17    1HB     17    1HD        1.8     4.5
            17    1HB    204   1HBD        2.5     5.5
            17     QG     17    2HD        1.8     3.4
            17     QG     17    1HD        1.8     3.4
            17     QG     18     HN        1.8     5.5
            18     HA     18    QG1        1.8     3.4
            18     HA     18    QG2        1.8     3.4
            18     HA     19     HN        1.8       3
            18     HA     19     HB        1.8     4.5
            18     HA    106    HD1        1.8     4.5
            18     HA    106     HA        1.8     4.5
            18     HA    204   2HBD        2.5     5.5
            18     HB     18     HN        1.8     3.5
            18     HB     18    QG1        1.8     3.4
            18     HB     18    QG2        1.8     3.4
            18     HB     19     HN        2.5     5.5
            18     HB    203    QMB        1.8     4.3
            18     HB    204    HHD        2.5     5.5
            18     HB    204   2HBD        1.8     4.5
            18     HB    204   1HBD        1.8     4.5
            18     HB    204    QMD        1.8     4.3
            18    QG1     18     HN        1.8     4.3
            18    QG1     19     HN        1.8     4.3
            18    QG1     19    QG2        1.8       7
            18    QG1     20     HA          2     4.5
            18    QG1     20    HD1        1.8       6
            18    QG1    105     HA        1.8     3.4
            18    QG1    105     HN        2.5     7.8
            18    QG1    106     HN        2.5     7.8
            18    QG1    203    HHB        1.8       6
            18    QG1    203    QMA        1.8     4.8
            18    QG1    203    QMB        1.8     3.7
            18    QG1    204    HHD        1.8     4.3
            18    QG1    204    HAC        1.8       6
            18    QG1    204    QMD        1.8     3.7
            18    QG2     18     HN        1.8     4.3
            18    QG2     19     HN        1.8       6
            18    QG2    105     HA        1.8     4.3
            18    QG2    105    2HB        1.8       6
            18    QG2    105    1HB        1.8       6
            18    QG2    106     HA        1.8       6
            18    QG2    106     QB        2.5     8.6
            18    QG2    106    HD1        1.8     4.3
            18    QG2    106    HE1        1.8     3.4
            18    QG2    203    HHB        2.5     7.8
            18    QG2    203    QMB        1.8       7
            18    QG2    204    HHA        2.5     7.8
            18    QG2    204    HAC        1.8       6
            18    QG2    204   2HBD        1.8       6
            18    QG2    204   1HBD        1.8     4.3
            18    QG2    204    HHD        1.8       6
            18    QG2    204    QMD        1.8     4.8
            18     HN    204   2HBD        1.8     4.5
            18     HN    204   1HBD        1.8     4.5
            18     HN    204    QMD        1.8       6
            18     HN    204    QAD        1.8     5.5
            19     HA     19    QG1        1.8     3.4
            19     HA     19    QG2        1.8     3.4
            19     HA     20     HN        1.8     3.5
            19     HA    201    QBD        2.5     7.2
            19     HB     19     HN        1.8       3
            19     HB     19    QG1        1.8     3.4
            19     HB     19    QG2        1.8     3.4
            19     HB     20     HN        1.8     4.5
            19    QG1     19     HN        1.8       6
            19    QG1     20     HN        1.8     4.3
            19    QG1     21   2HD2        1.8       6
            19    QG1     21   1HD2        1.8       6
            19    QG1    203    QMA        1.8       7
            19    QG2     19     HN        1.8     4.3
            19    QG2     20     HN        1.8       6
            19    QG2    105     HA        2.5     7.9
            19     HN     20     HN        2.5     5.5
            20     HA     20    HD1        1.8       3
            20     HA     20    HD2        1.8     4.5
            20     HA     20     HN        1.8       3
            20     HA    201    QMD        2.5     7.8
            20     HA    203    QMA        1.8     4.3
            20     HA    203    QMB        2.5     7.8
            20    2HB     20    HD1        1.8     4.5
            20    2HB     20    HD2        1.8     4.5
            20    2HB     20     HN        1.8     3.5
            20    2HB     21     HN        2.5     5.5
            20    2HB    201    HHD        2.5     5.5
            20    2HB    201    QMD        1.8     3.5
            20    1HB     20    HD1        1.8     4.5
            20    1HB     20    HD2        1.8     4.5
            20    1HB     20     HN        1.8     3.5
            20    1HB     21     HN        1.8     4.5
            20    1HB    203    QMB        2.6     7.8
            20    1HB    203    HHB        2.5     5.5
            20    HD1     20    HE1        1.8     4.5
            20    HD1     20    HE2        2.5     5.5
            20    HD1     21    1HB        2.5     5.5
            20    HD1     25    HD1        2.5     5.5
            20    HD1    201    QBC        1.8       6
            20    HD1    201    QMD        1.8     4.3
            20    HD1    203    HHB        2.5     5.5
            20    HD1    203    QBB        1.8     6.1
            20    HD1    203    QMA        1.8       6
            20    HD1    203    QMB        1.8     4.3
            20    HD1    204    QMD        2.5     7.8
            20    HD2     22     HA        1.8     4.5
            20    HD2     22    HD1        1.8     3.5
            20    HD2     22    HE1        1.8     4.5
            20    HD2     25    1HB        2.5     5.5
            20    HD2    201    QMD        1.8       6
            20    HD2    203    QBB        1.8     6.5
            20    HE1     25    HD2        1.8       3
            20    HE1     25    HE1        1.8     3.5
            20    HE1     25    HD1        1.8     3.5
            20    HE1    201    HAC        1.8     4.5
            20    HE1    201    HHD        2.5     5.5
            20    HE1    201    QMD        2.5     7.8
            20    HE1    201    QBC        1.8     4.6
            20    HE1    203    QBB        1.8     6.1
            20    HE1    203    HHB        2.5     5.5
            20    HE2     22     HN        2.5     5.5
            20    HE2     22    HD2        1.8       3
            20    HE2     22    HE1        1.8     4.5
            20    HE2    201    HAC        2.5     5.5
            20    HE2    201    HHD        2.5     5.5
            20     HN     21     HA        2.5     5.5
            20     HN     21     HN        2.5     5.5
            20     HN    201    QBD        2.5     7.2
            20     HZ     22     HA        1.8     4.5
            20     HZ     25    2HB        1.8     3.5
            20     HZ     25    HD1        1.8     3.5
            20     HZ     25    HD2        2.5     5.5
            20     HZ    201    HAC        1.8       3
            20     HZ    201    HHC        2.5     5.5
            20     HZ    201    HHD        1.8     3.5
            20     HZ    201    QBC        1.8     4.6
            20     HZ    201    QMC        1.8       6
            20     HZ    203    QBB        2.5     7.2
            21     HA     21    2HB        1.8       3
            21     HA     22     HN        1.8     3.5
            21     HA     23     HN        1.8     4.5
            21     HA     23     QB        2.5     7.2
            21     QB     21    QD2        1.8     6.6
            21     QB     22     QB        2.5       7
            21    2HB     21     HN        1.8       3
            21    2HB     22     HN        2.5     5.5
            21    2HB     23     HN        2.5     5.5
            21    2HB     24     HB        1.8     4.5
            21    2HB     24     HN        1.8     4.5
            21    2HB     25    HD1        2.5     5.5
            21    1HB     21     HN        1.8     3.5
            21    1HB     24     HB        1.8     4.5
            21    1HB     24     HN        2.5     5.5
            21    QD2     24    QG2        2.5     8.6
            21    QD2     25    HD1        2.5     7.2
            21    QD2     25    HE1        2.5     7.2
            21    QD2    203    QMA        2.5     7.8
            21    QD2    203    QBA        2.5       8
            21     HN     21    QD2        1.8     6.1
            21     HN     22     HA        2.5     5.5
            22     HA     23     HN        1.8     4.5
            22     HA     24     HN        2.5     5.5
            22     HA     25    2HB        1.8     4.5
            22     HA     25    HD1        1.8     3.5
            22     HA     25     HN        1.8     4.5
            22     HA    201    QBC        2.5     7.8
            22    2HB     22     HN        1.8     3.5
            22    2HB     22    HD2        1.8     4.5
            22    2HB     23     HN        1.8     4.5
            22    1HB     22     HN        1.8     4.5
            22    1HB     23     HN        1.8     4.5
            22    HD1     23     HN        2.5     5.5
            22    HD2     26     HN        2.5     5.5
            22    HD2    201    HHC        1.8     4.5
            22    HD2    201    HAB        2.5     5.5
            22    HD2    201    HAC        2.5     5.5
            22    HD2    201    QMB        2.5     7.8
            22    HE1    201    HHA        1.8     4.5
            22    HE1    201   1HAD        2.5     5.5
            22     HN     22    HD1        1.8     3.5
            22     HN     23     HN        1.8     4.5
            22     HN     24     HN        1.8     4.5
            22     HN     25    HD1        2.5     5.5
            23     HA     24     HN        1.8     4.5
            23     HA     25     HN        1.8     4.5
            23     HA     26     HA        2.5     5.5
            23     HA     26     HN        2.5     5.5
            23     HA     26     QB        1.8     5.5
            23     HA     26     QG        1.8     5.5
            23     HA     26     QD        1.8     5.5
            23     HN     24     HN        1.8     3.5
            23     HN     25     HN        2.5     5.5
            23     HN     26     QB        2.5     7.2
            24     HA     24     HB        1.8       3
            24     HA     24    QG2        1.8     3.4
            24     HA     25     HN        1.8     3.5
            24     HA     25    HD1        1.8     4.5
            24     HA     26     HN        2.5     5.5
            24     HA     26     QG        1.8     5.5
            24     HA     27     HN        2.5     5.5
            24     HA    203    HHA        2.5     5.5
            24     HA    203    QMD        1.8       6
            24     HB     24     HN        1.8     3.5
            24     HB     24    QG2        1.8     3.4
            24     HB     25     HN        1.8     4.5
            24     HB     25    HE1        1.8     3.5
            24     HB    203    HHA        2.5     5.5
            24     HB    203   1HAD        1.8     4.5
            24     HB    203    QBA        1.8       4
            24    QG2     24     HN        1.8       6
            24    QG2     25     HN        1.8       6
            24    QG2     25    HD1        1.8       6
            24    QG2     25    HD2        2.5     7.8
            24    QG2     25    HE1        1.8       6
            24    QG2    203    HHA        1.8     4.3
            24    QG2    203   1HAA        1.8       6
            24    QG2    203   1HAD        1.8       6
            24    QG2    203    QBA        1.8     4.6
            24    QG2    203    QMD        2.5       9
            24     HN     25     HN        1.8     3.5
            24     HN     25     HA        2.5     5.5
            24     HN     25    1HB          3     5.5
            24     HN     25    HD1        1.8     3.5
            24     HN     26     HN        1.8     4.5
            24     HN     26     QB        2.5     7.2
            25     HA     25    2HB        1.8       3
            25     HA     25    1HB        1.8       3
            25     HA     25    HD1        1.8     4.5
            25     HA     25    HD2        1.8     3.5
            25     HA     26     HA        2.5     5.5
            25     HA     26     HN        1.8     3.5
            25     HA     27     QB        1.8       6
            25     HA     28     HN        1.8     3.5
            25     HA     28    QG1        1.8       6
            25     HA     28    QG2        1.8     4.3
            25     HA    201    QBC        1.8       6
            25     HA    203    HHD        2.5     5.5
            25     HA    203    QMD        1.8       6
            25     HA    203    HAC        2.5     5.5
            25    2HB     25     HN        1.8     3.5
            25    2HB     25    HD1        1.8       4
            25    2HB     25    HD2        1.8     4.5
            25    2HB     26     HN        1.8     4.5
            25    2HB     28     HN        2.5     5.5
            25    2HB     28    QG2        1.8       6
            25    2HB    201    QMC        1.8     4.3
            25    2HB    201    QBC        1.8     4.6
            25    1HB     25     HN        1.8     3.5
            25    1HB     25    HD1        1.8       4
            25    1HB     26     HA        1.8     4.5
            25    1HB     26     HN        1.8     4.5
            25    1HB    201    QMC        1.8     4.3
            25    1HB    201    QBC        1.8     4.6
            25    HD1    201    QBC        1.8       6
            25    HD2     25    HE1        1.8     4.5
            25    HD2     28     HB        2.5     5.5
            25    HD2     28    QG1        2.5     7.8
            25    HD2     28    QG2        1.8     4.3
            25    HD2    201    HAC        2.5     5.5
            25    HD2    201    QBC        1.8     4.6
            25    HD2    203    HHD        1.8     4.5
            25    HD2    203    HAC        1.8     4.5
            25    HD2    203    QBC        1.8       6
            25    HD2    203    QMD        1.8       6
            25    HD2    203    QMC        2.5     7.8
            25    HE1    203    HHA        2.5     5.5
            25    HE1    203    HHB        1.8     4.5
            25    HE1    203   1HAA        2.5     5.5
            25    HE1    203    QMA        1.8       6
            25     HN     25    HD1        1.8     3.5
            25     HN     26     HN        1.8     3.5
            25     HN     26     QB        2.5     7.2
            25     HN     26     QG        2.5     7.2
            25     HN     26     HA        1.8     4.5
            25     HN     28     HN        2.5     5.5
            25     HN     28     HB        2.5     5.5
            25     HN    201    QBC        2.5     7.8
            26     HA     26    2HB        1.8     3.2
            26     HA     26    1HB        1.8     3.2
            26     HA     26     QG        1.8     5.5
            26     HA     26     QE        2.5     7.2
            26     HA     27     HN        1.8     3.5
            26     HA     28     HN        1.8     4.5
            26     HA    201    QBB        1.8     4.3
            26     HA    201    QMC        2.5     7.8
            26     QB     26     HN        1.8       4
            26    2HB     27     HN        1.8     4.5
            26    1HB     27     HN        1.8     4.5
            26     QG     26     HN        1.8       4
            26     QG     27     HN        2.5     7.2
            26     QG     28     HN        2.5     7.2
            26     QE     26     HN        1.8     5.5
            26     HN     27     HN        1.8     3.5
            27     HA     27     QB        1.8     3.4
            27     QB     27     HN        1.8     3.4
            27     QB     28     HN        1.8       6
            27     QB    203    QMD        1.8       7
            27     HN     28     HN        1.8       3
            27     HN     28    QG2        1.8       6
            28     HA     28    QG1        1.8     3.4
            28     HA     28    QG2        1.8     3.4
            28     HA     29     HN        1.8       3
            28     HA     29     HA        1.8     4.5
            28     HA     30     HN        2.5     5.5
            28     HA    203    HHD        2.5     5.5
            28     HB     28     HN        1.8     3.5
            28     HB     28    QG1        1.8     3.4
            28     HB     28    QG2        1.8     3.4
            28     HB     29     HN        1.8     3.5
            28     HB     30     HA        2.5     5.5
            28     HB    201    HHC        2.5     5.5
            28     HB    201    QMC        1.8     3.4
            28     HB    201    QBC        1.8       6
            28     HB    203    HAC        2.5     5.5
            28     HB    203    HHD        2.5     5.5
            28    QG1     29     HN        1.8     3.4
            28    QG1     32    1HB        1.8     4.3
            28    QG1     33     HN        2.5     7.8
            28    QG1    201    HHC        2.5     7.8
            28    QG1    201    QMC        1.8     4.8
            28    QG1    201    QBC        1.8     4.6
            28    QG1    203    HAC        1.8       6
            28    QG1    203    QBC        1.8     4.8
            28    QG1    203    HHD        1.8       6
            28    QG2     28     HN        1.8     3.4
            28    QG2     29     HN        1.8       6
            28    QG2     32     HN        2.5     7.8
            28    QG2    201    QMC        1.8     4.8
            28    QG2    201    QBC        1.8     4.6
            28    QG2    203    HAC        1.8     4.3
            28    QG2    203    HHD        1.8       6
            28    QG2    203    QBC        1.8     6.6
            28     HN     29     HN        2.5     5.5
            28     HN     29     HA        2.5     5.5
            28     HN     30     HN        2.5     5.5
            28     HN    201    QMC        2.5     7.8
            28     HN    203    QMD        2.5     7.8
            29     HA     29     HN        1.8     3.5
            29     HA     29     QB        1.8     3.2
            29     HA     29     QG        1.8       4
            29     HA     30     HN        1.8       3
            29     HA     31     HN        1.8     4.5
            29     HA     32     HN        2.5     5.5
            29     HA    201    QMC        2.5     7.8
            29     QB     29     HN        1.8     3.2
            29     QB     30     HA        2.5     7.2
            29     QB     30     HN        1.8       4
            29     QB     32    1HB        1.8     5.5
            29     QB    201    QMC        2.5     8.6
            29     QB     31     HN        1.8       4
            29    2HB     32     HN        1.8     3.5
            29    1HB     32     HN        1.8     3.5
            29     QG     29     QE        1.8       4
            29     QG     30     HN        1.8       4
            29     QG     31     HN        1.8     5.5
            29     QG     32    1HB        1.8       4
            29     QG     32     HN        1.8     5.5
            29     HN     30     HN        1.8     4.5
            29     HN     32     HN        2.5     5.5
            29     HN     32    2HB        1.8     3.5
            29     HN     32    1HB        1.8       4
            29     HN    201    QMC        1.8       6
            29     HN    203    HAC        2.5     5.5
            29     HN    203    QBC        1.8       6
            30     HA     30     HN        1.8       3
            30     HA     31     HN        1.8     3.5
            30     HA     32     HN        1.8     4.5
            30     HA     33     HN        1.8     4.5
            30     HA     34    1HB        1.8     4.5
            30     HA     34    HD2        1.8     4.5
            30     HA     34     HN        1.8     4.5
            30     HA     43     QD        2.5     7.2
            30     HA     43     QE        2.5     7.2
            30     HA    201    HAB        1.8     3.5
            30     HA    201    HHC        1.8       3
            30     HA    201    QBB        1.8       6
            30     HA    201    QMC        1.8     3.4
            30     QB     30     HN        1.8       4
            30     QB     31    1HA        1.8     5.5
            30     QB     31     HN        1.8       4
            30     QB     32     HN        1.8     5.5
            30     QB     34    2HB        2.5     7.2
            30     QB     34    1HB        2.5     7.2
            30     QB     34    HD2        1.8     5.5
            30     QB     43     QE        1.3     4.3
            30     QB    201    HHC        1.8     5.5
            30     QB    201    QMC        1.8     6.6
            30    2HB    201    HAB        1.8     4.5
            30    1HB     43     QD        1.8     6.1
            30    1HB    201    HAB        1.8     4.5
            30     HN     31     HN        1.8       3
            30     HN     32     HN        1.8     4.5
            30     HN     33     HN        2.5     5.5
            30     HN     43     QE        2.5     7.2
            30     HN    201    HHC        2.5     5.5
            30     HN    201    HAB        1.8     4.5
            30     HN    201    QMC        1.8       6
            30     HN    201    QBB        2.5     7.8
            31     QA     34     HN        1.8     4.3
            31     QA     42     HN        2.5       7
            31     QA    201    HHC        2.5     7.2
            31    2HA     32     HN        1.8     4.5
            31    2HA     33     HN        2.5     5.5
            31    2HA     35     HA        1.8     3.5
            31    2HA     43     QE        2.5       7
            31    1HA     34    2HB        1.8     4.5
            31    1HA     35     HA        1.8       3
            31    1HA     41     QB        1.8     5.5
            31    1HA     43     QE        1.8     5.5
            31     HN     32     HN        1.8     3.5
            31     HN     33     HN        2.5     5.5
            31     HN     43     QE        2.5     7.2
            31     HN    201    HHC        2.5     5.5
            32     HA     32    2HB        1.8       3
            32     HA     32    1HB        1.8       3
            32     HA     33     HN        1.8     4.5
            32     HA     34     HN        2.5     5.5
            32     HA     35     HA        1.8     4.5
            32     HA     35     QB        1.8     5.5
            32    2HB     32     HN        1.8       3
            32    2HB     33     HN        1.8       4
            32    2HB     77     HN        2.5     5.5
            32    2HB    203    QMC        1.8       6
            32    1HB     32     HN        1.8       3
            32    1HB     33     HN        1.8     3.5
            32    1HB     77     HN        2.5     5.5
            32     HN     33     HN        1.8     3.5
            32     HN     34     HN        1.8     4.5
            32     HN    201    QMC        1.8       6
            33     HA     33    2HB        1.8       3
            33     HA     34     HN        1.8     4.5
            33     HA     76    1HB        1.8     4.5
            33     HA    201    HHD        2.5     5.5
            33     HA    201    HAC        1.8     4.5
            33     HA    202    QBB        2.5     7.8
            33     QB     33     HN        1.8       4
            33    2HB     34    HD2        1.8     4.5
            33    2HB    201    HAC        1.8       3
            33    2HB    201    HHD        1.8     4.5
            33    2HB    201    QMC        1.8       6
            33    2HB    201    QBC        1.8       6
            33    2HB    202    QMB        1.8       6
            33    2HB    202    QBB        1.8       6
            33    1HB     34     HN        1.8       3
            33    1HB     34    HD2        1.8     4.5
            33    1HB    201    HAC        1.8     4.5
            33    1HB    201    HHC        2.5     5.5
            33    1HB    201    HHD        1.8     4.5
            33    1HB    201    QMC        1.8       6
            33    1HB    201    QBC        2.5     7.8
            33    1HB    202    QBB        1.8       6
            33     HN     34     HN        1.8     4.5
            33     HN     34     QB        1.8     5.5
            33     HN     34    HD2        2.5     5.5
            33     HN    203    QMC        1.8       6
            34     HA     34    1HB        1.8     4.5
            34     HA     34    HD1        1.8     3.5
            34     HA     34    HD2        2.5     5.5
            34     HA     35     HN          2       3
            34     HA     35    HD2        2.5     5.5
            34     HA     42     HN          3     5.5
            34     HA     43     QD        1.8     6.1
            34     HA    202    HHC        2.5     5.5
            34     HA    202    QBB        1.8     4.3
            34    2HB     34     HN        1.8     3.5
            34    2HB     34    HD1        1.8     3.5
            34    2HB     34    HD2        1.8     4.5
            34    2HB     41     QB        1.8     5.5
            34    2HB     41    1HB        2.5     5.5
            34    2HB     43     HA        1.8     4.5
            34    2HB     43     QD        1.8     5.5
            34    2HB     43     QE        1.8     5.5
            34    2HB     43     HN        2.5     5.5
            34    1HB     34     HN        1.8     3.5
            34    1HB     34    HD1        1.8     4.5
            34    1HB     41    1HB        1.8     4.5
            34    1HB     43     HA        2.5     5.5
            34    1HB     43     QD        1.8     5.5
            34    1HB     43     QE        1.8     5.5
            34    1HB     44     HN        2.5     5.5
            34    HD1     42    2HB        1.8     4.5
            34    HD1     43     HA        1.8     4.5
            34    HD1     43     QB        2.5     7.2
            34    HD1     43     QD        1.8     5.5
            34    HD1     44     HN        1.8       3
            34    HD1     46     HN        2.5     5.5
            34    HD1    201    QMD        2.5     7.8
            34    HD1    202    HHC        1.8     4.5
            34    HD1    202    QBB        1.8     4.3
            34    HD1    202    QMC        2.5     7.8
            34    HD1    202    HAB        2.5     5.5
            34    HD2     41     QB        2.5     7.2
            34    HD2     43     HA        1.8     4.5
            34    HD2     43     QB        2.5     7.2
            34    HD2     43     QD        1.8     5.5
            34    HD2     43     QE        1.8     5.5
            34    HD2    201    HAB        2.5     5.5
            34    HD2    201    HHC        1.8     4.5
            34    HD2    201    QMC        2.5     7.8
            34    HD2    201    QBB        2.5     7.8
            34    HD2    201    HHD        2.5     5.5
            34    HD2    202    QBB        1.8       6
            34    HE1     44     HA        1.8     4.5
            34    HE1     46     HN        1.8     4.5
            34    HE1    201    HHA        1.8     4.5
            34    HE1    202    HAB        1.8     4.5
            34    HE1    202    HHC        2.5     5.5
            34    HE1    202    QBB        1.8     4.3
            34     HN     35     HN        1.8     4.5
            34     HN     41     QB        2.5       7
            34     HN    201    QMC        2.5     7.2
            34     HN    202    QBB        2.5     7.8
            35     HA     35    HD1        1.8     4.5
            35     HA     35    HD2        1.8     4.5
            35     HA     36     HA        1.8     4.5
            35     HA     36     QD        1.8       4
            35     HA     41     HA        1.8     4.5
            35     HA     76     QE        1.8     5.5
            35     QB     35     HN        1.8       4
            35     QB     36     HA        1.8     5.5
            35    2HB     35    HD1        1.8     3.5
            35    2HB     35    HD2        1.8     4.5
            35    2HB     36     QD        1.8     5.5
            35    2HB     76     HA        2.5     5.5
            35    2HB     76    2HB        2.5     5.5
            35    2HB     76     QD        1.8     5.5
            35    2HB     76     QE        1.8     5.5
            35    2HB     76     HZ        2.5     5.5
            35    1HB     35    HD2        1.8     4.5
            35    1HB     35    HD1        1.8     3.5
            35    1HB     36     QD        1.8     5.5
            35    1HB     36    1HD        1.8     4.5
            35    1HB     76    2HB        2.5     5.5
            35    1HB     76    1HB        2.5     5.5
            35    1HB     76     QD        2.5     7.2
            35    1HB     76     QE        1.8     5.5
            35    HD1     35    HD2        1.8     4.5
            35    HD1     36     HA        2.5     5.5
            35    HD1     36    2HD        2.5     5.5
            35    HD1     36    1HD        1.8     4.5
            35    HD1     37     HN        1.8     4.5
            35    HD1     37     HB        1.8     4.5
            35    HD1     37    QG2        1.8     4.3
            35    HD1     76     QE        1.8       6
            35    HD1     76     HZ        1.8     4.5
            35    HD2     35     HN        1.8     3.5
            35    HD2     76    2HB        1.8     4.5
            35    HD2     76    1HB        1.8     4.5
            35    HD2     76     QD        1.8     5.5
            35    HD2     76     QE        1.8     5.5
            35    HD2    202    HHB        1.8     4.5
            35    HD2    202    QMB        2.5     7.8
            35    HE1     35    HD1        1.8       3
            35    HE1     76     QE        2.5     5.5
            35    HE1    202    HHD        1.8     4.3
            35    HE1    202    QBD        1.8       4
            35    HE1    202    QMC        2.5     7.8
            36     HA     36     QD        2.5     7.2
            36     HA     40     HA        1.8     4.5
            36     HA     40     QB        2.5     7.2
            36     HA     41     HA        1.8     3.5
            36     HA     41     QB        1.8       4
            36     HA     41    1HB        1.8     4.5
            36     HA     41     QG        1.8     5.5
            36     HA     42     HN        2.5     5.5
            36     HA     76     QE        2.5     7.2
            36     QB     36     HA        1.8       4
            36     QB     36     QD        1.8     6.1
            36     QB     36    1HD        1.8     5.5
            36     QB     37     HN        1.8     5.5
            36     QB     39    1HA        1.8     5.5
            36     QB     39     HN        2.5     7.2
            36     QB     40     HN        1.8     5.5
            36     QB     76     HZ        2.5     7.2
            36     QG     36    2HD        1.8       4
            36     QD     76     QE        1.8     6.1
            36     QD     76     HZ        2.5     7.2
            36    1HD     37     HN        2.5     5.5
            36    1HD     76     QE        2.5     7.2
            37     HA     37    QG1        1.8     3.4
            37     HA     37    QG2        1.8     3.4
            37     HA     38     HA        2.5     5.5
            37     HA     38    1HB        1.8     4.5
            37     HA     38    QD2        2.5     7.2
            37     HA     38     HN        1.8       3
            37     HA     76     QE        2.5     7.2
            37     HA    202    QMD        1.8       6
            37     HB     37     HA        1.8       3
            37     HB     37     HN        1.8     3.5
            37     HB     37    QG1        1.8     3.4
            37     HB     37    QG2        1.8     3.4
            37     HB     38     HN        1.8     4.5
            37     HB     40     HN        2.5     5.5
            37     HB     42     HA        1.8     4.5
            37     HB     42     QB        1.8     4.3
            37     HB    202    HHD        2.5     5.5
            37    QG1     38     HA        1.8       6
            37    QG1     38    1HB        1.8       6
            37    QG1     38    QD2        1.8     6.6
            37    QG1     38     HN        1.8       6
            37    QG1     40     HN        2.5     7.8
            37    QG1    202    HHD        1.8     4.3
            37    QG1    202    HAC        1.8       6
            37    QG1    202    QBC        1.8     4.8
            37    QG2     40     HN        2.5     7.8
            37    QG2     76     QE        1.8     6.6
            37    QG2     76     HZ        2.5     7.8
            37    QG2    202    HAC        1.8       6
            37    QG2    202    HHD        1.8     4.3
            37    QG2    202    QBC        1.8       7
            37    QG2    202    QBD        2.5     8.6
            37    QG2    202    QMC        1.8       7
            37    QG2    202    QMD        1.8     4.8
            37     HN     38     HN        2.5     5.5
            37     HN     40     HN        1.8     3.5
            37     HN     40     QB        2.5     7.2
            37     HN     41     HA        1.8     3.5
            37     HN     42     HN        1.8     4.5
            38     HA     38    2HB        1.8       3
            38     HA     38    1HB        1.8       3
            38     HA     39     HN        1.8     3.5
            38     HA     39    1HA        2.5     5.5
            38     HA     40     HN          3     5.5
            38    2HB     38    QD2        1.8     3.5
            38    2HB     38     HN        1.8     3.5
            38    2HB     40     HN          3     5.5
            38    1HB     38    QD2        1.8     4.5
            38    1HB     38     HN        1.8     4.5
            38    1HB     40     HN        1.8       4
            38    1HB     40     QG        1.8     5.5
            38    QD2     40     QG        2.5     7.9
            38     HN     39     HN          3     5.5
            39    2HA     40     HN        1.8     4.5
            39    1HA     40     HN        2.5     5.5
            39     HN     40     HN        1.8     3.5
            40     HA     40     QB        1.8     3.2
            40     HA     40     QG        1.8     5.5
            40     HA     41     HN        1.8       3
            40     QB     41     HN        1.8     5.5
            40     QG     40     QE        1.8     4.3
            40     HN     41     HN        1.8     4.5
            40     HN     41     HA          3     5.5
            41     HA     41    2HB        1.8     3.2
            41     HA     41    1HB        1.8     3.2
            41     HA     41    2HG        1.8     4.5
            41     HA     41    1HG        1.8       3
            41     HA     42     HN        1.8       3
            41     QB     41     HN        1.8       4
            41     QB     42     HN        1.8       4
            41     QB     43     QE        1.8     6.1
            41    2HB     43     HA        1.8     4.5
            41    2HB     43     QD        1.8     5.5
            41    1HB     41    1HG        1.8       3
            41    1HB     42     HA        2.5     5.5
            41     QG     41     HN        1.8     3.2
            41     QG     43     QE        2.5     7.2
            41     HN     42     HN        2.5     5.5
            42     HA     42    2HB        1.8       3
            42     HA     42    1HB        1.8       3
            42     HA     43     QD        1.8     5.5
            42     HA     43     QE        2.5     7.2
            42     HA     43     HN        1.8       3
            42     HN     43     HA          3     5.5
            42     QB     42     HN        1.8       4
            42     QB     43     HN        1.8       4
            42    1HB    202    HAC        2.5     5.5
            43     HA     43     QD        1.8       4
            43     HA     43     HN        1.8       3
            43     HA     44     HN        1.8       3
            43     HA     44     HA        2.5     5.5
            43     HA    201    HHB        2.5     5.5
            43     QB     43     QD        1.8     6.1
            43     QB     43     QE        2.5     7.9
            43     QB     43     HN        1.8       4
            43     QB     44     HN        1.8     5.5
            43     QB     44     QG        1.8     6.1
            43     QB    201    HHB        1.8     5.5
            43     QB    201    QMA        1.8     6.6
            43     QD     43     HN        1.8       4
            43     QD     44     HN        2.5     7.2
            43     QD    201    HHB        1.8     5.5
            43     QD    201    QMA        2.5     8.6
            43     QD    201    QMB        1.8     6.6
            43     QE    201    HHB        2.5     7.2
            43     QE    201    QMB        1.8     6.6
            43     HN     44     HN        1.8     4.5
            44     HA     44    2HG        1.8       4
            44     HA     44    1HG        1.8       4
            44     HA     45     HN        1.8     3.5
            44     HA    201    HHA        1.8     4.5
            44     HA    201    QAA        1.8     5.5
            44     HA    201    QBA        1.8     5.5
            44     HA    202    QMC        2.5     7.8
            44     QB     44     QG        1.8     3.4
            44     QB     44    QE2        1.8     3.4
            44     QB     45     HA        2.5     7.2
            44     QB     45     HN        1.8       4
            44     QB     48     HN        2.5       7
            44     QB    201   1HBA        1.8       4
            44    QE2     45     HN        2.5     7.8
            44    QE2     48    QG2        1.8     6.6
            44    QE2    202    QMC        2.5     8.6
            44     QG     44     HN        1.8       4
            44     QG     44    QE2        1.8     6.1
            44     QG    201   1HBA        1.8     5.5
            44    2HG    202    QMC        1.8     4.3
            44    1HG    202    QMC        1.8     4.3
            44     HN     44    QE2        2.5     7.2
            44     HN     45     HN        1.8     4.5
            44     HN    202    QMC        2.5     7.8
            44     HN    202    QBB        2.5     7.8
            45     HA     45     QB        1.8     3.2
            45     HA     45     QG        1.8       4
            45     HA     45     QD        1.8     5.5
            45     HA     46     HN        1.8       3
            45     HA     47     QB        2.5     7.8
            45     HA     48     HN        2.5     5.5
            45     HA    201    HHA        1.8     3.5
            45     HA    201    QAA        1.8     5.5
            45     HA    201   2HAD        1.8     3.2
            45     HA    201   1HAD        1.8     3.2
            45     HA    201    QBA        2.5       7
            45     HA    201    QBD        1.8     5.5
            45     QB     45     QG        1.8     3.4
            45     QB     45     QE        1.8     6.1
            45     QB     46     HN        1.8       4
            45     QB     48     HA        2.5     7.2
            45     QB     48     HN        1.8     4.3
            45     QB    201    QBD        2.5     7.9
            45     QB    201    QAA        1.8       6
            45    2HB     47     HN        1.8     4.5
            45    2HB    201    HHA        1.8     4.5
            45    2HB    201   1HBA        2.5     5.5
            45    1HB     47     HN        1.8     4.5
            45    1HB    201    HHA        1.8     4.5
            45    1HB    201   1HBA        2.5     5.5
            45     QG     46     HN        2.5     7.2
            45     QG     48    QG2        2.5     8.6
            45     QG    201    HHA        2.5     7.2
            45     QG    201    QBD        2.5     8.6
            45     QG    201    QAA        1.8       6
            45     QD    201    HHA        2.5     7.2
            45     QE     45     HN        1.8     5.5
            45     HN     46     HN        2.5     5.5
            45     HN    201    QAA        1.8     5.5
            45     HN    201    QBA        1.8     5.5
            45     HN    201   2HAD        2.5     5.5
            45     HN    202    QMC        2.5     7.8
            46     HA     47     HN        1.8     3.5
            46     HA     47     HA        2.5     5.5
            46     HA     52    HD2        1.8     4.5
            46     HA     69     QE        1.8       6
            46     HA    202    QMC        1.8     4.3
            46     HA    202    QBB        1.8     4.3
            46     HA    202    QBC        2.5     7.8
            46     QB    202    QMB        1.8     6.5
            46    2HB     47     HN        1.8     3.5
            46    2HB     52    HD2        1.8     4.5
            46    2HB     52    2HB        2.5     5.5
            46    2HB     52    1HB        1.8     4.5
            46    2HB     65     QE        1.8       4
            46    2HB     69     QE        1.8     4.3
            46    2HB    202    HHC        2.5     5.5
            46    2HB    202    QBB        1.8       6
            46    1HB     47     HN        2.5     5.5
            46    1HB     52    1HB        1.8     4.5
            46    1HB     52    HD2        1.8     4.5
            46    1HB     65     QD        2.5     7.2
            46    1HB     65     QE        2.5     7.2
            46    1HB     69     QE        1.8       6
            46    1HB    202    HHC        1.8     4.5
            46    1HB    202    QMC        2.5     7.8
            46     HN     47     HN        1.8     3.5
            46     HN     48     HN        2.5     5.5
            46     HN    201    QBD        1.8     5.5
            46     HN    201   1HAD        1.8     4.5
            46     HN    201    QMD        2.5     7.8
            46     HN    201    HHA        2.5     5.5
            46     HN    202    QMC        2.5     7.8
            46     HN    202    QBB        1.8       6
            47     HA     47     HN        1.8       3
            47     HA     48     HN        1.8     3.5
            47     HA     51    2HB        1.8     4.5
            47     HA     52     HN        1.8     3.5
            47     HA     52     HA        1.8     4.5
            47     HA     52    1HB        1.8     4.5
            47     HA     52    HD2        1.8     4.5
            47     HA     53     HA          2       5
            47     HA     65     QD        1.8     5.5
            47     HA     65     QE        1.8     5.5
            47     QB     47     HN        1.8     3.4
            47     QB     48     HN        1.8     4.3
            47     QB     51    2HB        1.8       6
            47     QB     52     HN        2.5     7.8
            47     QB     53     HA        1.8     4.3
            47     QB     53    2HB        2.5     7.8
            47     QB     53    1HB        2.5     7.8
            47     QB     65    1HB        2.5     7.8
            47     QB     65     QD        1.8     4.6
            47     QB     65     QE        1.8     3.6
            47     HN     48     HN        1.8     3.5
            47     HN     48     HA        2.5     5.5
            47     HN     69     QE        2.5     7.8
            48     HA     48     HB        1.8       3
            48     HA     48    QG2        1.8     3.4
            48     HA     48     HN        1.8       3
            48     HA     49     HA        1.8     4.5
            48     HA     49     QB        1.8       6
            48     HA     49     HN        1.8       3
            48     HA     50     HN        1.8     4.5
            48     HA     51    2HB        1.8     4.5
            48     HB     48     HN        1.8       3
            48     HB     48    QG2        1.8     3.4
            48     HB     49     HN        1.8     4.5
            48     HB     49     QB        2.5     7.8
            48     HB     50     HN        1.8     4.5
            48     HB    202    QMC        1.8       6
            48    QG2     48     HN        1.8     4.3
            48    QG2     51     HN        1.8       6
            48    QG2    202    QMC        1.8     6.1
            48     HN     49     HN        1.8     4.5
            48     HN     51     QB        1.8       4
            48     HN     52     HN        1.8     4.5
            48     HN     52    1HB          3     5.5
            48     HN     52    HD2        2.5     5.5
            48     HN     53     QB        2.5       7
            49     HA     49     HN        1.8       3
            49     HA     49     QB        1.8     3.4
            49     HA     50     HN        1.8     3.5
            49     HA     51     HN        1.8     4.5
            49     HA     53     QB        1.8       4
            49     QB     50     HN        1.8     4.3
            49     QB     51     HN        1.8       6
            49     HN     50     HN        1.8     4.5
            49     HN     50    2HA        2.5     5.5
            49     HN     53     QB        2.5       7
            50     QA     50     HN        1.8       3
            50     QA     51     QB        2.5       7
            50    2HA     51     HN        1.8     3.5
            50    1HA     51     HA        2.5     5.5
            50    1HA     51     HN        1.8     4.5
            50     HN     51     HN        1.8       3
            50     HN     51    2HB        1.8     4.5
            50     HN     53     QB        1.8     5.5
            51     HA     51     HN        1.8       3
            51     HA     51    2HB        1.8       3
            51     HA     51    1HB        1.8       3
            51     HA     52     HN        1.8     3.5
            51     HA     63     HA        1.8     4.5
            51     HA    202    HAC        1.8       3
            51     HA    202    HHD        1.8     4.5
            51     QB     52    HD2        1.8     5.5
            51     QB    202    QBC        1.8       7
            51    2HB     51     HN        1.8       3
            51    2HB     52     HN        1.8       3
            51    2HB     53     HN        2.5     5.5
            51    2HB    202    HAC        1.8     4.5
            51    2HB    202    HHD        2.5     5.5
            51    1HB     51     HN        1.8     3.5
            51    1HB     52     HN        1.8       3
            51    1HB    202    HAC        1.8     4.5
            51     HN     52     HN        1.8       4
            51     HN     53     HN        1.8     4.5
            51     HN     53     QB        1.8       4
            52     HA     53     HN        1.8       3
            52     HA     54     HN        1.8     4.5
            52     HA     65     QD        1.8     5.5
            52     HA     65     HN          3     5.5
            52     QB     65     QD        1.8     6.1
            52     QB     65     HN        1.8     5.5
            52    2HB     52     HN        1.8     3.5
            52    2HB     52    HD1        1.8     4.5
            52    2HB     53     HA        1.8     5.5
            52    2HB     53     HN        1.8     4.5
            52    2HB     65     HA        1.8     3.5
            52    2HB     65     QE        2.5     7.2
            52    2HB     68     QB        2.5     7.8
            52    1HB     52     HN        1.8     4.5
            52    1HB     52    HD1        1.8     3.5
            52    1HB     52    HD2        1.8       3
            52    1HB     53     HN        2.5     5.5
            52    1HB     65     HA        1.8     3.5
            52    1HB     65     QD        1.8     5.5
            52    1HB     65     QE        1.8     5.5
            52    1HB     68     QB        1.8       6
            52    HD1     52    HD2          3     5.5
            52    HD1     62     HA        2.5     5.5
            52    HD1     63     HA        1.8       3
            52    HD1     68     QB        1.8       6
            52    HD1     68     HN        1.8     4.5
            52    HD1     69     QG        2.5     7.8
            52    HD1     69     QE        2.5     7.8
            52    HD2     52     HN        1.8     4.5
            52    HD2     65     QD        2.5     7.2
            52    HD2     68     QB        2.5     7.8
            52    HD2    202    HAB        2.5     5.5
            52    HD2    202    HHB        2.5     5.5
            52    HD2    202    HHC        1.8     4.5
            52    HD2    202    QMC        1.8       6
            52    HE1     62     HA        1.8       3
            52    HE1     62     QB        1.8     4.3
            52    HE1     62     HN        2.5     5.5
            52    HE1     67    HD2        1.8     4.5
            52    HE1     68     QB        1.8     4.3
            52    HE1    202    HHA        1.8     4.5
            52    HE1    202    HHB        2.5     5.5
            52    HE1    202   1HBA        1.8     4.5
            52    HE1    202    QMA        2.5     5.5
            52     HN     53     HN        1.8     4.5
            52     HN    202    HAC        2.5     5.5
            53     HA     53    2HB        1.8       3
            53     HA     53    1HB        1.8       3
            53     HA     54     HA        2.5     5.5
            53     HA     54     HN        1.8     4.5
            53     HA     55     QG        1.8     5.5
            53     HA     65     HN        2.5     5.5
            53     HA     65     QB        1.8       6
            53     HA     65     HA        2.5     5.5
            53     QB     54     HN        1.8     5.5
            53     QB     55     HN        2.5       7
            53    2HB     53     HN        1.8     4.5
            53    1HB     53     HN        1.8     4.5
            53     HN     54     HN        1.8     3.5
            53     HN     54    1HB        2.5     5.5
            53     HN     65     QB          2     6.2
            53     HN     65     HN        2.5     5.5
            54     HA     54    2HB        1.8       3
            54     HA     54    1HB        1.8       3
            54     HA     55     HN        1.8       3
            54    2HB     54     HN        1.8     3.5
            54    2HB     54    QD2        1.8     3.5
            54    2HB     63     QB        1.8     5.5
            54    2HB     64    1HA        1.8       3
            54    2HB     64     HN        2.5     5.5
            54    1HB     54     HN        1.8     3.5
            54    1HB     54    QD2        1.8     3.5
            54    1HB     56     HN        2.5     5.5
            54    1HB     57     HN        2.5     5.5
            54    1HB     59     HN        2.5     5.5
            54    1HB     63     QB        1.8     5.5
            54    1HB     64    2HA        1.8     4.5
            54    1HB     64    1HA        1.8     4.5
            54    1HB     65     HN        2.5     5.5
            54    QD2     56     HN        1.8     4.5
            54    QD2     56     QB        1.8       4
            54    QD2     59     HN        1.8     5.5
            54    QD2     59    2HB        1.8     5.5
            54    QD2     59    1HB        1.8     5.5
            54    QD2     63     QB        1.8       6
            54    QD2     64    1HA        2.5     5.5
            54    QD2     64    2HA        2.5     5.5
            54    QD2     65     HN        2.5     7.2
            54     HN     55     HN        2.5     5.5
            54     HN     63     QB        2.5     7.2
            54     HN     64    2HA        1.8     4.5
            54     HN     65     HN        1.8     4.5
            55     HA     55     HN        1.8       3
            55     HA     55    2HB        1.8     3.4
            55     HA     55    1HB        1.8     3.4
            55     HA     55     QG        1.8     3.4
            55     HA     56     HA        2.5     5.5
            55     HA     65    2HB        1.8     4.5
            55     HA     65    1HB        1.8     4.5
            55     HA     65     QD        2.5     7.2
            55     QB     55     QG        1.8     3.4
            55    2HB     55     HN        1.8     3.5
            55    1HB     55     HN        1.8     3.5
            55    1HB     56     HN        1.8     4.5
            55     QE     65     QD        1.8       6
            55     HN     56     HN        1.8     4.5
            55     HN     56     HA          3     5.5
            56     HA     56    1HB        1.8       3
            56     HA     57     HN        1.8     3.5
            56     HA     57     QB        1.8     5.5
            56     HA     58     QG        2.5     7.2
            56     QB     59     HN        1.8       4
            56    2HB     56     HN        1.8       3
            56    2HB     57     HN        1.8     4.5
            56    2HB     58     QB        1.8     5.5
            56    2HB     59    2HB        2.5     5.5
            56    2HB     59    1HB        2.5     5.5
            56    1HB     56     HN        1.8       3
            56    1HB     57     HN        2.5     5.5
            56    1HB     58     HN        2.5     5.5
            56     HN     59    1HB        2.5     5.5
            57     HA     57     QB        1.8       3
            57     HA     57     QG        1.8       4
            57     HA     65     HN        2.5     5.5
            57     HA     66     QD        1.8     5.5
            57     HA     66     HN        1.8     4.5
            57     HA     66     QB        1.8       4
            57     HA     66     QE          2     5.8
            57     HA    204    QMA        1.8       6
            57     HA    204   1HBA        1.8     4.5
            57     QB     57     QG        1.8     3.4
            57     QB     58     HN        1.8     5.5
            57     QB     66     QB        1.8     6.1
            57     QB     66     QD        1.8     6.1
            57     QB    204   2HBA        1.8       4
            57    2HB    204   1HBA        1.8       4
            57    1HB     57     HN        1.8     3.5
            57    1HB    204   1HBA        1.8     4.5
            57     QG     57     HN        1.8     5.5
            57     QG     58     HN        1.8     5.5
            57     QG     59     HN        2.5     7.2
            57     QG     65     HN        2.5     7.2
            57     QG     66     QD        2.5     7.9
            57     HN     58     HN        1.8       3
            57     HN     65    1HB        2.5     5.5
            58     HA     58    2HB        1.8     3.2
            58     HA     58    1HB        1.8     3.2
            58     HA     59     HN        1.8     3.5
            58     HA     60     HN        2.5     5.5
            58     QB     58     HN        1.8     3.2
            58     QB     59     HN        1.8       4
            58     QG     58     HN        1.8     3.2
            58     QG     59     HN        1.8     5.5
            58     HN     59     HN        1.8       3
            59     HA     60     HN        1.8     3.5
            59     HA     60    1HB        2.5     5.5
            59     HA     61     HN        1.8     4.5
            59    2HB     59     HN        1.8       3
            59    2HB     64    1HA        1.8     4.5
            59    2HB     64     HN        1.8     4.5
            59    1HB     59     HN        1.8       3
            59    1HB     60     HN        2.5     5.5
            59    1HB     63     QB        1.8     5.5
            59    1HB     64    2HA        1.8     4.5
            59     HN     64    2HA        1.8     4.5
            59     HN     64    1HA        2.5     5.5
            60     HA     60    2HB        1.8       3
            60     HA     60    1HB        1.8       3
            60     HA     60     QG        1.8     3.2
            60     HA     60     QD        1.8     3.2
            60     HA     61     HN        1.8     4.5
            60     HA     67    HE1        1.8     4.5
            60     HA     67    1HB        1.8     4.5
            60     QB     60     HN        1.8       4
            60     QB     67    HE1        1.8     5.5
            60    2HB     61     HA        1.8     4.5
            60     QG     60     HN        1.8       4
            60     QG     67    HE1        1.8     5.5
            60     QD     67    2HB        1.8     5.5
            60     QD     67    1HB        1.8     5.5
            60     QD     67    HE1        1.8     5.5
            60     QE     67    HE1        1.8     5.5
            60     HN     61     HN        1.8       3
            61     HA     61    2HB        1.8       3
            61     HA     61    1HB        1.8       3
            61     HA     62     HN        1.8     3.5
            61     HA     63     HN        2.5     5.5
            61     HA     67    HD2          3     5.5
            61     QB     62     HN        1.8       4
            61    2HB     61     HN        1.8     3.5
            61    2HB     62     HA        1.8     4.5
            61    2HB     63     HN        1.8     4.5
            61    2HB     63     QB        1.8       4
            61    1HB     61     HN        1.8     3.5
            61     HN     62     HN        1.8     4.5
            61     HN     64     HN        2.5     5.5
            62     HA     62     QB        1.8     3.4
            62     HA     63     HN        1.8     4.5
            62     HA     63     HA        2.5     5.5
            62     HA     67    HD2        1.8       3
            62     HA     68     QB        2.5     7.8
            62     HA     75     HN        2.5     5.5
            62     HA    202   2HAD        1.8     4.5
            62     HA    202   2HBA        1.8     3.5
            62     QB     62     HN        1.8     3.2
            62     QB     63     HN        1.8     4.3
            62     QB     67    HD2        1.8     5.5
            62     QB     76     QE        2.5     8.6
            62     QB    202    HHA        1.8     4.3
            62     QB    202   2HAD        1.8     4.3
            62     QB    202   1HAD        1.8     4.3
            62     QB    202   2HBA        1.8       6
            62     QB    202   1HBA        1.8       6
            62     QB    202    QMD        1.8     4.8
            62     HN     63     HN        1.8     3.5
            62     HN     64     HN          3     5.5
            63     HA     63     QB        1.8     3.2
            63     HA     63     QG        1.8       4
            63     HA     63     QD        1.8       4
            63     HA     64     HN        1.8     4.5
            63    2HB     63     HN        1.8       3
            63    2HB     64     HN        1.8     4.5
            63    1HB     63     HN        1.8       3
            63    1HB     64     HN        1.8     4.5
            63     HN     64     HN        1.8       3
            63     HN     64    1HA        2.5     5.5
            63     HN     67    HD2        2.5     5.5
            64     QA     65     HN        1.8     3.2
            64     QA     67     HN        1.8     5.5
            64    2HA     66     HN        2.5     5.5
            64     HN     65     HN        1.8     4.5
            64     HN     67    1HB          3     5.5
            64     HN     68     HN        1.8     4.5
            65     HA     65     QD        1.8     3.2
            65     HA     65     QE        1.8     5.5
            65     HA     65     HN        1.8       3
            65     HA     66     HN        1.8     4.5
            65     HA     67     HN        2.5     5.5
            65     HA     68     HN        2.5     5.5
            65     HA     68     QB        1.8       6
            65     HA     69     QE        1.8       6
            65     QB     66     HN        1.8     3.2
            65     QB     67     HN        1.8     5.5
            65    2HB     65     QD        1.8       4
            65    2HB     65     HN        1.8       3
            65    1HB     65     QD        1.8       4
            65    1HB     65     HN        1.8     3.5
            65     QD     65     HN        1.8     5.5
            65     QD     66     HN        1.8     5.5
            65     QD     69    2HG        1.8     6.1
            65     QD     69     QE        1.8     6.6
            65     QD    204    HHA        2.5     7.2
            65     QD    204   1HAD        1.8     5.5
            65     QE     68     QB        2.5     8.6
            65     QE    201    QMD        2.5     8.6
            65     QE    203    QBB        2.5     8.6
            65     QE    204    HHA        1.8     5.5
            65     QE    204   1HAD        1.8       4
            65     QE    204    QAD        1.8     4.3
            65     QE    204   2HBD        2.5     7.2
            65     QE    204   1HBD        2.5     7.2
            65     QE    204    QMD        1.8     6.6
            65     HN     66     HN        1.8     3.5
            65     HN     67     HN        2.5       5
            66     HA     66     QD        1.8       4
            66     HA     67     HN        2.5     5.5
            66     HA     68     HN        2.5     5.5
            66     HA     69    1HB        2.5     5.5
            66     HA     69    2HG        1.8     4.5
            66     HA     69     QE        2.5     7.8
            66     HA     70    HE1        1.8     4.5
            66     QB     66     QD        1.8     3.4
            66     QB     66     HN        1.8       4
            66     QB     67     HN        1.8     3.7
            66     QB     70     HN        2.5     7.2
            66     QB     70    HE1        2.5     7.2
            66     QD     66     HN        1.8       4
            66     QD     67     HN        1.8     5.5
            66     QD     67     HA        1.8     5.5
            66     QD     67    1HB        2.5     7.2
            66     QD     70    HD1        1.8       4
            66     QD     70    HE1        1.8       4
            66     QD     70    1HB        1.8     5.5
            66     QD     70    2HB        2.5     7.2
            66     QD    204    HHA        2.5     7.2
            66     QD    204    HHB        2.5     7.2
            66     QD    204    QMA        2.5     7.2
            66     QD    204   2HAA        2.5     7.2
            66     QD    204   1HAA        2.5     7.2
            66     QD    204   2HBA        1.8       4
            66     QD    204   1HBA        1.8       4
            66     QE     70    1HB        2.5     7.2
            66     QE     70    HD1        1.8     5.5
            66     QE     70    HE1        1.8     4.5
            66     QE    204    HHB        1.8       4
            66     HN     67     HN        1.8     3.5
            66     HN     69    2HG        2.5     5.5
            66     HN    204   1HBA        2.5     5.2
            67     HA     67     HN        1.8       3
            67     HA     67    2HB        1.8       3
            67     HA     68     HN        1.8     4.5
            67     HA     70    2HB        2.5     5.5
            67     HA     71     HN        2.5     5.5
            67     HA     71    2HB        1.8     4.5
            67     QB     68     QB        2.5     7.9
            67    2HB     67    HD2        1.8     3.5
            67    2HB     67    HE1        2.5     5.5
            67    2HB     67     HN        1.8     3.5
            67    1HB     67    HD2        1.8     4.5
            67    1HB     67     HN        1.8     3.5
            67    1HB     67    HE1        2.5     5.5
            67    1HB     68     HN        1.8     4.5
            67    1HB     74    QG2        2.5     7.8
            67    HD2     68     HA        1.8     3.5
            67    HD2     68     QB        1.8     4.3
            67    HD2     74    QG2        2.5     7.8
            67    HD2    202   2HAA        2.5     5.5
            67    HD2    202   2HBA        1.8     4.5
            67    HD2    202   1HBA        1.8     3.5
            67    HE1     71    2HB        1.8     4.5
            67    HE1     71    1HB        1.8     4.5
            67    HE1     71     HA        2.5     5.5
            67    HE1     71     HN        2.5     5.5
            67    HE1     74     HA        1.8     4.5
            67    HE1     74     HB        2.5     5.5
            67    HE1     74    QG2        1.8     4.3
            67    HE1    202   1HBA        2.5     5.5
            67     HN     68     HN        1.8     3.5
            67     HN     69     HN        2.5     5.5
            68     HA     69     HN        2.5     5.5
            68     HA     71     HN        2.5     5.5
            68     HA     71    2HB        1.8     4.5
            68     HA     71    1HB        1.8     4.5
            68     HA     74    QG2        1.8       6
            68     HA     78     HA        2.5     5.5
            68     HA     78     QB        1.8       4
            68     HA    202   2HAA        1.8     4.5
            68     HA    202   1HAA        1.8     4.5
            68     HA    202    HHB        1.8     4.5
            68     QB     69     HA        1.8       6
            68     QB     69     QE        1.8     4.8
            68     QB     74    QG2        2.5       9
            68     QB     78     HA        1.8       6
            68     QB    202    HHB        1.8     4.3
            68     QB    202    QMA        1.8     4.6
            68     QB    202    QMB        1.8     5.1
            68     HN     69     HN        1.8     3.5
            69     HA     69    2HB        1.8       3
            69     HA     69    1HB        1.8       3
            69     HA     70     HA          2     4.5
            69     HA     70     HN        1.8     4.5
            69     HA     70    HD1        2.5     5.5
            69     HA     71     HN        1.8     4.5
            69     HA     78     HA        2.5     5.5
            69     HA     78     QB        1.8       4
            69     HA     79     HA        1.8       5
            69     HA     79     QB        1.8       4
            69     HA     79     HN        1.8       3
            69     HA     80     HN        1.8     3.5
            69     HA    202    QMB        1.8       6
            69     HA    203    HAB        2.5     5.5
            69     HA    204    QBC        1.8       6
            69     QB    204    QBC        1.8       7
            69    2HB     69     HN        1.8     3.5
            69    2HB     70     HA        2.5     5.5
            69    2HB     70     HN        2.5     5.5
            69    2HB     71     HN        2.5     5.5
            69    2HB     80    QG2        1.8       6
            69    2HB    204    HHD        2.5     5.5
            69    2HB    204    QMD        1.8       6
            69    1HB     69    1HG        1.8     3.5
            69    1HB     69     QE        1.8       6
            69    1HB     69     HN        1.8     3.5
            69    1HB     70    1HB        1.8     4.5
            69    1HB     70     HN        2.5     5.5
            69    1HB     80    QG1        2.5     7.8
            69    1HB    204    QMD        1.8       6
            69    2HG     69     HN        1.8       3
            69    2HG     70     HN        2.5     5.5
            69    2HG     70    HD1          3     5.5
            69    2HG    204   1HAD        1.8     4.5
            69    1HG     69     HN        1.8     3.5
            69    1HG     70     HN        2.5     5.5
            69    1HG     79    2HB        2.5     5.5
            69    1HG    204    QMD        1.8       6
            69     QE     69     HA        1.8       6
            69     QE     69     HN        2.5     7.8
            69     QE     79     HN        2.5     7.8
            69     QE    202    HAB        1.8       6
            69     QE    202    HHB        1.8       6
            69     QE    202    QMB        1.8     3.7
            69     QE    203    QMB        2.5     7.8
            69     QE    203    HAB        1.8     4.6
            69     HN     70     HA        2.5     5.5
            69     HN     70     HN        2.5     5.5
            69     HN     70    HD1        1.8     4.5
            69     HN     71     HN        2.5     5.5
            69     HN    202    QMA        1.8       6
            70     HA     70    HD2        1.8     4.5
            70     HA     71     HN        1.8     3.5
            70     HA     78     QB        2.5     7.2
            70     HA     80     HN        1.8     3.5
            70     HA     80     HA        1.8     4.5
            70     HA     80     HB        1.8       3
            70     HA     80    QG1        1.8       6
            70     HA     80    QG2        1.8     3.4
            70     HA     81     HN        1.8     4.5
            70     QB     70    HD1        1.8       4
            70    2HB     70     HN        1.8     4.5
            70    2HB     70    HD2        1.8       3
            70    2HB     71     HA        2.5     5.5
            70    2HB     71     HN        1.8     4.5
            70    2HB     80    QG2        1.8     4.3
            70    2HB    204    QBB        2.5     7.8
            70    1HB     70     HN        1.8     3.5
            70    1HB     70    HD2        1.8     4.5
            70    1HB     71     HA        2.5     5.5
            70    1HB     71     HN        1.8     3.5
            70    1HB     80    QG2        1.8       6
            70    HD1     70    HD2        1.8     4.5
            70    HD1     71     HN        1.8     4.5
            70    HD2     70     HN        2.5     5.5
            70    HD2     80    QG1        1.8       6
            70    HD2     80     HN        2.5     5.5
            70    HD2     80    QG2        1.8     3.4
            70    HD2    100     HA        1.8     5.5
            70    HD2    106    HD2        2.5     5.5
            70    HD2    204    HHB        2.5     5.5
            70    HD2    204    HHC        1.8     4.5
            70    HD2    204    HAB        1.8     4.5
            70    HD2    204    QBB        1.8       6
            70    HD2    204    QBC        2.5     7.8
            70    HD2    204    QMB        2.5     5.5
            70    HE1    204    HHA        1.8     4.5
            70    HE1    204   1HAD        2.5     5.5
            70    HE1    204    QAA        2.5     7.2
            70     HN     70    HD1        1.8     4.5
            70     HN     71     HN        1.8     3.5
            70     HN     78     QB        1.8     5.5
            70     HN     80     HN          3     5.5
            70     HN     80    QG1        2.5     6.5
            70     HN     80    QG2        2.5     7.8
            71     QB     71     HN        1.8       4
            71    2HB     72     HN        1.8     4.5
            71    2HB     74    QG2        1.8     3.4
            71    2HB     80    QG1        2.5     7.8
            71    1HB     72     HN        2.5     5.5
            71    1HB     74     HB        2.5     5.5
            71    1HB     74    QG2        1.8       6
            71    1HB     74     HN          3     5.5
            71     HN     78     QB        2.5     7.2
            71     HN     80    QG2        2.5     7.8
            72     HA     72    2HB        1.8     3.2
            72     HA     72    1HB        1.8     3.2
            72     HA     73     HN        1.8     3.5
            72     HA     74     HN        1.8     4.5
            72     HA     74    QG2        1.8       6
            72     HA     78     HN        2.5     5.5
            72     HA     81     HN        2.5     5.5
            72     HA     81    2HA        1.8     3.5
            72     QB     72     HN        1.8       4
            72     QB     73     HN        1.8     5.5
            72     QB     78     HN        2.5     7.2
            72     QB     81    1HA        1.8     5.5
            72     QG     72     HN        1.8       4
            73     QA     74     HN        1.8     3.2
            73     HN     74     HN        2.5     5.5
            74     HA     74     HB        1.8       3
            74     HA     74    QG2        1.8     3.4
            74     HA     75     HN        1.8       3
            74     HA     76     HN        2.5     5.5
            74     HB     74     HN        1.8     4.5
            74     HB     74    QG2        1.8     3.4
            74     HB     75     HN        1.8     4.5
            74     HB     76     QD        2.5     7.2
            74     HB     76     HN        1.8     3.5
            74     HB    202    HHA        1.8     4.5
            74     HB    202    HHB        2.5     5.5
            74     HB    202   2HBA        1.8     4.5
            74     HB    202    QMA        1.8     4.3
            74     HB    202   1HBA        1.8     4.5
            74     HB    202   1HAA        1.8     3.5
            74     HB    202   2HAA        1.8       3
            74    QG2     74     HN        1.8       6
            74    QG2     78     HA        2.5     5.5
            74    QG2     78     QB        1.8     6.6
            74    QG2    202    HHB        1.8       6
            74    QG2    202   2HBA        1.8       6
            74    QG2    202   1HBA        1.8       6
            74    QG2    202    QMA        1.8     4.6
            74    QG2    202   1HAA        1.8       6
            74     HN     75     HN        2.5     5.5
            74     HN     78     QB        2.5     7.2
            74     HN    202   2HAA        1.8     4.5
            75     HA     75    2HB        1.8     3.2
            75     HA     75    1HB        1.8     3.2
            75     HA     75    1HE        2.5     7.8
            75     HA     75    2HE        2.5     7.8
            75     HA     75     QG        1.8     3.2
            75     HA     75    1HG        1.8     4.5
            75     HA     76     HN        1.8     4.5
            75     QB     76     QD        2.5     7.9
            75     QB     76     QE        1.8     6.1
            75     QB    202    HHA        1.8     5.5
            75     QB    202   2HAA        1.8     5.5
            75    2HB     75     QE        2.5     7.2
            75    2HB     75     HN        1.8     3.5
            75    2HB     76     HN        1.8     3.5
            75    2HB    202    HHA        2.5     5.5
            75    2HB    202   1HAA        1.8     4.5
            75    2HB    202   2HBA        1.8     4.5
            75    2HB    202   1HBA        2.5     5.5
            75    2HB    202    QBD        1.8     5.5
            75    1HB     75     HN        1.8     3.5
            75    1HB     76     HZ        2.5     5.5
            75    1HB     76     HN        1.8     3.5
            75    1HB    202   2HAD        1.8     4.5
            75    1HB    202   1HAD        1.8     3.5
            75    1HB    202   2HBA        1.8     4.5
            75     QG     75     HN        1.8       6
            75     QG     76     HA        1.8     5.5
            75     QG     76     QE        1.8     6.1
            75     QG    202    HHA        2.5       7
            75    2HG     75     QE        1.8     5.5
            75    2HG     76     HZ        2.5     5.5
            75    2HG     76     HN        1.8     4.5
            75    2HG    202   1HAD        1.8     4.5
            75    1HG     75     QE        1.8       4
            75    1HG     76     QD        2.5     7.2
            75    1HG     76     QE        2.5     7.2
            75    1HG     76     HZ        2.5     5.5
            75    1HG     76     HN        2.5     5.5
            75    1HG    202    QBD        2.5     7.2
            75     QD    202    HHA        1.8       6
            75     QE     76     HZ        1.8     5.5
            75     QE     76     QD        1.8     6.1
            75     QE     76     QE        1.8     6.1
            75     HN     76     HN        1.8     4.5
            75     HN    202    HHA        2.5     5.5
            75     HN    202   2HAA        1.8     4.5
            75     HN    202   1HAA        1.8     4.5
            75     HN    202   1HBA        2.5     5.5
            75     HN    202    QMA        1.8       6
            76     HA     76     HN        1.8       3
            76     HA     76    2HB        1.8       3
            76     HA     76    1HB        1.8       3
            76     HA     76     QD        1.8     3.2
            76     HA     77     HN        1.8     3.5
            76    2HB     76     QD        1.8       4
            76    2HB     76     QE        2.5     7.2
            76    2HB     76     HN        1.8       4
            76    2HB     77     HN        1.8     3.5
            76    2HB     78     HN        2.5     5.5
            76    2HB    202    HHB        2.5     5.5
            76    2HB    202    QMA        2.5     7.8
            76    1HB     76     QD        1.8       4
            76    1HB     76     QE        1.8     5.5
            76    1HB     76     HZ        2.5     5.7
            76    1HB     76     HN        1.8     3.5
            76    1HB     77     HN        1.8     3.5
            76    1HB    202    HHB        2.5     5.5
            76    1HB    202    QMA        1.8       6
            76     QD     76     HN        1.8     5.5
            76     QD     77     HN        1.8     5.5
            76     QD    202    HHA        1.8     5.5
            76     QD    202    QMA        2.5     8.6
            76     QD    202    QBD        1.8     6.1
            76     QD    202   2HAA        2.5     7.2
            76     QD    202   1HAA        2.5     7.2
            76     QE    202    HHA        1.8     5.5
            76     QE    202    QBD        1.8     4.6
            76     QE    202   2HAD        2.5     7.2
            76     QE    202   1HAD        2.5     7.2
            76     QE    202    QMD        2.5     8.6
            76     QE    202    QMA        2.5     8.6
            76     HN     77     HN        2.5     5.5
            76     HN    202    HHA        2.5     5.5
            76     HN    202   2HAA        2.5     5.5
            76     HN    202   1HAA        2.5     5.5
            76     HN    202    QMA        1.8       6
            76     HZ    202    QBD        1.8     5.5
            77     HA     77     QB        1.8     3.2
            77     HA     77    2HG        1.8       4
            77     HA     77    1HG        1.8       4
            77     HA     77     QD        1.8     5.5
            77     HA     78     HN        1.8       3
            77     HA     82     HN        1.8     4.5
            77     HA     82     QB        1.8     6.1
            77     QB     82    2HB        2.5     7.2
            77     QB     82    1HB        1.8     5.5
            77     QB     82     HN        1.8     5.5
            77     QB    203    QBC        1.8     6.6
            77     QB    203    QMC        1.8     4.6
            77    2HB     77     HN        1.8     3.5
            77    2HB     78     HN        1.8     4.5
            77    1HB     77     QE        1.8       4
            77    1HB     77     HN        1.8     3.5
            77    1HB     78     HN        1.8     3.5
            77    1HB     82    1HB        1.8     4.5
            77    2HG     77     HN        1.8     4.5
            77    2HG     78     HN        1.8     4.5
            77    1HG     77     HN        1.8     3.5
            77    1HG     78     HN        2.5     5.5
            77     QE     77     HN        1.8     5.5
            77     HN     78     HN        2.5     5.5
            77     HN    203    QBC        2.5     7.8
            77     HN    203    QMC        1.8       6
            78     HA     78    2HB        1.8     3.2
            78     HA     78    1HB        1.8     3.2
            78     HA     79     HN        1.8     3.5
            78     HA     79     HA        1.8     4.5
            78     HA     80     HN        2.5     5.5
            78     HA     81     HN        2.5     5.5
            78     HA    202    HHB        1.8     4.5
            78     HA    202    QMA        1.8     4.3
            78     HA    203    QMC        2.5     7.8
            78     QB     79     HN        1.8       4
            78     QB     81    2HA        1.8     5.5
            78     QB    202    HHB        2.5     7.2
            78     QB    202    QMA        1.8     4.6
            78    2HB     78     HN        1.8     4.5
            78    2HB     80     HN        2.5     5.5
            78    2HB     81     HN        1.8     4.5
            78    1HB     78     HN        1.8     4.5
            78    1HB     80     HN        1.8     4.5
            78    1HB     81     HN        1.8     4.5
            78     HN     79     HN        2.5     5.5
            78     HN     81    2HA        1.8     3.5
            78     HN     82     HN        1.8     3.5
            78     HN     82    1HB        2.5     5.5
            78     HN    202    HHB        2.5     5.5
            78     HN    202    QMA        2.5     7.8
            78     HN    203    QMC        2.5     7.8
            79     HA     79    1HB        1.8       3
            79     HA     80     HN        1.8     4.5
            79     HA     80    QG2        2.5     7.8
            79     HA     81     HN        2.5     5.5
            79     HA     82     HN        2.5     5.5
            79     HA     82    1HB        1.8     4.5
            79     HA     83    HD2        2.5     5.5
            79     HA    203    HAB        1.8       3
            79     HA    203    HHC        1.8       3
            79     HA    203    QMC        1.8     4.3
            79     HA    203    QBB        2.5     7.2
            79     HA    204    QBC        1.8       6
            79    2HB     79     HN        1.8     3.5
            79    2HB     80     HN        1.8     3.5
            79    2HB     80    QG2        1.8       6
            79    2HB    203    HAB        1.8     4.5
            79    2HB    203    HHC        1.8     4.5
            79    2HB    203    QMB        1.8       6
            79    2HB    204    HAC        2.5     5.5
            79    2HB    204    HHD        2.5     5.5
            79    2HB    204    QMD        2.5     7.8
            79    2HB    204    QBC        1.8     4.3
            79    1HB     79     HN        1.8       3
            79    1HB     80    QG2        1.8       6
            79    1HB     81     HN        2.5     5.5
            79    1HB    203    HAB        1.8     4.5
            79    1HB    203    HHC        2.5     5.5
            79    1HB    203    QMB        1.8       6
            79    1HB    204    HAC        2.5     5.5
            79    1HB    204    HHD        2.5     5.5
            79    1HB    204    QMD        1.8       6
            79    1HB    204    QBC        1.8     3.4
            79     HN     80     HN        1.8       3
            79     HN     80    QG2        2.5     7.8
            79     HN     82    2HB        2.5     5.5
            79     HN    202    QMA        2.5     7.8
            79     HN    202    QMB        2.5     7.8
            79     HN    203    HHC        1.8     4.5
            79     HN    203    HAB        1.8     4.5
            79     HN    203    QBB        1.8       6
            80     HA     80     HB        1.8     4.5
            80     HA     80    QG1        1.8     3.4
            80     HA     80    QG2        1.8     3.4
            80     HA     81     HN        1.8     4.5
            80     HA     82     HN        2.5     5.5
            80     HA     83     HN        2.5     5.5
            80     HA     83    HD1        1.8     4.5
            80     HA     83    2HB        1.8       3
            80     HA     83    1HB        1.8     3.5
            80     HA     84     HN        1.8     4.5
            80     HA     97     QB        2.5     7.2
            80     HA     98     HB        2.5     5.5
            80     HA     98    QG2        1.8     4.3
            80     HA    204    QMC        1.8       6
            80     HA    204    QBC        1.8       6
            80     HB     80     HN        1.8     3.5
            80     HB     80    QG1        1.8     3.4
            80     HB     80    QG2        1.8     3.4
            80     HB     81     HN        1.8     3.5
            80     HB     84    QD1        1.8       6
            80     HB    204    QMC        1.8       6
            80     HB    204    QBB        1.8       6
            80     HB    204    QBC        2.5     7.8
            80    QG1     81     HN        1.8       6
            80    QG1     83    2HB        1.8       6
            80    QG1     83    1HB        1.8       6
            80    QG1     84    1HB        2.5     7.2
            80    QG1     84     HA        2.5     7.8
            80    QG1     84     HG        1.8       6
            80    QG1     84     HN        1.8       6
            80    QG1     98     HA        1.8     4.3
            80    QG1     98     HB        1.8     4.3
            80    QG1     98    QG2        1.8     4.8
            80    QG1     98     HN        2.5     7.8
            80    QG1    204    HHC        1.8       6
            80    QG1    204    HAB        2.5     7.8
            80    QG1    204    QBB        1.8     4.8
            80    QG1    204    QMC        1.8       7
            80    QG2     80     HN        1.8     3.4
            80    QG2     81     HN        1.8       6
            80    QG2     83    1HB        1.8       6
            80    QG2     98     HA        1.8       6
            80    QG2     98     HB        1.8       6
            80    QG2     98    QG2        2.5       9
            80    QG2    106    HD2        1.8       6
            80    QG2    204    HHC        1.8       6
            80    QG2    204    HHD        1.8       6
            80    QG2    204    HAB        1.8       6
            80    QG2    204    HAC        1.8       6
            80    QG2    204    QBB        1.8       7
            80    QG2    204    QBC        1.8     4.2
            80    QG2    204    QMC        1.8     4.2
            80     HN     81     HN        1.8     3.5
            80     HN     82     HN        2.5     5.5
            80     HN    203    HAB        2.5     5.5
            80     HN    203    HHC        2.5     5.5
            80     HN    204    QBC        1.8       6
            81    2HA     82     HN        1.8     3.5
            81    2HA     83     HN        1.8     4.5
            81    2HA     84     HN        2.5     5.5
            81    1HA     82     HN        1.8     4.5
            81    1HA     84     HN        1.8     4.5
            81    1HA     84    QD1        1.8       6
            81    1HA     84    2HB        1.8     4.5
            81     HN     82     HN        1.8     3.5
            81     HN     83     HN        1.8     4.5
            81     HN     84    QD1        2.5     7.8
            82     HA     83     HN        1.8     4.5
            82     HA     83    HD2        2.5     5.5
            82     HA     84     HN        2.5     5.5
            82     HA     85     HN        1.8     4.5
            82     HA     85     QB        1.8       4
            82     HA     85    2HG        1.8     5.5
            82     HA     85    1HG        1.8     5.5
            82     HA     86     HN        2.5     5.5
            82     HA    203    QBC        1.8     6.3
            82     QB    203    HHC        1.8     5.5
            82     QB    203    QBC        1.8     4.8
            82    2HB     83     HN        1.8     3.5
            82    2HB     83    HD2        2.5     5.5
            82    2HB    201    QBC        2.5     7.8
            82    2HB    203    HAC        2.5     5.5
            82    2HB    203    QMC        1.8     3.4
            82    1HB     83     HN        1.8     4.5
            82    1HB     83    HD2        1.8     4.5
            82    1HB    201    QBC        2.5     7.8
            82    1HB    203    HAC        2.5     5.5
            82    1HB    203    HHD        2.5     5.5
            82    1HB    203    QMC        1.8     4.3
            82     HN     83     HN        1.8     3.5
            82     HN     83    2HB        2.5     5.5
            82     HN     83    1HB        1.8     4.5
            82     HN     83     HA        2.5     5.5
            82     HN     85     HN        2.5     5.5
            82     HN    203    QBC        1.8     6.5
            82     HN    203    QMC        1.8       6
            83     HA     83    2HB        1.8       3
            83     HA     83    HD2        1.8       3
            83     HA     85     HN        2.5     5.5
            83     HA     86     HB        1.8       3
            83     HA     86     HN        2.5     5.5
            83     HA     86    QG2        1.8     4.3
            83     HA     87     HN        2.5     5.5
            83     HA     97     QB        1.8     5.5
            83     HA     97    QD1        1.8       6
            83     HA     97    QD2        2.5     7.8
            83     HA    203    HHD        2.5     5.5
            83     HA    203    QMD        2.5     7.8
            83     QB     83    HD1        1.8       4
            83     QB     84     HN        1.8       4
            83    2HB     83     HN        1.8     3.5
            83    2HB     85     HN        2.5     5.5
            83    2HB     98     HA        1.8     4.5
            83    2HB     98     HN        1.8     4.5
            83    2HB     98    QG2        1.8     3.2
            83    2HB    204    QBC        1.8     4.3
            83    1HB     83     HN        1.8     3.5
            83    1HB     83    HD2        1.8     4.5
            83    1HB     85     HN        2.5     5.5
            83    1HB     97     HA        1.8     4.5
            83    1HB     97    QD1        1.8       6
            83    1HB     97    QD2        1.8       6
            83    1HB     98     HA        1.8     4.5
            83    1HB     98    QG2        1.8     3.4
            83    1HB    204    QMC        1.8       6
            83    1HB    204    QBC        2.5     7.8
            83    HD1     97     HG        2.5     5.5
            83    HD1     97    QD1        1.8       6
            83    HD1     97    QD2        2.5     7.8
            83    HD1     97     QB        1.8     4.3
            83    HD1     97     HA        1.8     3.5
            83    HD1    204    HAC        2.5     5.5
            83    HD1    204    QBC        1.8       6
            83    HD1    204    QMC        1.8     5.3
            83    HD2     86     HB        1.8     4.5
            83    HD2     97    QD1        1.8       6
            83    HD2    203    HAC        2.5     5.5
            83    HD2    203    HHC        2.5     5.5
            83    HD2    203    HHD        1.8     4.5
            83    HD2    203    QMD        2.5     7.8
            83    HD2    203    QMC        1.8       6
            83    HD2    204    QBC        1.8       6
            83    HE1     97     HA        1.8     3.5
            83    HE1     97    QD2        1.8       6
            83    HE1    203    HHA        2.5     5.5
            83    HE1    203    HHB        1.8     3.5
            83    HE1    203    QMA        1.8       6
            83    HE1    203    QMB        1.8       6
            83    HE1    204    QBC        1.8     3.4
            83     HN     84     HN        1.8     3.5
            83     HN     85     HN        2.5     5.5
            83     HN     97    QD1        2.5     7.8
            83     HN    203    QBC        2.5     7.8
            83     HN    203    QMC        1.8       6
            84     HA     84    2HB        1.8     3.5
            84     HA     84    QD1        1.8     4.3
            84     HA     84    QD2        1.8     4.3
            84     HA     85     HN        1.8     4.5
            84     HA     86     HN        2.5     5.5
            84     HA     87     HN        2.5     5.5
            84     HA     87     QB        1.8     4.3
            84     HA     94     QG        1.8     3.2
            84     HA     94     QE        1.8     5.5
            84     HA     98     HN        2.5     5.5
            84    2HB     84     HN        1.8       3
            84    2HB     84    QD1        1.8     4.3
            84    2HB     84    QD2        1.8     3.4
            84    2HB     85     QG        1.8     5.5
            84    2HB     85     HN        1.8     3.5
            84    1HB     84     HN        1.8     3.5
            84    1HB     84    QD1        1.8     3.4
            84    1HB     84    QD2        1.8       4
            84    1HB     85     HN        1.8     3.5
            84    QD1     85     HN        2.5     7.8
            84    QD1     98     HA        1.8       6
            84    QD1     98     HB        1.8     4.3
            84    QD1     98    QG2        1.8       7
            84    QD2     85     HN        1.8       6
            84    QD2     94     QE        1.8     6.6
            84     HG     84    QD1        1.8     3.4
            84     HG     84    QD2        1.8     3.4
            84     HG     84     HN        1.8     3.5
            84     HG     85     HN        2.5     5.5
            84     HN     85     HN        1.8     3.5
            84     HN     85     QG        2.5     7.2
            84     HN     86     HN        1.8     4.5
            84     HN     94     QG        2.5     7.2
            84     HN     98     HB        1.8     4.5
            84     HN     98    QG2        1.8     4.3
            85     HA     85     QB        1.8     3.2
            85     HA     85     QG        1.8     3.2
            85     HA     86     HN        1.8     4.5
            85     HA     88     HN        1.8     4.5
            85     QB     85     QG        1.8     3.4
            85     QB     85     HN        1.8     3.4
            85     QB     86     HN        1.8       4
            85     QB     87     HN        2.5     7.2
            85     QG     86     HN        2.5     7.2
            85     HN     86     HN        1.8       3
            85     HN     86     HB        2.5     5.5
            85     HN     86     HA        2.5     5.5
            85     HN     87     HN        2.5     5.5
            85     HN     88     HN        2.5     5.5
            86     HA     86     HN        1.8       3
            86     HA     86    QG2        1.8     3.4
            86     HA     87     HN        1.8     3.5
            86     HA     88     HN        1.8     4.5
            86     HA     97    QD1        1.8       6
            86     HA    203    QMD        1.8       6
            86     HB     86     HN        1.8       3
            86     HB     86    QG2        1.8     3.4
            86     HB     97     QB        1.8     5.5
            86     HB     97    QD1        1.8       6
            86     HB    203    HHD        1.8     4.5
            86     HB    203    QMD        1.8       6
            86    QG2     88     HN        1.8       6
            86    QG2     97    QD1        1.8     3.7
            86    QG2     97    QD2        1.8       7
            86    QG2    203    HHA        1.8       6
            86    QG2    203    HHD        1.8       6
            86    QG2    203   2HBD        1.8       6
            86    QG2    203   1HBD        1.8     4.3
            86    QG2    203    QMD        1.8     3.7
            86     HN     87     HN        2.5     5.5
            86     HN     87     QB        1.8       6
            86     HN     88     HN        2.5     5.5
            87     HA     88     HN        1.8     3.5
            87     HA     90    1HB        1.8     4.5
            87     HA     93     QB        1.8       4
            87     QB     87     HN        1.8     3.4
            87     QB     88     HN        1.8     4.3
            87     QB     90    2HB        2.5     7.8
            87     QB     90    1HB        1.8     5.5
            87     QB     90     HN        1.8       6
            87     QB     93     HA        1.8       6
            87     QB     93     QB        1.8     6.6
            87     QB     94     HA        1.8     3.4
            87     QB     95     HN        1.8       6
            87     QB     97    QD1        1.8     3.7
            87     QB     97    QD2        1.8       7
            87     QB     98     HN        2.5     5.5
            87     QB     98    QG2        1.8     4.8
            87     HN     88     HN        1.8     3.5
            87     HN     93     QB        1.8       6
            87     HN     94     QG        1.8     5.5
            87     HN     97    QD1        1.8       6
            88     QA     88     HN        1.8     3.2
            88     QA     89     HN        1.8     5.5
            88     QA     90    1HB        2.5     7.2
            88     HN     90     HN        1.8     4.5
            88     HN     93     QB        2.5     7.2
            88     HN     93     QD        2.5     7.2
            89     HA     90     HN        1.8     3.5
            89     HA     94     QE        1.8     5.5
            89     QB     90     HN        1.8     4.3
            90     HA     90    1HB        1.8       3
            90     HA     91     HN        1.8       3
            90     HA     91     QB        1.8       6
            90     HA     92     HN        1.8     4.5
            90     HA     93     QB        1.8     5.5
            90     HA     94     HN        2.5     5.5
            90    2HB     90     HN        1.8     3.5
            90    2HB     91     HN        1.8     4.5
            90    2HB     93     HA        1.8     4.5
            90    2HB     93     HN        1.8     3.5
            90    2HB     93     QB        1.8       4
            90    1HB     90     HN        1.8       3
            90    1HB     91     HN        1.8     4.5
            90    1HB     93     HN        1.8     4.5
            90    1HB     93     QB        1.8     5.5
            90    1HB     94     QB        2.5     7.2
            90    1HB     93     QG        1.8     5.5
            90     HN     91     HN        1.8     3.5
            90     HN     93     HN        1.8     4.5
            90     HN     93    2HB        1.8     4.5
            90     HN     93    1HB        1.8     4.5
            90     HN     94     QE        1.8       6
            90     HN     94     QB        2.5     7.2
            90     HN     94     QG        1.8       6
            91     HA     92     HN        1.8     3.5
            91     HA     94     HN        1.8     3.5
            91     HA     94     QB        1.8     3.4
            91     HA     94     QD        1.8     5.5
            91     QB     92     HN        1.8     4.3
            91    1HB     91     HN        1.8       3
            91     HN     92     HN        1.8     4.5
            92     HA     92     HN        1.8       3
            92     HA     93     HN        1.8     3.5
            92     HA     94     HN        1.8     4.5
            92     HA     95     HN        2.5     5.5
            92     HA     95     QB        1.8       4
            92     HA     95     QG        1.8     5.5
            92     HA     95     QD        1.8     5.5
            92     HA     96     QG        1.8     5.5
            92     QB     92     HN        1.8     3.4
            92     QB     93     HN        1.8     3.4
            92     HN     94     HN        1.8     3.5
            92     HN     93     QB        1.8       6
            93     HA     93     HN        1.8       3
            93     HA     93    2HB        1.8     3.2
            93     HA     93    1HB        1.8     3.2
            93     HA     93     QG        1.8     5.5
            93     HA     93     QE        1.8     5.5
            93     HA     94     HN        1.8     3.5
            93     HA     94     HA        2.5     5.5
            93     HA     95     HN        2.5     5.5
            93     HA     96     HN        2.5     5.5
            93     HA     96    2HB        1.8       4
            93     HA     96    1HB        1.8       4
            93     HA     96     QG        1.8     5.5
            93     HA     97    QD1        1.8       6
            93     HA     97    QD2        1.8       6
            93     QB     93     QE        1.8     6.1
            93     QB     94     HA        1.8     5.5
            93    2HB     93     HN        1.8     3.5
            93    2HB     94     HN        1.8     3.5
            93    2HB     97    QD1        1.8     6.6
            93    1HB     93     HN        1.8       3
            93    1HB     94     HN        1.8     3.5
            93    1HB     97    QD1        1.8     6.6
            93     QG     93     HN        1.8     3.2
            93     QD     93     HN        2.5     7.2
            93     QD     97    QD1        1.8     6.6
            93     QE     93     HN        2.5     7.2
            93     QE     97    QD1        1.8     6.6
            93     QE    203    QMD        2.5       9
            93     HN     94     HN        1.8       3
            93     HN     95     HN        1.8     4.5
            94     HA     94     QB        1.8     3.2
            94     HA     94     QG        1.8       4
            94     HA     94     QD        1.8     5.5
            94     HA     95     QB        2.5       7
            94     HA     96     QB        2.5       7
            94     HA     97     HN        2.5     5.5
            94     HA     97    QD1        1.8       6
            94     HA     97     QB        1.8       4
            94     HA     98     HA        2.5     5.5
            94     HA     98     HN        1.8     3.5
            94     HA     98    QG2        1.8     4.3
            94     QB     94     HN        1.8     3.2
            94     QB     98    QG2        1.8     6.6
            94    1HB     95     HN        1.8     4.5
            94     QG     94     HN        1.8       4
            94     QG     95     HN        2.5     7.2
            94     QG     96     HN        2.5     7.2
            94     QD     95     HN        2.5     7.2
            94     QE     95     HN        2.5     7.5
            94     HN     95     HN        1.8     3.5
            94     HN     95     QB        1.8     5.5
            94     HN     95     HA          3     5.5
            94     HN     96     HN        1.8     4.5
            94     HN     96     QB        2.5     7.2
            94     HN     98    QG2        2.5     7.8
            95     HA     95    2HB        1.8     3.2
            95     HA     95    1HB        1.8     3.2
            95     HA     98     HN        2.5     5.5
            95     HA     99    2HA        1.8     4.5
            95     HA    103    2HB        1.8     4.5
            95     QB     95     QE        2.5     7.9
            95     QB     95     HN        1.8     3.2
            95     QB     96     QG        1.8     6.1
            95     QB     96     HN        1.8       4
            95     QG     95     HN        1.8       4
            95     QG     96     HA        1.8     5.5
            95     QG     96     HN        1.8       4
            95     QD     95     HN        1.8     5.5
            95     QD     96     HN        1.8     5.5
            95     QD    103     HA        2.5     5.5
            95     QE    103     HN        2.5     7.2
            95     HN     96     HN        1.8     4.5
            95     HN     96     HA        2.5     5.5
            95     HN     96    2HB        1.8     4.5
            95     HN     96     QG        1.8     5.5
            95     HN     97     QB        1.8       4
            96     HA     96     HN        1.8       3
            96     HA     96    2HG        1.8       4
            96     HA     96    1HG        1.8       4
            96     HA     97     HN        1.8     3.5
            96     HA     99     HN        2.5     5.5
            96     HA    103     HA        1.8       3
            96     HA    103    1HB        1.8     3.5
            96     QB     96     HN        1.8     3.2
            96     QB     96     QG        1.8     3.4
            96     QB     97    QD2        1.8     6.6
            96     QB    103     HA        2.5     7.2
            96     QB    103    2HB        2.5     7.2
            96     QB    104     HN        2.5     7.2
            96    2HB     97     HN        1.8     3.5
            96    2HB     97    QD1        2.5     8.6
            96    1HB     97     HN        1.8     3.5
            96    1HB     97    QD1        2.5     8.6
            96     QG     96     HN        1.8     3.2
            96     QG     97    QD2        2.5     8.6
            96     QG    104     QE        2.5     7.2
            96     HN     97     HN        1.8       3
            96     HN     97     QD        2.5       8
            96     HN     98     HN        2.5     5.5
            96     HN    103     HA        2.5     5.5
            97     HA     97    QD1        1.8     4.3
            97     HA     98     HA        2.5     5.5
            97     HA     98     HN        1.8     3.5
            97     HA     98    QG2        1.8       6
            97     HA     99     HN        2.5     5.5
            97     HA    104     QB        1.8     5.5
            97     HA    203    HHA        2.5     5.5
            97     HA    204    QMC        1.8       6
            97     QB     97    QD1        1.8     3.6
            97     QB     97    QD2        1.8     4.6
            97     QB     97     HN        1.8     3.2
            97     QB     98     HN        1.8     5.5
            97     QB     98    QG2        1.8     4.8
            97     HG     97    QD1        1.8     3.4
            97     HG     97    QD2        1.8     3.4
            97     HG     97     HN        1.8       3
            97     HG     98     HN        1.8     4.5
            97    QD1     97     HN        1.8     4.3
            97    QD1     98    QG2        1.8       7
            97    QD1     98     HN        1.8       6
            97    QD1    203    HHA        1.8       6
            97    QD1    203   2HAD        1.8       6
            97    QD1    203   1HAD        1.8       6
            97    QD1    203   2HBD        1.8       6
            97    QD1    203   1HBD        1.8       6
            97    QD1    203    QMD        2.5       9
            97    QD2     97     HN        1.8       6
            97    QD2     98    QG2        2.5       9
            97    QD2    104     QB        1.8     6.6
            97    QD2    104     QE        1.8     6.6
            97    QD2    203    HHA        1.8     4.3
            97    QD2    203   2HAA        1.8       6
            97    QD2    203   1HAA        1.8       6
            97    QD2    203   2HAD        1.8       6
            97    QD2    203   1HBA        2.5     7.8
            97    QD2    203   2HBD        1.8       6
            97    QD2    203   1HBD        2.5     7.8
            97    QD2    203    QMA        1.8       7
            97    QD2    203    QMD        2.5       9
            97    QD2    203   2HBA        2.5     7.8
            97     HN     98     HN        1.8       3
            97     HN     98    QG2        1.8       6
            97     HN     99     HN        1.8     4.5
            98     HA     98    QG2        1.8     3.4
            98     HA     98     HB        1.8       3
            98     HA     99     HN        1.8     4.5
            98     HA    103    2HB        2.5     5.5
            98     HA    204    HAB        2.5     5.5
            98     HA    204    HHC        1.8     4.5
            98     HA    204    QMC        1.8     3.4
            98     HA    204    QBC        1.8       6
            98     HA    204    QBB        2.5     7.8
            98     HB     98    QG2        1.8     3.4
            98     HB     98     HN        2.5     5.5
            98     HB    100     HN        2.5     5.5
            98     HB    204    HHC        2.5     5.5
            98     HB    204    QMC        1.8       6
            98     HB    204    QBB        2.5     7.8
            98    QG2     98     HN        1.8       6
            98    QG2     99     HN        2.5     7.2
            98    QG2    204    QMC        1.8       7
            98    QG2    204    QBC        1.8       7
            98     HN     99     HN        1.8       3
            98     HN    204    QMC        2.5     7.8
            99     QA     99     HN        1.8     3.2
            99     QA    102     QA        2.5     7.9
            99     QA    204    HHC        2.5     7.2
            99    2HA    100     HN        1.8     3.5
            99    2HA    101     HN        2.5     5.5
            99    2HA    103     HA        1.8     4.5
            99    2HA    103    2HB        1.8     4.5
            99    2HA    103    1HB        1.8     3.5
            99    2HA    103     HN        1.8     4.5
            99    1HA    100     HN        1.8     3.5
            99    1HA    101     HN        1.8     4.5
            99    1HA    103    2HB        1.8     4.5
            99    1HA    204    QMC        2.5     7.8
            99     HN    100     HN        2.5     5.5
            99     HN    100     HA        2.5     5.5
            99     HN    103     HA        2.5     5.5
            99     HN    103    2HB        1.8     3.5
            99     HN    103    1HB        1.8     3.5
            99     HN    104     HN        2.5     5.5
            99     HN    204    QMC        2.5     7.8
           100     HA    100     HN        1.8       3
           100     HA    100    2HB        1.8       3
           100     HA    100    1HB        1.8       3
           100     HA    101     HN        1.8     3.5
           100     HA    101     HA        1.8     4.5
           100     HA    106    HD2        1.8     3.5
           100     HA    204    HHC        1.8       3
           100     HA    204    HAB        1.8       3
           100     HA    204    QMC        1.8     4.3
           100     HA    204    QBB        1.8       6
           100    2HB    100     HN        1.8     3.5
           100    2HB    101     HN        1.8     3.5
           100    2HB    101     QG        2.5     7.2
           100    2HB    204    HAB        1.8       3
           100    2HB    204    HHB        2.5     5.5
           100    2HB    204    HHC        1.8     4.5
           100    2HB    204    QBB        1.8     4.3
           100    1HB    100     HN        1.8       3
           100    1HB    101     HN        1.8     3.5
           100    1HB    106    HD2        1.8     3.5
           100    1HB    204    HAB        2.5     5.5
           100    1HB    204    HHC        2.5     5.5
           100    1HB    204    QMB        1.8     4.6
           100    1HB    204    QBB        2.5     7.8
           100     HN    101     HN        1.8     3.5
           100     HN    101     HA        2.5     5.5
           100     HN    103    1HB        2.5     5.5
           100     HN    106    HD2        2.5     5.5
           100     HN    204    HHC        1.8     3.5
           100     HN    204    HAB        2.5     5.5
           100     HN    204    QBB        2.5     7.8
           100     HN    204    QMC        2.5     7.8
           100     HN    204    QMB        2.5     7.5
           101     HA    101     QB        1.8     3.2
           101     HA    102     HN        1.8     3.5
           101     HA    103     HN        1.8     4.5
           101     HA    106     QB        1.8     3.2
           101     HA    106    HD2        1.8     4.5
           101     QB    101     HN        1.8       4
           101     QB    102     HN        1.8       4
           101     QB    103     HN        2.5     7.2
           101     QG    101     QE        1.8     6.1
           101     QG    102     HN        2.5     7.2
           101     HN    102     HN        1.8     4.5
           101     HN    103     HN        2.5     5.5
           101     HN    103     QB        2.5       7
           101     HN    106     QB        1.8     5.5
           102     QA    103     HN        1.8     3.4
           102     QA    103     HA        2.5     7.2
           102    2HA    102     HN        1.8       3
           102    1HA    102     HN        1.8       3
           102     HN    103     HN        1.8       3
           103     HA    103    1HB        1.8       3
           103     HA    103    2HB        1.8       3
           103     HA    104     HN        1.8       3
           103     HA    105     HN        1.8     4.5
           103     HA    204    QMC        1.8     6.5
           103    2HB    103     HN        1.8     3.5
           103    2HB    105     HN        1.8     4.5
           103    2HB    204    QMC        1.8       6
           103    1HB    103     HN        1.8     3.5
           103    1HB    104     HN        1.8     3.5
           103    1HB    105     HN        1.8     3.5
           103    1HB    204    QMC        1.8     4.3
           103     HN    104     HN        2.5     5.5
           103     HN    105     HN        2.5     5.5
           103     HN    106     HN        1.8     4.5
           103     HN    106     QB        1.8     5.5
           104     HA    104    2HB        1.8     3.2
           104     HA    104    1HB        1.8     3.2
           104     HA    104     QG        1.8       4
           104     HA    104     QE        2.5     7.2
           104     HA    104     HN        1.8       3
           104     HA    105     HN        1.8     3.5
           104     HA    106     HN        2.5     5.5
           104     HA    203   2HAA        2.5     5.5
           104     QB    104     QG        1.8     6.1
           104     QB    105     HA        1.8     5.5
           104     QB    105     HN        1.8       4
           104     QB    105    2HB        1.8     5.5
           104     QB    203    HHA        2.5     7.2
           104     QB    203    QAA        1.8     5.5
           104    2HB    104     HN        1.8     3.5
           104    2HB    203    HHB        2.5     5.5
           104    2HB    203    QMA        1.8     3.5
           104    1HB    104     HN        1.8     3.5
           104    1HB    203    HHB        2.5     5.5
           104    1HB    203    QMA        1.8     3.5
           104     QG    203    QMA        1.8     6.6
           104    2HG    104     HN        1.8     3.5
           104    1HG    104     HN        1.8     3.5
           104     QE    104     HN        2.5     7.2
           104     HN    105     HN        1.8       3
           104     HN    105    2HB        1.8     4.5
           104     HN    105    1HB        2.5     5.5
           104     HN    105     HA          3     5.5
           104     HN    106     HN        2.5     5.5
           104     HN    203   2HAA        2.5     5.5
           104     HN    203   1HAA        2.5     5.5
           104     HN    204    QMC        2.5     7.8
           105     HA    105     HN        1.8       3
           105     HA    106     HN        1.8     4.5
           105     HA    106     HA        2.5     5.5
           105     HA    107     HN        2.5     5.5
           105     HA    203    HHB        1.8     3.5
           105     HA    203    QMA        1.8     3.4
           105     HA    203    QMB        1.8     4.6
           105     HA    204    HAC        1.8     4.5
           105     HA    204    HHD        2.5     5.5
           105     QB    105     HN        1.8     3.2
           105     QB    106     HN        1.8     3.2
           105     QB    203    QMB        1.8     6.5
           105    2HB    204    HAC        1.8     4.5
           105    2HB    204    HHC        2.5     5.5
           105    2HB    204    HHD        1.8     4.5
           105    2HB    204    QMC        1.8       6
           105    2HB    204    QBC        1.8       6
           105    1HB    204    HAC        1.8     4.5
           105    1HB    204    HHC        2.5     5.5
           105    1HB    204    HHD        1.8     4.5
           105    1HB    204    QMC        1.8     4.3
           105    1HB    204    QBC        1.8       6
           105     HN    106     HN        1.8       3
           105     HN    106     HA        2.5     5.5
           105     HN    204    QMC        1.8       6
           106     HA    106     QB        1.8     3.2
           106     HA    106    HD2        2.5     5.5
           106     HA    107     HN        1.8       3
           106     QB    106    HD1        1.8       4
           106     QB    106    HD2        1.8     3.2
           106     QB    106     HN        1.8     3.2
           106     QB    107     HN        1.8     5.5
           106    HD1    107     HN        1.8     4.5
           106    HD2    204    HAB        1.8     4.5
           106    HD2    204    QBB        2.5     7.8
           106    HD2    204    HHC        1.8     4.5
           106    HD2    204    QMC        1.8       6
           106    HD2    204    QMB        2.5     7.8
           106    HE1    204    HHA        1.8     4.5
           106    HE1    204    HHD        2.5     5.5
           106    HE1    204    QMD        2.5     7.8
           106    HE1    204   1HBD        1.8       6
           106     HN    107     HN        1.8     4.5
           106     HN    204    QMC        1.8       6
           107     HA    107     HN        1.8       3
           107     QB    107     HN        1.8     3.2
           201    HHA    201   2HAA        1.8     4.5
           201    HHA    201   1HAA        1.8     3.5
           201    HHA    201   2HBA        1.8     3.5
           201    HHA    201   1HBA        1.8     3.5
           201    HHA    201    QBD        1.8       4
           201    HHA    201    QMD        1.8     6.5
           201   1HAA    201   1HBA        1.8       3
           201    HAB    201    QMB        2.5     7.8
           201    HAB    201    QMC        1.8     5.3
           201    HAC    201    QMC        2.5     7.8
           201    HAC    201    QMD        1.8     4.6
           201    HAC    202    QBB        1.8       6
           201    HAC    202    QMB        1.8       7
           201    HAC    203    HAB        1.8     4.5
           201    HAC    203    HHC        1.8       5
           201    HAC    203    QMC        1.8       6
           201    HAC    203    QBB        1.8       6
           201   2HAD    201   1HBA        2.5     5.5
           201   2HAD    201    QMD        1.8     4.3
           201   1HAD    201   1HBA        2.5     7.8
           201    HHB    201    QBB        2.5     7.8
           201   2HBA    201   1HAA        1.8     3.4
           201   2HBA    201   1HAD        1.8     4.5
           201    QBB    201    QMB        1.8     3.7
           201    QBB    201    QMC        1.8       7
           201    QBC    201    QMC        1.8     4.7
           201    QBC    202    QMB        1.8       7
           201    QBC    203    HAB        1.8       6
           201    QBC    203    HAC        2.5     7.2
           201    QBC    203    QBC        1.8       8
           201    QBC    203    QBB        1.8       7
           201    QBC    203    HHC        1.8       6
           201    QBC    203    HHD        2.5     7.8
           201    QBC    203    QMC        1.8     4.8
           201    QBD    201    QMD        1.8     4.6
           201    HHC    201    HAB        1.8       3
           201    HHC    201    QBB        1.8     4.3
           201    HHC    201    QBC        1.8     6.1
           201    HHD    201    HAC        1.8     3.4
           201    HHD    201    QBC        1.8     4.3
           201    HHD    201    QMC        2.5     7.8
           201    HHD    202    QBB        1.8       6
           201    HHD    202    QMB        2.5     7.8
           201    HHD    203    HAB        2.5     5.5
           201    HHD    203    HHC        2.5     5.5
           201    HHD    203    QBB        1.8     4.3
           201    QMA    201    QMB        1.8     5.8
           201    QMC    202    QBB        2.5       9
           201    QMC    203    HHC        2.5     7.8
           201    QMD    202    HAB        1.8     4.3
           201    QMD    202    QMB        1.8       7
           201    QMD    202    HHC        2.5     7.8
           201    QMD    202    QBB        1.8     4.8
           201    QMD    203    HAB        1.8       6
           201    QMD    203    HHC        1.8       6
           201    QMD    203    QMB        1.8       7
           201    QMD    203    QBB        1.8     3.7
           202    HHA    202   2HAA        1.8     3.5
           202    HHA    202   1HAA        1.8     3.5
           202    HHA    202   2HAD        1.8     3.5
           202    HHA    202   1HAD        1.8     3.5
           202    HHA    202   2HBA        1.8     4.5
           202    HHA    202   1HBA        1.8     4.5
           202    HHA    202    QBD        1.8       4
           202    HHA    202    QMA        1.8     6.5
           202   2HAA    202   2HBA        1.8     3.5
           202   1HAA    202    QMA        1.8     4.3
           202    HAB    202    QMB        2.5     7.8
           202    HAB    202    QMC        1.8       6
           202    HAB    203    QBB        1.8     4.3
           202    HAC    202    QMC        2.5     7.8
           202    HAC    202    QMD        1.8       6
           202   2HAD    202    QMD        1.8       6
           202   1HAD    202    QBD        1.8       4
           202   1HAD    202    QMD        1.8     4.3
           202    HHB    202   2HAA        2.5     5.5
           202    HHB    202   1HAA        2.5     5.5
           202    HHB    202    QBB        1.8       6
           202    HHB    203    QMC        2.5     7.8
           202    HHB    203    QBB        2.5     7.8
           202   1HBA    202    QMA        1.8     4.3
           202    QBB    202    QMB        1.8     3.7
           202    QBB    202    QMC        1.8       7
           202    QBB    203    QBB        1.8       7
           202    HHC    202    HAB        1.8     3.5
           202    HHC    202    QBB        1.8     4.3
           202    HHC    202    QBC        1.8       6
           202    HHD    202    HAC        1.8       3
           202    HHD    202    QBC        1.8     4.3
           202    QMB    203    HAB        1.8     6.1
           202    QMB    203    HHC        2.5     7.8
           202    QMB    203    QBB        1.8       7
           202    QMC    202    QBC        1.8     4.8
           202    QMD    202    QBC        1.8       7
           202    QMD    202    QBD        1.8     3.6
           203    HHA    203   2HAA        1.8     3.4
           203    HHA    203   2HAD        1.8     3.4
           203    HHA    203    QBA        1.8     3.2
           203    HHA    203   2HBD        1.8     4.5
           203    HHA    203   1HBD        1.8     4.5
           203    HHA    203    QMA        1.8     6.5
           203    HHA    203    QMD        1.8     6.5
           203   2HAA    203    QMA        1.8     3.4
           203   1HAA    203    QBA        1.8       4
           203    HAB    203    QMB        2.5     7.8
           203    HAB    203    QMC        1.8     4.3
           203    HAB    204    QBC        2.5     7.2
           203    HAC    203    QMC        1.8       6
           203    HAC    203    QMD        1.8     4.3
           203   2HAD    203    QBA        2.5     7.2
           203   2HAD    203   2HBD        1.8     3.5
           203   2HAD    203   1HBD        1.8     3.5
           203   2HAD    203    QMD        1.8     4.3
           203   1HAD    203   2HBD        1.8     3.5
           203   1HAD    203    QMD        1.8     4.3
           203    HHB    203    QAA        1.8     5.5
           203    HHB    203    HAB        2.5     5.5
           203    HHB    203    QBB        2.5     7.8
           203    HHB    204    QBC        1.8       6
           203    HHB    204    HAC        1.8     4.5
           203    HHB    204    HHD        2.5     5.5
           203    HHB    204    QMD        1.8       6
           203    HHC    203    HAB        1.8       3
           203    HHC    203    QBB        1.8     5.5
           203    HHC    203    QBC        1.8       6
           203    HHC    204    QBC        2.5     7.8
           203    HHD    203    HAC        1.8       3
           203    HHD    203    QBC        1.8       6
           203    QMA    203    QMB        1.8       7
           203    QMA    204    HAC        2.5     7.8
           203    QMA    204    QBC        1.8       7
           203    QMB    203    QBB        1.8       7
           203    QMB    204    HAC        1.8     4.3
           203    QMB    204    HHD        1.8     3.7
           203    QMB    204    QMD        1.8     3.7
           203    QMB    204    QBC        1.8     4.8
           203    QMB    204   1HAD        2.5     7.8
           203    QMB    204   2HBD        2.5     7.8
           203    QMC    203    QBC        1.8     4.8
           203    QMC    204    QBC        2.5     7.9
           203    QMD    203    QBC        1.8       7
           203    QMD    203   2HBD        1.8     4.3
           203    QMD    203   1HBD        1.8     4.3
           204    HHA    204    QAA        1.8       4
           204    HHA    204   1HAA        1.8     3.5
           204    HHA    204    QAD        1.8       4
           204    HHA    204   1HAD        1.8     3.5
           204    HHA    204   2HBA        1.8     4.5
           204    HHA    204   1HBA        1.8     4.5
           204    HHA    204   2HBD        1.8     4.5
           204    HHA    204   1HBD        1.8     4.5
           204    HHA    204    QMA        1.8     6.5
           204    HHA    204    QMD        1.8     6.5
           204    QAA    204    QMA        1.8     4.3
           204   1HAA    204   2HBA        1.8       3
           204    HAB    204    QMB        1.8       6
           204    HAB    204    QMC        1.8       6
           204    HAC    204    QMC        1.8       6
           204    HAC    204    QMD        1.8       6
           204   2HAD    204   2HAA        1.8     4.5
           204   2HAD    204   2HBD        1.8     4.5
           204   2HAD    204    QMD        1.8       6
           204   1HAD    204   2HBD        1.8     4.5
           204   1HAD    204    QMD        1.8     4.3
           204    HHB    204   2HBA        2.5     5.5
           204    HHB    204   1HBA        2.5     5.5
           204    HHB    204    QBB        2.5     7.8
           204   2HBA    204    QMA        1.8     3.4
           204    HHC    204    HAB        1.8     3.4
           204    HHC    204    QBB        1.8     3.4
           204    HHC    204    QBC        1.8       6
           204    HHD    204    HAC        1.8       3
           204    HHD    204    QBC        1.8     4.6
           204    HHD    204   2HBD        2.5     5.5
           204    QMA    204   1HBA        1.8     3.4
           204    QMB    204    QBB        1.8     4.8
           204    QMC    204    QBB        1.8       7
           204    QMC    204    QBC        1.8     4.8
           204    QMD    204   2HBD        1.8     4.3

 thioether bond
            30     SG    201    CAB        1.7     1.9
            46     SG    202    CAB        1.7     1.9
            79     SG    203    CAB        1.7     1.9
           100     SG    204    CAB        1.7     1.9
            33     SG    201    CAC        1.7     1.9
            51     SG    202    CAC        1.7     1.9
            82     SG    203    CAC        1.7     1.9
           105     SG    204    CAC        1.7     1.9

 heme ligeted histidine
            22    NE2    201     FE        1.8     2.2
            34    NE2    201     FE        1.8     2.2
            35    NE2    202     FE        1.8     2.2
            52    NE2    202     FE        1.8     2.2
            25    NE2    203     FE        1.8     2.2
            83    NE2    203     FE        1.8     2.2
            70    NE2    204     FE        1.8     2.2
           106    NE2    204     FE        1.8     2.2
            22    NE2    201    N A        2.7     2.9
            22    NE2    201    N B        2.7     2.9
            22    NE2    201    N C        2.7     2.9
            22    NE2    201    N D        2.7     2.9
            25    NE2    203    N A        2.7     2.9
            25    NE2    203    N B        2.7     2.9
            25    NE2    203    N C        2.7     2.9
            25    NE2    203    N D        2.7     2.9
            34    NE2    201    N A        2.7     2.9
            34    NE2    201    N B        2.7     2.9
            34    NE2    201    N C        2.7     2.9
            34    NE2    201    N D        2.7     2.9
            35    NE2    202    N A        2.7     2.9
            35    NE2    202    N B        2.7     2.9
            35    NE2    202    N C        2.7     2.9
            35    NE2    202    N D        2.7     2.9
            52    NE2    202    N A        2.7     2.9
            52    NE2    202    N B        2.7     2.9
            52    NE2    202    N C        2.7     2.9
            52    NE2    202    N D        2.7     2.9
            70    NE2    204    N A        2.7     2.9
            70    NE2    204    N B        2.7     2.9
            70    NE2    204    N C        2.7     2.9
            70    NE2    204    N D        2.7     2.9
           106    NE2    204    N A        2.7     2.9
           106    NE2    204    N B        2.7     2.9
           106    NE2    204    N C        2.7     2.9
           106    NE2    204    N D        2.7     2.9


Angle restraints
  Phi angle restraints
        residue       lower upper   limits
             3          -110     -50
             4          -100     -40
             7          -110     -50
             9          -110     -50
            10          -160     -80
            11          -160     -80
            12          -160     -80
            13          -110     -50
            14          -160     -80
            15          -110     -50
            16          -160     -80
            18          -160     -80
            19          -160     -80
            20          -160     -80
            21          -160     -80
            22          -110     -50
            23          -110     -50
            24          -100     -40
            25          -160     -80
            26          -100     -40
            28          -160     -80
            29          -100     -40
            30          -100     -40
            32          -160     -80
            33          -160     -80
            34          -110     -50
            37          -160     -80
            40          -160     -80
            42          -100     -40
            43          -160     -80
            44          -160     -80
            45          -100     -40
            46          -100     -40
            47          -110     -50
            48          -100     -40
            49          -100     -40
            51          -160     -80
            52          -160     -80
            53          -160     -80
            54          -160     -80
            55          -160     -80
            56          -160     -80
            59          -110     -50
            61          -160     -80
            62          -100     -40
            63          -160     -80
            65          -100     -40
            66          -100     -40
            67          -100     -40
            69          -160     -80
            70          -160     -80
            71          -160     -80
            72          -160     -80
            74          -160     -80
            75          -100     -40
            76          -160     -80
            78          -160     -80
            79          -100     -40
            80          -100     -40
            82          -100     -40
            83          -100     -40
            84          -100     -40
            85          -100     -40
            86          -100     -40
            90          -160     -80
            91          -120     -40
            93          -110     -50
            94          -100     -40
            95          -110     -50
            96          -100     -40
            97          -160     -80
            98          -160     -80
           100          -160     -80
           103          -160     -80
           104          -100     -40
           105          -160     -80
           106          -160     -80
           107          -110     -50

  Chai angle restraints
             7           -75     -45
            12            40      80
            18           165     195
            20           165     195
            25           -75     -45
            28           165     195
            33           -75     -45
            34           -75     -45
            38           165     195
            59           160     200
            70           -80     -40
            71           -75     -45
            80           165     195
            90           165     195
           100           -75     -45


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1H        ALA   1  21.087  14.512   2.602
    2   2H    ALA   1          2H        ALA   1  19.744  15.038   1.704
    3   3H    ALA   1          3H        ALA   1  21.097  14.387   0.911
    4    HA   ALA   1           HA       ALA   1  19.532  12.649   0.898
    5   1HB   ALA   1          1HB       ALA   1  20.991  11.894   3.366
    6   2HB   ALA   1          2HB       ALA   1  21.995  12.530   2.063
    7   3HB   ALA   1          3HB       ALA   1  20.981  11.113   1.786
    8    HA   PRO   2           HA       PRO   2  16.250  13.162   3.816
    9   1HB   PRO   2          1HB       PRO   2  14.845  10.908   3.163
   10   2HB   PRO   2          2HB       PRO   2  14.846  12.366   2.161
   11   1HG   PRO   2          1HG       PRO   2  16.355   9.830   1.810
   12   2HG   PRO   2          2HG       PRO   2  15.610  10.878   0.593
   13   1HD   PRO   2          1HD       PRO   2  18.288  10.844   1.128
   14   2HD   PRO   2          2HD       PRO   2  17.429  12.256   0.476
   15    H    LYS   3           H        LYS   3  15.738  12.332   5.881
   16    HA   LYS   3           HA       LYS   3  17.427  10.039   6.788
   17   1HB   LYS   3          1HB       LYS   3  15.923  12.126   8.375
   18   2HB   LYS   3          2HB       LYS   3  17.147  11.012   8.978
   19   1HG   LYS   3          1HG       LYS   3  18.674  12.102   7.153
   20   2HG   LYS   3          2HG       LYS   3  17.498  13.416   7.206
   21   1HD   LYS   3          1HD       LYS   3  18.578  14.213   9.014
   22   2HD   LYS   3          2HD       LYS   3  18.031  12.786   9.896
   23   1HE   LYS   3          1HE       LYS   3  20.041  11.566   9.318
   24   2HE   LYS   3          2HE       LYS   3  20.557  12.852   8.208
   25   1HZ   LYS   3          1HZ       LYS   3  20.049  13.242  11.109
   26   2HZ   LYS   3          2HZ       LYS   3  20.666  14.393  10.023
   27   3HZ   LYS   3          3HZ       LYS   3  21.590  13.028  10.434
   28    H    ALA   4           H        ALA   4  15.949   8.448   5.981
   29    HA   ALA   4           HA       ALA   4  13.236   8.119   6.224
   30   1HB   ALA   4          1HB       ALA   4  15.374   6.526   5.679
   31   2HB   ALA   4          2HB       ALA   4  13.731   5.908   5.856
   32   3HB   ALA   4          3HB       ALA   4  14.854   5.835   7.216
   33    HA   PRO   5           HA       PRO   5  12.481   8.489  10.553
   34   1HB   PRO   5          1HB       PRO   5   9.838   7.769  10.504
   35   2HB   PRO   5          2HB       PRO   5  10.432   9.360   9.997
   36   1HG   PRO   5          1HG       PRO   5   9.511   7.082   8.355
   37   2HG   PRO   5          2HG       PRO   5   9.469   8.815   8.018
   38   1HD   PRO   5          1HD       PRO   5  11.307   6.991   6.968
   39   2HD   PRO   5          2HD       PRO   5  11.458   8.759   6.948
   40    H    ALA   6           H        ALA   6  11.782   7.091  12.371
   41    HA   ALA   6           HA       ALA   6  12.893   4.484  12.273
   42   1HB   ALA   6          1HB       ALA   6  12.761   5.600  14.353
   43   2HB   ALA   6          2HB       ALA   6  11.543   4.332  14.488
   44   3HB   ALA   6          3HB       ALA   6  11.056   5.990  14.132
   45    H    ASP   7           H        ASP   7  11.900   2.458  12.196
   46    HA   ASP   7           HA       ASP   7   9.691   2.046  10.471
   47   1HB   ASP   7          1HB       ASP   7  10.609   0.185  12.671
   48   2HB   ASP   7          2HB       ASP   7   9.991  -0.241  11.078
   49    H    GLY   8           H        GLY   8   7.589   1.134  11.088
   50   1HA   GLY   8          1HA       GLY   8   5.819   0.727  12.689
   51   2HA   GLY   8          2HA       GLY   8   6.686   1.732  13.850
   52    H    LEU   9           H        LEU   9   6.447   2.955  10.620
   53    HA   LEU   9           HA       LEU   9   5.060   5.331  11.465
   54   1HB   LEU   9          1HB       LEU   9   6.433   4.361   9.208
   55   2HB   LEU   9          2HB       LEU   9   4.801   4.721   8.638
   56    HG   LEU   9           HG       LEU   9   5.976   6.734  10.457
   57   1HD1  LEU   9          1HD1      LEU   9   7.188   5.974   7.817
   58   2HD1  LEU   9          2HD1      LEU   9   7.986   6.517   9.294
   59   3HD1  LEU   9          3HD1      LEU   9   7.137   7.678   8.272
   60   1HD2  LEU   9          1HD2      LEU   9   4.503   6.811   7.805
   61   2HD2  LEU   9          2HD2      LEU   9   4.984   8.244   8.713
   62   3HD2  LEU   9          3HD2      LEU   9   3.812   7.112   9.401
   63    H    LYS  10           H        LYS  10   2.911   5.493  11.889
   64    HA   LYS  10           HA       LYS  10   1.121   3.302  11.009
   65   1HB   LYS  10          1HB       LYS  10   1.266   5.305  13.143
   66   2HB   LYS  10          2HB       LYS  10  -0.358   5.094  12.484
   67   1HG   LYS  10          1HG       LYS  10   0.198   2.532  12.678
   68   2HG   LYS  10          2HG       LYS  10   1.399   3.079  13.850
   69   1HD   LYS  10          1HD       LYS  10  -0.751   4.512  14.677
   70   2HD   LYS  10          2HD       LYS  10  -1.561   3.082  14.038
   71   1HE   LYS  10          1HE       LYS  10  -0.772   1.743  15.715
   72   2HE   LYS  10          2HE       LYS  10   0.827   2.514  15.699
   73   1HZ   LYS  10          1HZ       LYS  10  -0.186   3.214  17.691
   74   2HZ   LYS  10          2HZ       LYS  10  -1.672   3.527  16.930
   75   3HZ   LYS  10          3HZ       LYS  10  -0.335   4.531  16.632
   76    H    MET  11           H        MET  11   0.197   3.542   9.056
   77    HA   MET  11           HA       MET  11  -0.351   6.209   7.904
   78   1HB   MET  11          1HB       MET  11  -0.231   3.360   7.057
   79   2HB   MET  11          2HB       MET  11  -1.386   4.366   6.186
   80   1HG   MET  11          1HG       MET  11   0.493   6.039   5.855
   81   2HG   MET  11          2HG       MET  11   1.588   4.804   6.477
   82   1HE   MET  11          1HE       MET  11   1.148   6.538   4.043
   83   2HE   MET  11          2HE       MET  11   0.108   5.914   2.766
   84   3HE   MET  11          3HE       MET  11   1.836   5.578   2.727
   85    H    ASP  12           H        ASP  12  -2.065   7.020   9.222
   86    HA   ASP  12           HA       ASP  12  -4.526   5.313   9.366
   87   1HB   ASP  12          1HB       ASP  12  -5.066   7.146  11.137
   88   2HB   ASP  12          2HB       ASP  12  -3.839   5.944  11.515
   89    H    LYS  13           H        LYS  13  -3.499   7.203   7.146
   90    HA   LYS  13           HA       LYS  13  -5.073   9.519   6.906
   91   1HB   LYS  13          1HB       LYS  13  -3.944   7.466   5.023
   92   2HB   LYS  13          2HB       LYS  13  -4.865   8.828   4.394
   93   1HG   LYS  13          1HG       LYS  13  -2.430   9.026   6.193
   94   2HG   LYS  13          2HG       LYS  13  -2.448   9.347   4.458
   95   1HD   LYS  13          1HD       LYS  13  -4.267  11.081   4.945
   96   2HD   LYS  13          2HD       LYS  13  -3.844  10.894   6.647
   97   1HE   LYS  13          1HE       LYS  13  -1.362  11.228   5.561
   98   2HE   LYS  13          2HE       LYS  13  -2.339  12.238   4.478
   99   1HZ   LYS  13          1HZ       LYS  13  -1.902  12.489   7.358
  100   2HZ   LYS  13          2HZ       LYS  13  -3.449  12.878   6.771
  101   3HZ   LYS  13          3HZ       LYS  13  -2.083  13.700   6.183
  102    H    THR  14           H        THR  14  -5.969   6.143   6.501
  103    HA   THR  14           HA       THR  14  -8.753   6.997   5.755
  104    HB   THR  14           HB       THR  14  -8.832   4.584   4.887
  105    HG1  THR  14           1HG      THR  14  -7.065   3.774   5.976
  106   1HG2  THR  14          1HG2      THR  14  -6.793   6.467   3.674
  107   2HG2  THR  14          2HG2      THR  14  -8.537   6.556   3.423
  108   3HG2  THR  14          3HG2      THR  14  -7.631   5.164   2.831
  109    H    LYS  15           H        LYS  15 -10.193   4.803   6.365
  110    HA   LYS  15           HA       LYS  15 -10.384   4.855   9.257
  111   1HB   LYS  15          1HB       LYS  15 -11.744   3.607   6.915
  112   2HB   LYS  15          2HB       LYS  15 -11.997   2.835   8.480
  113   1HG   LYS  15          1HG       LYS  15 -13.578   4.400   8.866
  114   2HG   LYS  15          2HG       LYS  15 -12.258   5.560   9.022
  115   1HD   LYS  15          1HD       LYS  15 -12.365   6.023   6.607
  116   2HD   LYS  15          2HD       LYS  15 -13.671   4.851   6.433
  117   1HE   LYS  15          1HE       LYS  15 -14.545   6.514   8.502
  118   2HE   LYS  15          2HE       LYS  15 -13.812   7.624   7.326
  119   1HZ   LYS  15          1HZ       LYS  15 -15.918   7.307   6.456
  120   2HZ   LYS  15          2HZ       LYS  15 -15.988   5.674   6.923
  121   3HZ   LYS  15          3HZ       LYS  15 -15.014   6.146   5.612
  122    H    GLN  16           H        GLN  16  -8.862   2.758   6.903
  123    HA   GLN  16           HA       GLN  16  -8.255   0.727   9.005
  124   1HB   GLN  16          1HB       GLN  16  -8.432   0.838   6.021
  125   2HB   GLN  16          2HB       GLN  16  -7.313  -0.331   6.725
  126   1HG   GLN  16          1HG       GLN  16  -8.994  -1.586   7.665
  127   2HG   GLN  16          2HG       GLN  16 -10.037  -0.188   7.920
  128   1HE2  GLN  16          2HE2      GLN  16  -8.812  -2.361   5.340
  129   2HE2  GLN  16          1HE2      GLN  16 -10.130  -2.121   4.297
  130    HA   PRO  17           HA       PRO  17  -4.459   3.327   8.792
  131   1HB   PRO  17          1HB       PRO  17  -3.786   2.913  11.421
  132   2HB   PRO  17          2HB       PRO  17  -4.892   4.194  10.885
  133   1HG   PRO  17          1HG       PRO  17  -5.525   1.500  12.006
  134   2HG   PRO  17          2HG       PRO  17  -6.267   3.070  12.362
  135   1HD   PRO  17          1HD       PRO  17  -7.437   1.290  10.716
  136   2HD   PRO  17          2HD       PRO  17  -7.562   3.044  10.446
  137    H    VAL  18           H        VAL  18  -2.463   2.487   8.282
  138    HA   VAL  18           HA       VAL  18  -1.868  -0.335   9.092
  139    HB   VAL  18           HB       VAL  18  -1.606   1.173   6.486
  140   1HG1  VAL  18          1HG1      VAL  18  -0.397  -1.526   7.136
  141   2HG1  VAL  18          2HG1      VAL  18   0.523  -0.025   7.044
  142   3HG1  VAL  18          3HG1      VAL  18  -0.283  -0.654   5.607
  143   1HG2  VAL  18          1HG2      VAL  18  -3.142  -1.162   7.540
  144   2HG2  VAL  18          2HG2      VAL  18  -2.625  -1.224   5.855
  145   3HG2  VAL  18          3HG2      VAL  18  -3.648   0.098   6.415
  146    H    VAL  19           H        VAL  19   0.184  -0.614   9.961
  147    HA   VAL  19           HA       VAL  19   1.861   1.780  10.347
  148    HB   VAL  19           HB       VAL  19   2.006  -1.103  11.280
  149   1HG1  VAL  19          1HG1      VAL  19   3.687   1.319  11.982
  150   2HG1  VAL  19          2HG1      VAL  19   4.246  -0.210  11.305
  151   3HG1  VAL  19          3HG1      VAL  19   3.642  -0.147  12.961
  152   1HG2  VAL  19          1HG2      VAL  19   0.187   0.725  12.020
  153   2HG2  VAL  19          2HG2      VAL  19   1.503   1.221  13.084
  154   3HG2  VAL  19          3HG2      VAL  19   0.873  -0.424  13.170
  155    H    PHE  20           H        PHE  20   3.470   2.258   8.868
  156    HA   PHE  20           HA       PHE  20   4.478   0.097   7.085
  157   1HB   PHE  20          1HB       PHE  20   3.716   2.228   6.098
  158   2HB   PHE  20          2HB       PHE  20   4.868   3.112   7.094
  159    HD1  PHE  20           HD1      PHE  20   4.870   0.128   4.815
  160    HD2  PHE  20           HD2      PHE  20   6.885   3.706   6.064
  161    HE1  PHE  20           HE1      PHE  20   6.642  -0.273   3.127
  162    HE2  PHE  20           HE2      PHE  20   8.650   3.305   4.379
  163    HZ   PHE  20           HZ       PHE  20   8.533   1.316   2.909
  164    H    ASN  21           H        ASN  21   6.412  -0.866   7.578
  165    HA   ASN  21           HA       ASN  21   8.191   0.463   9.563
  166   1HB   ASN  21          1HB       ASN  21   7.201  -2.174   9.031
  167   2HB   ASN  21          2HB       ASN  21   8.952  -2.187   8.873
  168   1HD2  ASN  21          2HD2      ASN  21   6.613  -0.561  11.096
  169   2HD2  ASN  21          1HD2      ASN  21   7.442  -0.988  12.513
  170    H    HIS  22           H        HIS  22   9.447   1.857   8.229
  171    HA   HIS  22           HA       HIS  22  10.403   1.426   5.639
  172   1HB   HIS  22          1HB       HIS  22  11.427   2.819   8.096
  173   2HB   HIS  22          2HB       HIS  22  12.442   2.769   6.657
  174    HD1  HIS  22           HD1      HIS  22   9.641   4.570   8.148
  175    HD2  HIS  22           HD2      HIS  22  11.018   3.905   4.265
  176    HE1  HIS  22           HE1      HIS  22   8.622   6.382   6.706
  177    H    SER  23           H        SER  23  11.604   0.107   8.699
  178    HA   SER  23           HA       SER  23  14.098  -0.938   7.982
  179   1HB   SER  23          1HB       SER  23  13.566  -1.357  10.181
  180   2HB   SER  23          2HB       SER  23  11.865  -1.634   9.817
  181    HG   SER  23           HG       SER  23  12.755  -3.593  10.352
  182    H    THR  24           H        THR  24  10.871  -2.335   7.376
  183    HA   THR  24           HA       THR  24  11.927  -4.669   5.976
  184    HB   THR  24           HB       THR  24   9.161  -3.942   5.424
  185    HG1  THR  24           1HG      THR  24   8.576  -3.257   7.308
  186   1HG2  THR  24          1HG2      THR  24   9.360  -6.203   5.416
  187   2HG2  THR  24          2HG2      THR  24   9.131  -6.060   7.159
  188   3HG2  THR  24          3HG2      THR  24  10.759  -6.177   6.490
  189    H    HIS  25           H        HIS  25  11.815  -1.454   5.152
  190    HA   HIS  25           HA       HIS  25  11.520  -2.079   2.247
  191   1HB   HIS  25          1HB       HIS  25  10.761   0.374   3.860
  192   2HB   HIS  25          2HB       HIS  25  10.548   0.193   2.122
  193    HD1  HIS  25           HD1      HIS  25   9.233  -1.038   5.407
  194    HD2  HIS  25           HD2      HIS  25   8.478  -1.616   1.349
  195    HE1  HIS  25           HE1      HIS  25   7.070  -2.347   5.261
  196    H    LYS  26           H        LYS  26  13.599  -0.942   4.708
  197    HA   LYS  26           HA       LYS  26  15.125   1.096   3.534
  198   1HB   LYS  26          1HB       LYS  26  16.042  -1.350   5.086
  199   2HB   LYS  26          2HB       LYS  26  16.965   0.142   4.904
  200   1HG   LYS  26          1HG       LYS  26  14.919   1.337   5.897
  201   2HG   LYS  26          2HG       LYS  26  14.357  -0.267   6.366
  202   1HD   LYS  26          1HD       LYS  26  16.955   1.057   7.190
  203   2HD   LYS  26          2HD       LYS  26  15.583   0.675   8.232
  204   1HE   LYS  26          1HE       LYS  26  15.932  -1.715   7.915
  205   2HE   LYS  26          2HE       LYS  26  17.210  -1.403   6.722
  206   1HZ   LYS  26          1HZ       LYS  26  18.199  -1.760   8.881
  207   2HZ   LYS  26          2HZ       LYS  26  17.218  -0.557   9.572
  208   3HZ   LYS  26          3HZ       LYS  26  18.406  -0.138   8.432
  209    H    ALA  27           H        ALA  27  14.977  -2.324   2.738
  210    HA   ALA  27           HA       ALA  27  17.305  -2.235   0.945
  211   1HB   ALA  27          1HB       ALA  27  16.840  -4.266   2.144
  212   2HB   ALA  27          2HB       ALA  27  16.428  -4.587   0.460
  213   3HB   ALA  27          3HB       ALA  27  15.152  -4.254   1.632
  214    H    VAL  28           H        VAL  28  14.138  -1.155   0.738
  215    HA   VAL  28           HA       VAL  28  13.649  -1.889  -2.072
  216    HB   VAL  28           HB       VAL  28  12.272  -0.159  -0.008
  217   1HG1  VAL  28          1HG1      VAL  28  11.400  -0.811  -2.832
  218   2HG1  VAL  28          2HG1      VAL  28  11.816   0.787  -2.210
  219   3HG1  VAL  28          3HG1      VAL  28  10.384  -0.045  -1.611
  220   1HG2  VAL  28          1HG2      VAL  28  10.582  -1.956  -0.081
  221   2HG2  VAL  28          2HG2      VAL  28  12.168  -2.600   0.348
  222   3HG2  VAL  28          3HG2      VAL  28  11.544  -2.808  -1.289
  223    H    LYS  29           H        LYS  29  12.997   0.116  -3.511
  224    HA   LYS  29           HA       LYS  29  15.344   1.909  -3.506
  225   1HB   LYS  29          1HB       LYS  29  13.486   0.787  -5.398
  226   2HB   LYS  29          2HB       LYS  29  13.525   2.545  -5.560
  227   1HG   LYS  29          1HG       LYS  29  15.341   2.081  -6.874
  228   2HG   LYS  29          2HG       LYS  29  16.160   2.087  -5.311
  229   1HD   LYS  29          1HD       LYS  29  15.973  -0.329  -5.142
  230   2HD   LYS  29          2HD       LYS  29  14.993  -0.394  -6.608
  231   1HE   LYS  29          1HE       LYS  29  16.815   0.053  -8.007
  232   2HE   LYS  29          2HE       LYS  29  17.736   0.848  -6.714
  233   1HZ   LYS  29          1HZ       LYS  29  18.158  -1.175  -5.664
  234   2HZ   LYS  29          2HZ       LYS  29  18.381  -1.536  -7.309
  235   3HZ   LYS  29          3HZ       LYS  29  16.947  -1.994  -6.522
  236    H    CYS  30           H        CYS  30  15.087   3.530  -2.072
  237    HA   CYS  30           HA       CYS  30  12.800   4.730  -1.031
  238   1HB   CYS  30          1HB       CYS  30  15.521   5.802  -1.793
  239   2HB   CYS  30          2HB       CYS  30  14.333   6.828  -0.993
  240    H    GLY  31           H        GLY  31  14.102   5.001  -4.256
  241   1HA   GLY  31          1HA       GLY  31  12.385   7.304  -4.932
  242   2HA   GLY  31          2HA       GLY  31  13.513   6.501  -6.026
  243    H    ASP  32           H        ASP  32  12.105   3.904  -4.816
  244    HA   ASP  32           HA       ASP  32  10.245   3.645  -7.066
  245   1HB   ASP  32          1HB       ASP  32  11.799   1.992  -5.418
  246   2HB   ASP  32          2HB       ASP  32  10.138   1.585  -5.004
  247    H    CYS  33           H        CYS  33  10.097   4.122  -3.569
  248    HA   CYS  33           HA       CYS  33   7.130   4.063  -3.564
  249   1HB   CYS  33          1HB       CYS  33   9.370   4.280  -1.550
  250   2HB   CYS  33          2HB       CYS  33   7.730   4.715  -1.079
  251    H    HIS  34           H        HIS  34   9.719   6.340  -2.559
  252    HA   HIS  34           HA       HIS  34   7.892   8.650  -2.864
  253   1HB   HIS  34          1HB       HIS  34  10.800   8.300  -2.048
  254   2HB   HIS  34          2HB       HIS  34   9.975   9.850  -2.075
  255    HD1  HIS  34           HD1      HIS  34   7.594   9.791  -0.578
  256    HD2  HIS  34           HD2      HIS  34  10.591   7.066   0.403
  257    HE1  HIS  34           HE1      HIS  34   7.145   9.050   1.803
  258    H    HIS  35           H        HIS  35   8.301   7.276  -5.290
  259    HA   HIS  35           HA       HIS  35  10.343   7.726  -7.010
  260   1HB   HIS  35          1HB       HIS  35   8.502   8.234  -8.726
  261   2HB   HIS  35          2HB       HIS  35   8.311   6.767  -7.785
  262    HD1  HIS  35           HD1      HIS  35   7.059  10.258  -8.045
  263    HD2  HIS  35           HD2      HIS  35   6.049   6.738  -6.080
  264    HE1  HIS  35           HE1      HIS  35   4.790  10.660  -7.001
  265    HA   PRO  36           HA       PRO  36  11.388  11.912  -7.462
  266   1HB   PRO  36          1HB       PRO  36  11.642  12.191 -10.181
  267   2HB   PRO  36          2HB       PRO  36  12.820  11.329  -9.169
  268   1HG   PRO  36          1HG       PRO  36  10.592  10.231 -10.827
  269   2HG   PRO  36          2HG       PRO  36  12.258   9.651 -10.656
  270   1HD   PRO  36          1HD       PRO  36  10.219   8.481  -9.357
  271   2HD   PRO  36          2HD       PRO  36  11.836   8.621  -8.628
  272    H    VAL  37           H        VAL  37   9.813  13.347  -6.929
  273    HA   VAL  37           HA       VAL  37   7.660  13.917  -8.939
  274    HB   VAL  37           HB       VAL  37   7.728  13.803  -5.924
  275   1HG1  VAL  37          1HG1      VAL  37   5.262  14.672  -6.258
  276   2HG1  VAL  37          2HG1      VAL  37   5.927  15.394  -7.724
  277   3HG1  VAL  37          3HG1      VAL  37   6.591  15.826  -6.148
  278   1HG2  VAL  37          1HG2      VAL  37   6.087  12.541  -8.127
  279   2HG2  VAL  37          2HG2      VAL  37   5.567  12.509  -6.442
  280   3HG2  VAL  37          3HG2      VAL  37   7.082  11.736  -6.913
  281    H    ASN  38           H        ASN  38   7.068  16.212  -9.079
  282    HA   ASN  38           HA       ASN  38   7.710  18.494  -9.287
  283   1HB   ASN  38          1HB       ASN  38   7.146  17.935  -6.833
  284   2HB   ASN  38          2HB       ASN  38   8.869  17.984  -6.556
  285   1HD2  ASN  38          2HD2      ASN  38   8.817  20.140  -8.903
  286   2HD2  ASN  38          1HD2      ASN  38   8.448  21.565  -8.059
  287    H    GLY  39           H        GLY  39   9.844  16.253  -9.844
  288   1HA   GLY  39          1HA       GLY  39  11.990  16.605 -10.863
  289   2HA   GLY  39          2HA       GLY  39  12.120  18.137  -9.994
  290    H    LYS  40           H        LYS  40  10.991  16.301  -7.633
  291    HA   LYS  40           HA       LYS  40  13.569  14.932  -6.972
  292   1HB   LYS  40          1HB       LYS  40  13.380  16.122  -4.699
  293   2HB   LYS  40          2HB       LYS  40  13.878  17.117  -6.068
  294   1HG   LYS  40          1HG       LYS  40  11.519  17.843  -6.368
  295   2HG   LYS  40          2HG       LYS  40  11.070  16.904  -4.945
  296   1HD   LYS  40          1HD       LYS  40  13.321  18.546  -4.273
  297   2HD   LYS  40          2HD       LYS  40  12.093  19.561  -5.030
  298   1HE   LYS  40          1HE       LYS  40  10.683  19.361  -3.252
  299   2HE   LYS  40          2HE       LYS  40  10.997  17.621  -3.096
  300   1HZ   LYS  40          1HZ       LYS  40  12.036  18.516  -1.235
  301   2HZ   LYS  40          2HZ       LYS  40  12.598  19.883  -2.072
  302   3HZ   LYS  40          3HZ       LYS  40  13.313  18.365  -2.340
  303    H    GLU  41           H        GLU  41  13.256  13.114  -5.646
  304    HA   GLU  41           HA       GLU  41  10.653  11.949  -5.443
  305   1HB   GLU  41          1HB       GLU  41  13.326  11.468  -4.121
  306   2HB   GLU  41          2HB       GLU  41  11.927  10.465  -3.747
  307   1HG   GLU  41          1HG       GLU  41  11.799   9.608  -5.927
  308   2HG   GLU  41          2HG       GLU  41  12.719  10.947  -6.611
  309    H    ASP  42           H        ASP  42   9.048  12.857  -4.180
  310    HA   ASP  42           HA       ASP  42   9.562  14.527  -1.891
  311   1HB   ASP  42          1HB       ASP  42   7.177  13.019  -2.961
  312   2HB   ASP  42          2HB       ASP  42   7.081  14.008  -1.505
  313    H    TYR  43           H        TYR  43  10.802  13.510  -0.333
  314    HA   TYR  43           HA       TYR  43  10.300  10.760   0.522
  315   1HB   TYR  43          1HB       TYR  43  12.008  13.008   1.643
  316   2HB   TYR  43          2HB       TYR  43  12.119  11.314   2.124
  317    HD1  TYR  43           HD1      TYR  43  13.259  13.795  -0.181
  318    HD2  TYR  43           HD2      TYR  43  12.540   9.578   0.226
  319    HE1  TYR  43           HE1      TYR  43  14.771  13.351  -2.095
  320    HE2  TYR  43           HE2      TYR  43  14.053   9.136  -1.687
  321    HH   TYR  43           HH       TYR  43  16.255  10.979  -2.753
  322    H    GLN  44           H        GLN  44   7.900  12.024   0.824
  323    HA   GLN  44           HA       GLN  44   7.699  12.452   3.789
  324   1HB   GLN  44          1HB       GLN  44   5.908  14.104   3.217
  325   2HB   GLN  44          2HB       GLN  44   7.480  14.559   2.559
  326   1HG   GLN  44          1HG       GLN  44   6.748  13.325   0.420
  327   2HG   GLN  44          2HG       GLN  44   5.121  13.367   1.099
  328   1HE2  GLN  44          2HE2      GLN  44   5.977  16.059   2.448
  329   2HE2  GLN  44          1HE2      GLN  44   5.791  17.190   1.197
  330    H    LYS  45           H        LYS  45   5.383  12.027   4.554
  331    HA   LYS  45           HA       LYS  45   4.509   9.448   4.196
  332   1HB   LYS  45          1HB       LYS  45   3.188  12.054   4.829
  333   2HB   LYS  45          2HB       LYS  45   2.159  10.639   4.610
  334   1HG   LYS  45          1HG       LYS  45   3.002   9.561   6.468
  335   2HG   LYS  45          2HG       LYS  45   4.579  10.341   6.334
  336   1HD   LYS  45          1HD       LYS  45   3.375  11.218   8.282
  337   2HD   LYS  45          2HD       LYS  45   3.560  12.483   7.067
  338   1HE   LYS  45          1HE       LYS  45   1.138  11.077   6.480
  339   2HE   LYS  45          2HE       LYS  45   1.125  11.504   8.202
  340   1HZ   LYS  45          1HZ       LYS  45   0.471  13.488   7.324
  341   2HZ   LYS  45          2HZ       LYS  45   1.298  13.252   5.858
  342   3HZ   LYS  45          3HZ       LYS  45   2.150  13.715   7.253
  343    H    CYS  46           H        CYS  46   3.392   8.303   2.650
  344    HA   CYS  46           HA       CYS  46   3.298   9.071  -0.043
  345   1HB   CYS  46          1HB       CYS  46   1.507   7.160   1.476
  346   2HB   CYS  46          2HB       CYS  46   1.817   7.116  -0.254
  347    H    ALA  47           H        ALA  47   0.692   9.265   2.374
  348    HA   ALA  47           HA       ALA  47  -1.107  10.583   0.437
  349   1HB   ALA  47          1HB       ALA  47  -2.590   9.565   1.786
  350   2HB   ALA  47          2HB       ALA  47  -2.067  10.587   3.125
  351   3HB   ALA  47          3HB       ALA  47  -1.270   9.042   2.833
  352    H    THR  48           H        THR  48   1.147  12.166   0.830
  353    HA   THR  48           HA       THR  48   1.302  14.003   2.868
  354    HB   THR  48           HB       THR  48   1.408  15.121   0.135
  355    HG1  THR  48           1HG      THR  48   3.105  12.985   0.878
  356   1HG2  THR  48          1HG2      THR  48   3.636  15.777   0.868
  357   2HG2  THR  48          2HG2      THR  48   3.510  14.727   2.279
  358   3HG2  THR  48          3HG2      THR  48   2.474  16.147   2.143
  359    H    ALA  49           H        ALA  49   0.528  16.317   2.828
  360    HA   ALA  49           HA       ALA  49  -2.340  16.444   2.901
  361   1HB   ALA  49          1HB       ALA  49  -0.177  17.896   3.811
  362   2HB   ALA  49          2HB       ALA  49  -1.860  18.398   3.951
  363   3HB   ALA  49          3HB       ALA  49  -0.878  18.971   2.604
  364    H    GLY  50           H        GLY  50  -2.264  15.511   0.508
  365   1HA   GLY  50          1HA       GLY  50  -3.654  16.645  -1.351
  366   2HA   GLY  50          2HA       GLY  50  -2.310  17.788  -1.429
  367    H    CYS  51           H        CYS  51  -1.814  14.386  -0.797
  368    HA   CYS  51           HA       CYS  51  -0.567  14.107  -3.505
  369   1HB   CYS  51          1HB       CYS  51   0.533  14.099  -0.947
  370   2HB   CYS  51          2HB       CYS  51   0.436  12.394  -1.354
  371    H    HIS  52           H        HIS  52  -1.125  11.685  -0.975
  372    HA   HIS  52           HA       HIS  52  -2.975  10.243  -2.837
  373   1HB   HIS  52          1HB       HIS  52  -0.850   9.322  -0.901
  374   2HB   HIS  52          2HB       HIS  52  -2.040   8.228  -1.556
  375    HD1  HIS  52           HD1      HIS  52  -2.187   8.848  -4.394
  376    HD2  HIS  52           HD2      HIS  52   1.445   9.000  -2.387
  377    HE1  HIS  52           HE1      HIS  52  -0.389   8.501  -6.155
  378    H    ASP  53           H        ASP  53  -3.475  12.253  -0.620
  379    HA   ASP  53           HA       ASP  53  -4.655  10.663   1.559
  380   1HB   ASP  53          1HB       ASP  53  -3.404  12.889   1.726
  381   2HB   ASP  53          2HB       ASP  53  -4.844  13.634   1.033
  382    H    ASN  54           H        ASN  54  -5.785  10.551  -1.292
  383    HA   ASN  54           HA       ASN  54  -8.373  11.909  -1.081
  384   1HB   ASN  54          1HB       ASN  54  -8.255  11.568  -3.309
  385   2HB   ASN  54          2HB       ASN  54  -6.713  10.766  -3.060
  386   1HD2  ASN  54          2HD2      ASN  54  -9.624  10.305  -4.521
  387   2HD2  ASN  54          1HD2      ASN  54  -9.736   8.613  -4.441
  388    H    MET  55           H        MET  55  -9.837  11.117   0.372
  389    HA   MET  55           HA       MET  55  -9.774   8.318   1.237
  390   1HB   MET  55          1HB       MET  55 -11.663  10.619   1.834
  391   2HB   MET  55          2HB       MET  55 -11.539   9.123   2.756
  392   1HG   MET  55          1HG       MET  55  -9.278  11.101   2.358
  393   2HG   MET  55          2HG       MET  55 -10.263  10.974   3.816
  394   1HE   MET  55          1HE       MET  55  -7.049  10.434   2.613
  395   2HE   MET  55          2HE       MET  55  -7.689   9.267   1.459
  396   3HE   MET  55          3HE       MET  55  -6.582   8.732   2.719
  397    H    ASP  56           H        ASP  56 -10.668   9.249  -1.616
  398    HA   ASP  56           HA       ASP  56 -13.488   8.471  -1.744
  399   1HB   ASP  56          1HB       ASP  56 -11.776   9.957  -3.265
  400   2HB   ASP  56          2HB       ASP  56 -11.770   8.439  -4.163
  401    H    LYS  57           H        LYS  57 -10.503   6.827  -1.571
  402    HA   LYS  57           HA       LYS  57  -9.875   4.586  -2.017
  403   1HB   LYS  57          1HB       LYS  57 -12.806   4.193  -1.356
  404   2HB   LYS  57          2HB       LYS  57 -11.490   3.063  -1.055
  405   1HG   LYS  57          1HG       LYS  57 -10.708   4.241   0.761
  406   2HG   LYS  57          2HG       LYS  57 -11.231   5.794   0.112
  407   1HD   LYS  57          1HD       LYS  57 -12.573   5.070   2.093
  408   2HD   LYS  57          2HD       LYS  57 -13.553   5.288   0.642
  409   1HE   LYS  57          1HE       LYS  57 -12.893   2.671   0.350
  410   2HE   LYS  57          2HE       LYS  57 -12.913   2.793   2.121
  411   1HZ   LYS  57          1HZ       LYS  57 -15.044   4.195   1.648
  412   2HZ   LYS  57          2HZ       LYS  57 -15.132   2.498   1.695
  413   3HZ   LYS  57          3HZ       LYS  57 -15.078   3.308   0.202
  414    H    LYS  58           H        LYS  58 -11.161   6.208  -4.285
  415    HA   LYS  58           HA       LYS  58 -11.761   3.863  -6.035
  416   1HB   LYS  58          1HB       LYS  58 -13.733   4.929  -6.848
  417   2HB   LYS  58          2HB       LYS  58 -13.796   5.122  -5.097
  418   1HG   LYS  58          1HG       LYS  58 -14.129   7.320  -5.587
  419   2HG   LYS  58          2HG       LYS  58 -12.379   7.344  -5.807
  420   1HD   LYS  58          1HD       LYS  58 -12.573   7.673  -8.031
  421   2HD   LYS  58          2HD       LYS  58 -13.760   6.377  -8.187
  422   1HE   LYS  58          1HE       LYS  58 -15.577   7.831  -7.662
  423   2HE   LYS  58          2HE       LYS  58 -14.486   9.093  -7.056
  424   1HZ   LYS  58          1HZ       LYS  58 -15.383   9.169  -9.507
  425   2HZ   LYS  58          2HZ       LYS  58 -14.092   8.100  -9.785
  426   3HZ   LYS  58          3HZ       LYS  58 -13.797   9.646  -9.145
  427    H    ASP  59           H        ASP  59 -10.549   7.147  -5.670
  428    HA   ASP  59           HA       ASP  59 -10.127   7.960  -8.316
  429   1HB   ASP  59          1HB       ASP  59  -9.606   9.411  -6.494
  430   2HB   ASP  59          2HB       ASP  59  -8.509   8.230  -5.775
  431    H    LYS  60           H        LYS  60  -9.435   6.433  -9.832
  432    HA   LYS  60           HA       LYS  60  -7.208   4.601  -9.208
  433   1HB   LYS  60          1HB       LYS  60  -9.342   4.951 -11.205
  434   2HB   LYS  60          2HB       LYS  60  -7.824   4.369 -11.891
  435   1HG   LYS  60          1HG       LYS  60  -8.939   3.123  -9.387
  436   2HG   LYS  60          2HG       LYS  60  -9.520   2.615 -10.974
  437   1HD   LYS  60          1HD       LYS  60  -6.570   2.796 -10.633
  438   2HD   LYS  60          2HD       LYS  60  -7.384   1.479  -9.789
  439   1HE   LYS  60          1HE       LYS  60  -8.189   0.524 -11.794
  440   2HE   LYS  60          2HE       LYS  60  -7.950   2.027 -12.708
  441   1HZ   LYS  60          1HZ       LYS  60  -5.836   0.293 -11.543
  442   2HZ   LYS  60          2HZ       LYS  60  -5.546   1.822 -12.224
  443   3HZ   LYS  60          3HZ       LYS  60  -6.137   0.556 -13.192
  444    H    SER  61           H        SER  61  -6.706   7.550  -9.294
  445    HA   SER  61           HA       SER  61  -4.892   7.708 -11.673
  446   1HB   SER  61          1HB       SER  61  -6.706   9.520 -10.264
  447   2HB   SER  61          2HB       SER  61  -5.108  10.224 -10.495
  448    HG   SER  61           HG       SER  61  -5.310   9.607 -12.725
  449    H    ALA  62           H        ALA  62  -3.278   9.805 -10.656
  450    HA   ALA  62           HA       ALA  62  -1.596   8.281  -8.740
  451   1HB   ALA  62          1HB       ALA  62  -0.570  10.834  -9.666
  452   2HB   ALA  62          2HB       ALA  62  -1.191   9.884 -11.016
  453   3HB   ALA  62          3HB       ALA  62   0.056   9.214  -9.967
  454    H    LYS  63           H        LYS  63  -4.112   9.754  -7.904
  455    HA   LYS  63           HA       LYS  63  -2.824  11.467  -5.816
  456   1HB   LYS  63          1HB       LYS  63  -4.049  12.495  -7.999
  457   2HB   LYS  63          2HB       LYS  63  -5.451  12.291  -6.944
  458   1HG   LYS  63          1HG       LYS  63  -3.119  13.444  -5.576
  459   2HG   LYS  63          2HG       LYS  63  -3.731  14.451  -6.888
  460   1HD   LYS  63          1HD       LYS  63  -5.919  13.353  -5.331
  461   2HD   LYS  63          2HD       LYS  63  -4.800  14.246  -4.300
  462   1HE   LYS  63          1HE       LYS  63  -4.971  16.213  -5.751
  463   2HE   LYS  63          2HE       LYS  63  -6.023  15.320  -6.868
  464   1HZ   LYS  63          1HZ       LYS  63  -7.458  16.471  -5.409
  465   2HZ   LYS  63          2HZ       LYS  63  -6.559  16.025  -4.037
  466   3HZ   LYS  63          3HZ       LYS  63  -7.466  14.860  -4.879
  467    H    GLY  64           H        GLY  64  -4.162   8.687  -5.955
  468   1HA   GLY  64          1HA       GLY  64  -6.175   9.245  -3.821
  469   2HA   GLY  64          2HA       GLY  64  -6.437   7.993  -5.026
  470    H    TYR  65           H        TYR  65  -5.746   8.265  -1.928
  471    HA   TYR  65           HA       TYR  65  -3.391   6.860  -1.320
  472   1HB   TYR  65          1HB       TYR  65  -5.505   7.891   0.013
  473   2HB   TYR  65          2HB       TYR  65  -5.928   6.184   0.112
  474    HD1  TYR  65           HD1      TYR  65  -2.467   7.545  -0.002
  475    HD2  TYR  65           HD2      TYR  65  -5.549   5.827   2.444
  476    HE1  TYR  65           HE1      TYR  65  -0.838   7.255   1.844
  477    HE2  TYR  65           HE2      TYR  65  -3.922   5.537   4.289
  478    HH   TYR  65           HH       TYR  65  -1.512   5.348   4.601
  479    H    TYR  66           H        TYR  66  -6.624   5.350  -1.447
  480    HA   TYR  66           HA       TYR  66  -6.073   2.679  -1.455
  481   1HB   TYR  66          1HB       TYR  66  -8.198   4.225  -1.901
  482   2HB   TYR  66          2HB       TYR  66  -7.911   3.717  -3.564
  483    HD1  TYR  66           HD1      TYR  66  -9.075   2.743  -0.287
  484    HD2  TYR  66           HD2      TYR  66  -7.847   1.265  -4.120
  485    HE1  TYR  66           HE1      TYR  66 -10.156   0.560   0.206
  486    HE2  TYR  66           HE2      TYR  66  -8.918  -0.918  -3.631
  487    HH   TYR  66           HH       TYR  66 -10.789  -1.748  -2.136
  488    H    HIS  67           H        HIS  67  -6.509   4.319  -4.600
  489    HA   HIS  67           HA       HIS  67  -5.659   2.412  -6.344
  490   1HB   HIS  67          1HB       HIS  67  -6.356   4.587  -7.079
  491   2HB   HIS  67          2HB       HIS  67  -4.984   5.359  -6.277
  492    HD1  HIS  67           HD1      HIS  67  -5.586   2.732  -8.968
  493    HD2  HIS  67           HD2      HIS  67  -2.788   5.644  -7.941
  494    HE1  HIS  67           HE1      HIS  67  -3.806   2.673 -10.761
  495    H    ALA  68           H        ALA  68  -3.208   4.865  -5.675
  496    HA   ALA  68           HA       ALA  68  -0.958   3.433  -6.399
  497   1HB   ALA  68          1HB       ALA  68  -1.272   5.351  -4.064
  498   2HB   ALA  68          2HB       ALA  68  -1.061   5.819  -5.752
  499   3HB   ALA  68          3HB       ALA  68   0.241   4.991  -4.896
  500    H    MET  69           H        MET  69  -2.868   2.956  -3.488
  501    HA   MET  69           HA       MET  69  -0.748   1.387  -2.171
  502   1HB   MET  69          1HB       MET  69  -3.612   2.072  -1.489
  503   2HB   MET  69          2HB       MET  69  -2.499   1.242  -0.405
  504   1HG   MET  69          1HG       MET  69  -1.341   3.666  -1.557
  505   2HG   MET  69          2HG       MET  69  -2.795   3.992  -0.615
  506   1HE   MET  69          1HE       MET  69   0.335   4.309  -0.779
  507   2HE   MET  69          2HE       MET  69   1.277   3.636   0.549
  508   3HE   MET  69          3HE       MET  69   0.289   5.069   0.819
  509    H    HIS  70           H        HIS  70  -3.835   0.739  -3.844
  510    HA   HIS  70           HA       HIS  70  -3.377  -2.167  -3.327
  511   1HB   HIS  70          1HB       HIS  70  -5.845  -0.663  -4.245
  512   2HB   HIS  70          2HB       HIS  70  -5.779  -2.360  -3.765
  513    HD1  HIS  70           HD1      HIS  70  -5.863   1.096  -2.389
  514    HD2  HIS  70           HD2      HIS  70  -5.341  -2.773  -0.941
  515    HE1  HIS  70           HE1      HIS  70  -6.072   1.243   0.131
  516    H    ASP  71           H        ASP  71  -3.155   0.196  -5.800
  517    HA   ASP  71           HA       ASP  71  -3.771  -1.631  -8.020
  518   1HB   ASP  71          1HB       ASP  71  -2.766   1.193  -7.686
  519   2HB   ASP  71          2HB       ASP  71  -2.840   0.436  -9.275
  520    H    LYS  72           H        LYS  72  -2.141  -2.190  -9.655
  521    HA   LYS  72           HA       LYS  72   0.591  -2.520  -8.471
  522   1HB   LYS  72          1HB       LYS  72  -0.766  -4.134 -10.646
  523   2HB   LYS  72          2HB       LYS  72   0.683  -4.571  -9.741
  524   1HG   LYS  72          1HG       LYS  72  -0.647  -5.627  -8.262
  525   2HG   LYS  72          2HG       LYS  72  -1.280  -4.048  -7.793
  526   1HD   LYS  72          1HD       LYS  72  -3.117  -5.545  -8.451
  527   2HD   LYS  72          2HD       LYS  72  -2.976  -4.206  -9.590
  528   1HE   LYS  72          1HE       LYS  72  -2.992  -5.875 -11.166
  529   2HE   LYS  72          2HE       LYS  72  -1.284  -6.057 -10.720
  530   1HZ   LYS  72          1HZ       LYS  72  -2.910  -8.075 -10.515
  531   2HZ   LYS  72          2HZ       LYS  72  -3.335  -7.330  -9.048
  532   3HZ   LYS  72          3HZ       LYS  72  -1.727  -7.803  -9.329
  533    H    GLY  73           H        GLY  73  -0.993  -2.299 -11.668
  534   1HA   GLY  73          1HA       GLY  73   1.397  -1.423 -13.019
  535   2HA   GLY  73          2HA       GLY  73  -0.240  -1.316 -13.670
  536    H    THR  74           H        THR  74   1.557   0.188 -10.967
  537    HA   THR  74           HA       THR  74   0.240   2.785 -11.623
  538    HB   THR  74           HB       THR  74   1.336   3.254  -9.284
  539    HG1  THR  74           1HG      THR  74   1.167   0.474  -9.047
  540   1HG2  THR  74          1HG2      THR  74  -1.039   3.062  -9.454
  541   2HG2  THR  74          2HG2      THR  74  -0.555   1.942  -8.180
  542   3HG2  THR  74          3HG2      THR  74  -0.943   1.333  -9.790
  543    H    LYS  75           H        LYS  75   1.626   4.741 -11.552
  544    HA   LYS  75           HA       LYS  75   3.799   4.892 -13.216
  545   1HB   LYS  75          1HB       LYS  75   2.495   6.602 -11.614
  546   2HB   LYS  75          2HB       LYS  75   3.938   6.397 -10.628
  547   1HG   LYS  75          1HG       LYS  75   4.154   8.304 -12.208
  548   2HG   LYS  75          2HG       LYS  75   5.356   7.053 -12.515
  549   1HD   LYS  75          1HD       LYS  75   3.026   6.383 -14.013
  550   2HD   LYS  75          2HD       LYS  75   3.378   8.087 -14.309
  551   1HE   LYS  75          1HE       LYS  75   5.703   6.210 -14.340
  552   2HE   LYS  75          2HE       LYS  75   4.589   6.154 -15.721
  553   1HZ   LYS  75          1HZ       LYS  75   6.307   7.853 -16.026
  554   2HZ   LYS  75          2HZ       LYS  75   5.804   8.624 -14.598
  555   3HZ   LYS  75          3HZ       LYS  75   4.761   8.545 -15.937
  556    H    PHE  76           H        PHE  76   3.798   3.760  -9.878
  557    HA   PHE  76           HA       PHE  76   6.585   2.736 -10.250
  558   1HB   PHE  76          1HB       PHE  76   5.522   4.241  -7.843
  559   2HB   PHE  76          2HB       PHE  76   7.152   3.611  -8.036
  560    HD1  PHE  76           HD1      PHE  76   8.517   4.470 -10.072
  561    HD2  PHE  76           HD2      PHE  76   4.945   6.359  -8.619
  562    HE1  PHE  76           HE1      PHE  76   9.131   6.555 -11.267
  563    HE2  PHE  76           HE2      PHE  76   5.558   8.441  -9.810
  564    HZ   PHE  76           HZ       PHE  76   7.646   8.534 -11.132
  565    H    LYS  77           H        LYS  77   7.094   1.195  -8.279
  566    HA   LYS  77           HA       LYS  77   4.971  -0.763  -8.138
  567   1HB   LYS  77          1HB       LYS  77   6.523  -1.861  -6.553
  568   2HB   LYS  77          2HB       LYS  77   7.338  -1.368  -8.034
  569   1HG   LYS  77          1HG       LYS  77   8.047   0.739  -6.836
  570   2HG   LYS  77          2HG       LYS  77   7.404   0.035  -5.353
  571   1HD   LYS  77          1HD       LYS  77   9.863  -0.363  -5.635
  572   2HD   LYS  77          2HD       LYS  77   8.928  -1.854  -5.531
  573   1HE   LYS  77          1HE       LYS  77   9.023  -2.183  -7.920
  574   2HE   LYS  77          2HE       LYS  77   9.730  -0.574  -8.165
  575   1HZ   LYS  77          1HZ       LYS  77  10.934  -2.872  -6.722
  576   2HZ   LYS  77          2HZ       LYS  77  11.551  -1.292  -6.635
  577   3HZ   LYS  77          3HZ       LYS  77  11.521  -2.114  -8.121
  578    H    SER  78           H        SER  78   3.220  -0.393  -7.015
  579    HA   SER  78           HA       SER  78   3.006   1.536  -4.852
  580   1HB   SER  78          1HB       SER  78   0.669   0.097  -4.935
  581   2HB   SER  78          2HB       SER  78   1.038   1.461  -5.985
  582    HG   SER  78           HG       SER  78   0.578  -1.002  -6.705
  583    H    CYS  79           H        CYS  79   1.545   0.651  -2.901
  584    HA   CYS  79           HA       CYS  79   3.191  -0.997  -1.253
  585   1HB   CYS  79          1HB       CYS  79   0.263  -0.213  -1.140
  586   2HB   CYS  79          2HB       CYS  79   1.142  -0.928   0.207
  587    H    VAL  80           H        VAL  80  -0.134  -1.791  -2.294
  588    HA   VAL  80           HA       VAL  80   0.208  -4.634  -1.905
  589    HB   VAL  80           HB       VAL  80  -1.774  -2.860  -3.335
  590   1HG1  VAL  80          1HG1      VAL  80  -1.999  -4.849  -4.569
  591   2HG1  VAL  80          2HG1      VAL  80  -3.197  -5.037  -3.288
  592   3HG1  VAL  80          3HG1      VAL  80  -1.643  -5.863  -3.171
  593   1HG2  VAL  80          1HG2      VAL  80  -2.898  -2.862  -1.355
  594   2HG2  VAL  80          2HG2      VAL  80  -1.388  -3.445  -0.654
  595   3HG2  VAL  80          3HG2      VAL  80  -2.643  -4.592  -1.120
  596    H    GLY  81           H        GLY  81   0.708  -2.438  -4.607
  597   1HA   GLY  81          1HA       GLY  81   0.825  -4.419  -6.693
  598   2HA   GLY  81          2HA       GLY  81   1.527  -2.801  -6.780
  599    H    CYS  82           H        CYS  82   3.285  -2.958  -4.578
  600    HA   CYS  82           HA       CYS  82   5.485  -4.494  -5.753
  601   1HB   CYS  82          1HB       CYS  82   5.447  -2.205  -4.475
  602   2HB   CYS  82          2HB       CYS  82   5.432  -3.201  -3.024
  603    H    HIS  83           H        HIS  83   3.024  -4.950  -3.411
  604    HA   HIS  83           HA       HIS  83   4.335  -7.018  -1.837
  605   1HB   HIS  83          1HB       HIS  83   1.672  -5.691  -2.116
  606   2HB   HIS  83          2HB       HIS  83   1.729  -7.220  -1.261
  607    HD1  HIS  83           HD1      HIS  83   1.240  -5.931   1.002
  608    HD2  HIS  83           HD2      HIS  83   4.821  -4.883  -0.859
  609    HE1  HIS  83           HE1      HIS  83   2.599  -4.674   2.726
  610    H    LEU  84           H        LEU  84   1.514  -7.128  -4.082
  611    HA   LEU  84           HA       LEU  84   1.270  -9.900  -4.348
  612   1HB   LEU  84          1HB       LEU  84   0.321  -7.521  -5.498
  613   2HB   LEU  84          2HB       LEU  84   0.958  -8.452  -6.848
  614    HG   LEU  84           HG       LEU  84  -0.765  -9.799  -4.800
  615   1HD1  LEU  84          1HD1      LEU  84  -1.921  -8.477  -7.254
  616   2HD1  LEU  84          2HD1      LEU  84  -1.833  -7.623  -5.713
  617   3HD1  LEU  84          3HD1      LEU  84  -2.772  -9.111  -5.845
  618   1HD2  LEU  84          1HD2      LEU  84  -0.204 -10.173  -7.757
  619   2HD2  LEU  84          2HD2      LEU  84  -1.396 -11.116  -6.864
  620   3HD2  LEU  84          3HD2      LEU  84   0.311 -11.222  -6.436
  621    H    GLU  85           H        GLU  85   3.701  -7.741  -5.671
  622    HA   GLU  85           HA       GLU  85   4.770  -9.818  -7.494
  623   1HB   GLU  85          1HB       GLU  85   5.331  -6.917  -6.871
  624   2HB   GLU  85          2HB       GLU  85   6.437  -7.857  -7.872
  625   1HG   GLU  85          1HG       GLU  85   3.536  -8.011  -8.539
  626   2HG   GLU  85          2HG       GLU  85   4.374  -6.510  -8.929
  627    H    THR  86           H        THR  86   5.710  -8.053  -4.537
  628    HA   THR  86           HA       THR  86   8.315  -9.248  -4.265
  629    HB   THR  86           HB       THR  86   6.341  -7.791  -2.527
  630    HG1  THR  86           1HG      THR  86   7.819  -6.745  -3.979
  631   1HG2  THR  86          1HG2      THR  86   8.951  -8.969  -1.532
  632   2HG2  THR  86          2HG2      THR  86   7.349  -9.561  -1.093
  633   3HG2  THR  86          3HG2      THR  86   7.851  -7.939  -0.613
  634    H    ALA  87           H        ALA  87   5.237 -10.615  -4.047
  635    HA   ALA  87           HA       ALA  87   5.883 -12.565  -1.930
  636   1HB   ALA  87          1HB       ALA  87   3.611 -12.875  -1.926
  637   2HB   ALA  87          2HB       ALA  87   3.524 -12.917  -3.686
  638   3HB   ALA  87          3HB       ALA  87   3.601 -11.369  -2.845
  639    H    GLY  88           H        GLY  88   5.716 -12.396  -5.448
  640   1HA   GLY  88          1HA       GLY  88   6.294 -13.962  -7.099
  641   2HA   GLY  88          2HA       GLY  88   7.468 -14.549  -5.921
  642    H    ALA  89           H        ALA  89   3.997 -14.783  -6.736
  643    HA   ALA  89           HA       ALA  89   2.464 -16.544  -6.260
  644   1HB   ALA  89          1HB       ALA  89   4.393 -18.607  -6.875
  645   2HB   ALA  89          2HB       ALA  89   4.626 -17.216  -7.933
  646   3HB   ALA  89          3HB       ALA  89   3.056 -18.016  -7.860
  647    H    ASP  90           H        ASP  90   3.304 -15.817  -3.837
  648    HA   ASP  90           HA       ASP  90   4.029 -18.368  -2.465
  649   1HB   ASP  90          1HB       ASP  90   5.878 -16.774  -2.502
  650   2HB   ASP  90          2HB       ASP  90   4.834 -15.507  -1.869
  651    H    ALA  91           H        ALA  91   1.729 -18.688  -2.224
  652    HA   ALA  91           HA       ALA  91  -0.305 -17.110  -1.319
  653   1HB   ALA  91          1HB       ALA  91  -1.211 -19.110  -0.309
  654   2HB   ALA  91          2HB       ALA  91   0.404 -19.776  -0.062
  655   3HB   ALA  91          3HB       ALA  91  -0.245 -19.618  -1.695
  656    H    ALA  92           H        ALA  92   2.518 -18.042   0.562
  657    HA   ALA  92           HA       ALA  92   1.463 -17.119   3.123
  658   1HB   ALA  92          1HB       ALA  92   4.369 -17.150   2.792
  659   2HB   ALA  92          2HB       ALA  92   3.622 -18.619   2.163
  660   3HB   ALA  92          3HB       ALA  92   3.362 -18.147   3.843
  661    H    LYS  93           H        LYS  93   3.670 -15.851   0.656
  662    HA   LYS  93           HA       LYS  93   4.007 -13.272   1.974
  663   1HB   LYS  93          1HB       LYS  93   4.851 -14.722  -0.473
  664   2HB   LYS  93          2HB       LYS  93   4.853 -12.967  -0.594
  665   1HG   LYS  93          1HG       LYS  93   6.203 -12.881   1.515
  666   2HG   LYS  93          2HG       LYS  93   6.280 -14.645   1.484
  667   1HD   LYS  93          1HD       LYS  93   7.324 -14.511  -0.786
  668   2HD   LYS  93          2HD       LYS  93   7.357 -12.754  -0.630
  669   1HE   LYS  93          1HE       LYS  93   9.340 -12.951   0.449
  670   2HE   LYS  93          2HE       LYS  93   8.493 -13.796   1.760
  671   1HZ   LYS  93          1HZ       LYS  93   9.660 -14.981  -0.698
  672   2HZ   LYS  93          2HZ       LYS  93   8.593 -15.824   0.320
  673   3HZ   LYS  93          3HZ       LYS  93  10.097 -15.301   0.908
  674    H    LYS  94           H        LYS  94   1.831 -14.689  -0.388
  675    HA   LYS  94           HA       LYS  94   0.816 -12.157  -1.424
  676   1HB   LYS  94          1HB       LYS  94   0.471 -15.026  -1.782
  677   2HB   LYS  94          2HB       LYS  94  -1.085 -14.194  -1.792
  678   1HG   LYS  94          1HG       LYS  94   0.398 -12.500  -3.330
  679   2HG   LYS  94          2HG       LYS  94   1.143 -14.048  -3.734
  680   1HD   LYS  94          1HD       LYS  94  -1.710 -14.379  -3.663
  681   2HD   LYS  94          2HD       LYS  94  -1.317 -13.007  -4.700
  682   1HE   LYS  94          1HE       LYS  94   0.238 -14.387  -6.000
  683   2HE   LYS  94          2HE       LYS  94  -0.058 -15.767  -4.922
  684   1HZ   LYS  94          1HZ       LYS  94  -1.479 -15.420  -7.095
  685   2HZ   LYS  94          2HZ       LYS  94  -2.372 -14.395  -6.076
  686   3HZ   LYS  94          3HZ       LYS  94  -2.177 -16.034  -5.676
  687    H    LYS  95           H        LYS  95   0.131 -14.225   1.309
  688    HA   LYS  95           HA       LYS  95  -2.454 -12.939   1.910
  689   1HB   LYS  95          1HB       LYS  95  -2.570 -14.604   3.597
  690   2HB   LYS  95          2HB       LYS  95  -1.681 -15.391   2.294
  691   1HG   LYS  95          1HG       LYS  95  -0.074 -15.819   3.820
  692   2HG   LYS  95          2HG       LYS  95   0.303 -14.098   3.755
  693   1HD   LYS  95          1HD       LYS  95  -1.348 -13.679   5.556
  694   2HD   LYS  95          2HD       LYS  95  -1.674 -15.411   5.643
  695   1HE   LYS  95          1HE       LYS  95   1.115 -15.243   5.811
  696   2HE   LYS  95          2HE       LYS  95   0.527 -13.908   6.823
  697   1HZ   LYS  95          1HZ       LYS  95   0.264 -15.604   8.293
  698   2HZ   LYS  95          2HZ       LYS  95   0.059 -16.783   7.086
  699   3HZ   LYS  95          3HZ       LYS  95  -1.224 -15.745   7.492
  700    H    GLU  96           H        GLU  96   0.897 -12.502   2.607
  701    HA   GLU  96           HA       GLU  96   0.375 -10.811   4.999
  702   1HB   GLU  96          1HB       GLU  96   2.778 -11.001   5.267
  703   2HB   GLU  96          2HB       GLU  96   2.166 -12.591   4.848
  704   1HG   GLU  96          1HG       GLU  96   2.821 -12.271   2.542
  705   2HG   GLU  96          2HG       GLU  96   3.337 -10.621   2.886
  706    H    LEU  97           H        LEU  97   1.842 -10.662   1.789
  707    HA   LEU  97           HA       LEU  97   2.354  -7.790   1.896
  708   1HB   LEU  97          1HB       LEU  97   2.319  -9.780  -0.383
  709   2HB   LEU  97          2HB       LEU  97   3.087  -8.192  -0.408
  710    HG   LEU  97           HG       LEU  97   3.857 -10.610   1.222
  711   1HD1  LEU  97          1HD1      LEU  97   5.261  -8.759  -0.707
  712   2HD1  LEU  97          2HD1      LEU  97   4.906 -10.473  -0.929
  713   3HD1  LEU  97          3HD1      LEU  97   6.103  -9.967   0.264
  714   1HD2  LEU  97          1HD2      LEU  97   3.788  -8.695   2.764
  715   2HD2  LEU  97          2HD2      LEU  97   4.723  -7.727   1.624
  716   3HD2  LEU  97          3HD2      LEU  97   5.462  -9.123   2.408
  717    H    THR  98           H        THR  98   0.194  -9.754  -0.183
  718    HA   THR  98           HA       THR  98  -1.393  -7.308  -0.747
  719    HB   THR  98           HB       THR  98  -2.394  -8.768  -2.479
  720    HG1  THR  98           1HG      THR  98  -1.930 -10.864  -2.546
  721   1HG2  THR  98          1HG2      THR  98   0.241  -7.829  -2.321
  722   2HG2  THR  98          2HG2      THR  98  -0.626  -8.283  -3.788
  723   3HG2  THR  98          3HG2      THR  98   0.382  -9.468  -2.954
  724    H    GLY  99           H        GLY  99  -1.483  -9.933   1.414
  725   1HA   GLY  99          1HA       GLY  99  -4.236 -10.577   1.516
  726   2HA   GLY  99          2HA       GLY  99  -3.155 -10.634   2.909
  727    H    CYS 100           H        CYS 100  -5.920  -9.220   1.827
  728    HA   CYS 100           HA       CYS 100  -5.531  -6.514   2.853
  729   1HB   CYS 100          1HB       CYS 100  -8.249  -7.600   2.611
  730   2HB   CYS 100          2HB       CYS 100  -7.576  -6.144   1.930
  731    H    LYS 101           H        LYS 101  -7.766  -9.096   3.893
  732    HA   LYS 101           HA       LYS 101  -7.823  -7.836   6.575
  733   1HB   LYS 101          1HB       LYS 101  -9.440  -9.993   5.199
  734   2HB   LYS 101          2HB       LYS 101  -9.757  -9.435   6.843
  735   1HG   LYS 101          1HG       LYS 101 -10.465  -7.332   6.140
  736   2HG   LYS 101          2HG       LYS 101  -9.548  -7.415   4.635
  737   1HD   LYS 101          1HD       LYS 101 -11.930  -7.662   4.148
  738   2HD   LYS 101          2HD       LYS 101 -11.103  -9.187   3.825
  739   1HE   LYS 101          1HE       LYS 101 -11.824  -9.312   6.547
  740   2HE   LYS 101          2HE       LYS 101 -13.246  -8.663   5.705
  741   1HZ   LYS 101          1HZ       LYS 101 -13.125 -10.423   4.107
  742   2HZ   LYS 101          2HZ       LYS 101 -13.126 -11.123   5.656
  743   3HZ   LYS 101          3HZ       LYS 101 -11.678 -11.007   4.772
  744    H    GLY 102           H        GLY 102  -5.614  -9.779   5.432
  745   1HA   GLY 102          1HA       GLY 102  -5.256 -11.191   7.972
  746   2HA   GLY 102          2HA       GLY 102  -5.566 -12.262   6.607
  747    H    SER 103           H        SER 103  -3.679  -9.231   6.668
  748    HA   SER 103           HA       SER 103  -1.287 -10.841   5.883
  749   1HB   SER 103          1HB       SER 103  -0.935  -9.311   4.161
  750   2HB   SER 103          2HB       SER 103  -2.676  -9.461   4.176
  751    HG   SER 103           HG       SER 103  -2.323  -7.313   4.225
  752    H    LYS 104           H        LYS 104   0.231  -8.353   5.648
  753    HA   LYS 104           HA       LYS 104   0.819  -7.884   8.540
  754   1HB   LYS 104          1HB       LYS 104   2.276  -7.482   5.912
  755   2HB   LYS 104          2HB       LYS 104   2.935  -6.969   7.463
  756   1HG   LYS 104          1HG       LYS 104   1.959  -9.777   7.302
  757   2HG   LYS 104          2HG       LYS 104   3.442  -9.403   6.422
  758   1HD   LYS 104          1HD       LYS 104   3.844  -8.121   8.834
  759   2HD   LYS 104          2HD       LYS 104   2.984  -9.583   9.317
  760   1HE   LYS 104          1HE       LYS 104   4.706 -10.727   7.620
  761   2HE   LYS 104          2HE       LYS 104   5.681  -9.308   8.055
  762   1HZ   LYS 104          1HZ       LYS 104   4.748  -9.930  10.432
  763   2HZ   LYS 104          2HZ       LYS 104   6.174 -10.624   9.825
  764   3HZ   LYS 104          3HZ       LYS 104   4.710 -11.483   9.751
  765    H    CYS 105           H        CYS 105  -0.212  -6.445   5.579
  766    HA   CYS 105           HA       CYS 105   0.197  -3.673   6.344
  767   1HB   CYS 105          1HB       CYS 105  -0.203  -5.202   4.067
  768   2HB   CYS 105          2HB       CYS 105  -1.714  -4.346   4.238
  769    H    HIS 106           H        HIS 106  -2.392  -6.028   6.676
  770    HA   HIS 106           HA       HIS 106  -4.125  -3.873   7.851
  771   1HB   HIS 106          1HB       HIS 106  -4.620  -6.125   5.950
  772   2HB   HIS 106          2HB       HIS 106  -5.920  -5.689   7.060
  773    HD1  HIS 106           HD1      HIS 106  -5.148  -2.587   7.087
  774    HD2  HIS 106           HD2      HIS 106  -5.879  -4.906   3.680
  775    HE1  HIS 106           HE1      HIS 106  -5.696  -0.965   5.229
  776    H    SER 107           H        SER 107  -2.553  -4.884   9.706
  777    HA   SER 107           HA       SER 107  -3.045  -7.426  10.837
  778   1HB   SER 107          1HB       SER 107  -2.642  -4.929  12.473
  779   2HB   SER 107          2HB       SER 107  -1.932  -6.524  12.707
  780    HG   SER 107           HG       SER 107  -0.555  -6.160  11.059
  781    HHA  HEC 201           HHA      HEC 201   6.109   8.690   5.715
  782    HHB  HEC 201           HHB      HEC 201  12.210   9.763   4.744
  783    HHC  HEC 201           HHC      HEC 201  12.544   4.624   1.041
  784    HHD  HEC 201           HHD      HEC 201   6.431   3.675   1.825
  785   1HMA  HEC 201          1HMA      HEC 201  10.490  11.964   6.327
  786   2HMA  HEC 201          2HMA      HEC 201  11.461  10.615   6.920
  787   3HMA  HEC 201          3HMA      HEC 201   9.945  11.032   7.724
  788   1HAA  HEC 201          1HAA      HEC 201   6.669   9.825   7.244
  789   2HAA  HEC 201          2HAA      HEC 201   8.012  10.785   7.858
  790   1HBA  HEC 201          1HBA      HEC 201   6.918  11.681   5.265
  791   2HBA  HEC 201          2HBA      HEC 201   5.822  11.848   6.637
  792   1HMB  HEC 201          1HMB      HEC 201  15.060   9.075   2.880
  793   2HMB  HEC 201          2HMB      HEC 201  15.199   8.105   4.346
  794   3HMB  HEC 201          3HMB      HEC 201  14.155   9.526   4.326
  795    HAB  HEC 201           HAB      HEC 201  14.419   5.397   1.150
  796   1HBB  HEC 201          1HBB      HEC 201  16.713   5.750   2.410
  797   2HBB  HEC 201          2HBB      HEC 201  15.505   4.647   3.070
  798   3HBB  HEC 201          3HBB      HEC 201  15.671   6.272   3.733
  799   1HMC  HEC 201          1HMC      HEC 201  11.848   2.025   0.647
  800   2HMC  HEC 201          2HMC      HEC 201  10.618   1.867  -0.609
  801   3HMC  HEC 201          3HMC      HEC 201  11.761   3.210  -0.657
  802    HAC  HEC 201           HAC      HEC 201   7.033   2.314   0.618
  803   1HBC  HEC 201          1HBC      HEC 201   8.239   0.182  -0.384
  804   2HBC  HEC 201          2HBC      HEC 201   8.084   0.383   1.360
  805   3HBC  HEC 201          3HBC      HEC 201   9.603   0.780   0.559
  806   1HMD  HEC 201          1HMD      HEC 201   3.755   4.249   4.489
  807   2HMD  HEC 201          2HMD      HEC 201   3.452   4.712   2.815
  808   3HMD  HEC 201          3HMD      HEC 201   4.638   3.462   3.185
  809   1HAD  HEC 201          1HAD      HEC 201   4.368   8.062   5.605
  810   2HAD  HEC 201          2HAD      HEC 201   3.337   7.594   4.258
  811   1HBD  HEC 201          1HBD      HEC 201   2.741   5.545   5.286
  812   2HBD  HEC 201          2HBD      HEC 201   4.046   5.666   6.465
  813    HHA  HEC 202           HHA      HEC 202   1.609   7.754  -9.484
  814    HHB  HEC 202           HHB      HEC 202   2.867   4.247  -4.788
  815    HHC  HEC 202           HHC      HEC 202   4.588   9.126  -1.252
  816    HHD  HEC 202           HHD      HEC 202   2.815  13.046  -5.803
  817   1HMA  HEC 202          1HMA      HEC 202   0.498   3.332  -7.528
  818   2HMA  HEC 202          2HMA      HEC 202   0.915   3.387  -5.816
  819   3HMA  HEC 202          3HMA      HEC 202   2.135   2.937  -7.006
  820   1HAA  HEC 202          1HAA      HEC 202   1.195   5.302  -9.987
  821   2HAA  HEC 202          2HAA      HEC 202   0.068   4.470  -8.956
  822   1HBA  HEC 202          1HBA      HEC 202  -1.269   6.489  -8.722
  823   2HBA  HEC 202          2HBA      HEC 202  -0.118   7.392  -9.699
  824   1HMB  HEC 202          1HMB      HEC 202   4.321   3.476  -3.149
  825   2HMB  HEC 202          2HMB      HEC 202   4.538   3.917  -1.454
  826   3HMB  HEC 202          3HMB      HEC 202   2.914   3.735  -2.118
  827    HAB  HEC 202           HAB      HEC 202   4.303   7.147   0.102
  828   1HBB  HEC 202          1HBB      HEC 202   6.556   7.089   0.270
  829   2HBB  HEC 202          2HBB      HEC 202   6.682   6.352  -1.327
  830   3HBB  HEC 202          3HBB      HEC 202   6.480   5.337   0.100
  831   1HMC  HEC 202          1HMC      HEC 202   5.411  12.915  -1.451
  832   2HMC  HEC 202          2HMC      HEC 202   4.115  12.136  -0.542
  833   3HMC  HEC 202          3HMC      HEC 202   5.572  11.231  -0.956
  834    HAC  HEC 202           HAC      HEC 202   2.446  14.034  -3.650
  835   1HBC  HEC 202          1HBC      HEC 202   3.936  14.099  -1.537
  836   2HBC  HEC 202          2HBC      HEC 202   3.745  15.602  -2.439
  837   3HBC  HEC 202          3HBC      HEC 202   5.217  14.647  -2.617
  838   1HMD  HEC 202          1HMD      HEC 202   2.006  13.063  -9.794
  839   2HMD  HEC 202          2HMD      HEC 202   2.916  13.610  -8.384
  840   3HMD  HEC 202          3HMD      HEC 202   1.156  13.523  -8.318
  841   1HAD  HEC 202          1HAD      HEC 202   1.889   9.339 -10.748
  842   2HAD  HEC 202          2HAD      HEC 202   1.152  10.926 -10.902
  843   1HBD  HEC 202          1HBD      HEC 202   3.581  11.816 -10.557
  844   2HBD  HEC 202          2HBD      HEC 202   4.058  10.176 -10.998
  845    HHA  HEC 203           HHA      HEC 203   7.016  -6.826   4.657
  846    HHB  HEC 203           HHB      HEC 203   2.628  -2.071   4.958
  847    HHC  HEC 203           HHC      HEC 203   4.666   0.153  -0.346
  848    HHD  HEC 203           HHD      HEC 203   8.915  -4.468  -0.851
  849   1HMA  HEC 203          1HMA      HEC 203   3.337  -3.384   7.623
  850   2HMA  HEC 203          2HMA      HEC 203   2.924  -5.096   7.522
  851   3HMA  HEC 203          3HMA      HEC 203   2.060  -3.921   6.530
  852   1HAA  HEC 203          1HAA      HEC 203   4.735  -6.119   7.743
  853   2HAA  HEC 203          2HAA      HEC 203   4.542  -7.319   6.471
  854   1HBA  HEC 203          1HBA      HEC 203   6.786  -7.717   6.321
  855   2HBA  HEC 203          2HBA      HEC 203   7.209  -6.033   6.634
  856   1HMB  HEC 203          1HMB      HEC 203   2.427   0.389   5.129
  857   2HMB  HEC 203          2HMB      HEC 203   1.752   1.295   3.775
  858   3HMB  HEC 203          3HMB      HEC 203   1.131  -0.310   4.159
  859    HAB  HEC 203           HAB      HEC 203   2.737   0.991   0.238
  860   1HBB  HEC 203          1HBB      HEC 203   4.144   2.764   0.192
  861   2HBB  HEC 203          2HBB      HEC 203   4.700   2.407   1.827
  862   3HBB  HEC 203          3HBB      HEC 203   3.283   3.428   1.579
  863   1HMC  HEC 203          1HMC      HEC 203   5.652   0.493  -2.039
  864   2HMC  HEC 203          2HMC      HEC 203   7.262   0.254  -2.721
  865   3HMC  HEC 203          3HMC      HEC 203   5.887  -0.638  -3.373
  866    HAC  HEC 203           HAC      HEC 203   9.146  -3.292  -2.507
  867   1HBC  HEC 203          1HBC      HEC 203   8.199  -0.901  -4.043
  868   2HBC  HEC 203          2HBC      HEC 203   9.840  -1.507  -3.824
  869   3HBC  HEC 203          3HBC      HEC 203   9.036  -0.640  -2.517
  870   1HMD  HEC 203          1HMD      HEC 203  10.223  -6.001  -0.334
  871   2HMD  HEC 203          2HMD      HEC 203   9.828  -7.661   0.113
  872   3HMD  HEC 203          3HMD      HEC 203  10.896  -6.702   1.138
  873   1HAD  HEC 203          1HAD      HEC 203  10.054  -7.771   3.229
  874   2HAD  HEC 203          2HAD      HEC 203   8.577  -7.906   4.177
  875   1HBD  HEC 203          1HBD      HEC 203   7.571  -9.202   2.252
  876   2HBD  HEC 203          2HBD      HEC 203   9.176  -9.226   1.522
  877    HHA  HEC 204           HHA      HEC 204  -6.753   2.207   3.915
  878    HHB  HEC 204           HHB      HEC 204 -10.137  -2.295   1.111
  879    HHC  HEC 204           HHC      HEC 204  -4.839  -5.901   0.920
  880    HHD  HEC 204           HHD      HEC 204  -1.487  -1.054   2.768
  881   1HMA  HEC 204          1HMA      HEC 204 -11.672   0.235   3.164
  882   2HMA  HEC 204          2HMA      HEC 204 -11.475  -0.837   1.779
  883   3HMA  HEC 204          3HMA      HEC 204 -11.332   0.909   1.569
  884   1HAA  HEC 204          1HAA      HEC 204  -9.913   2.117   4.592
  885   2HAA  HEC 204          2HAA      HEC 204  -8.465   2.868   3.931
  886   1HBA  HEC 204          1HBA      HEC 204  -9.657   3.123   1.744
  887   2HBA  HEC 204          2HBA      HEC 204 -11.110   2.494   2.515
  888   1HMB  HEC 204          1HMB      HEC 204 -10.613  -3.802  -0.223
  889   2HMB  HEC 204          2HMB      HEC 204  -9.824  -4.698  -1.521
  890   3HMB  HEC 204          3HMB      HEC 204 -10.305  -5.529  -0.042
  891    HAB  HEC 204           HAB      HEC 204  -6.549  -6.958   0.199
  892   1HBB  HEC 204          1HBB      HEC 204  -5.737  -6.255  -1.900
  893   2HBB  HEC 204          2HBB      HEC 204  -7.330  -5.720  -2.438
  894   3HBB  HEC 204          3HBB      HEC 204  -6.979  -7.443  -2.300
  895   1HMC  HEC 204          1HMC      HEC 204  -1.746  -6.345   1.975
  896   2HMC  HEC 204          2HMC      HEC 204  -3.015  -6.546   0.765
  897   3HMC  HEC 204          3HMC      HEC 204  -1.462  -5.849   0.305
  898    HAC  HEC 204           HAC      HEC 204  -0.468  -2.599   2.997
  899   1HBC  HEC 204          1HBC      HEC 204   0.443  -4.226   0.602
  900   2HBC  HEC 204          2HBC      HEC 204   1.406  -3.113   1.576
  901   3HBC  HEC 204          3HBC      HEC 204   0.137  -2.490   0.521
  902   1HMD  HEC 204          1HMD      HEC 204  -0.871   0.790   3.306
  903   2HMD  HEC 204          2HMD      HEC 204  -1.406   2.463   3.151
  904   3HMD  HEC 204          3HMD      HEC 204  -1.402   1.682   4.731
  905   1HAD  HEC 204          1HAD      HEC 204  -3.593   3.777   3.777
  906   2HAD  HEC 204          2HAD      HEC 204  -5.268   3.447   4.202
  907   1HBD  HEC 204          1HBD      HEC 204  -4.108   2.143   6.216
  908   2HBD  HEC 204          2HBD      HEC 204  -2.821   3.299   5.891
  Start of MODEL    2
    1   1H    ALA   1          1H        ALA   1  20.314  14.777   0.683
    2   2H    ALA   1          2H        ALA   1  20.656  15.129   2.309
    3   3H    ALA   1          3H        ALA   1  19.078  15.320   1.709
    4    HA   ALA   1           HA       ALA   1  19.318  12.779   1.159
    5   1HB   ALA   1          1HB       ALA   1  20.816  12.461   3.588
    6   2HB   ALA   1          2HB       ALA   1  21.714  13.529   2.511
    7   3HB   ALA   1          3HB       ALA   1  21.243  11.919   1.965
    8    HA   PRO   2           HA       PRO   2  16.053  13.533   4.127
    9   1HB   PRO   2          1HB       PRO   2  14.588  11.320   3.455
   10   2HB   PRO   2          2HB       PRO   2  14.568  12.816   2.508
   11   1HG   PRO   2          1HG       PRO   2  16.042  10.281   2.008
   12   2HG   PRO   2          2HG       PRO   2  15.244  11.365   0.859
   13   1HD   PRO   2          1HD       PRO   2  17.939  11.313   1.248
   14   2HD   PRO   2          2HD       PRO   2  17.053  12.762   0.721
   15    H    LYS   3           H        LYS   3  15.553  12.614   6.163
   16    HA   LYS   3           HA       LYS   3  17.272  10.305   6.963
   17   1HB   LYS   3          1HB       LYS   3  15.728  12.245   8.684
   18   2HB   LYS   3          2HB       LYS   3  17.053  11.194   9.172
   19   1HG   LYS   3          1HG       LYS   3  18.661  12.474   8.003
   20   2HG   LYS   3          2HG       LYS   3  17.432  13.287   7.034
   21   1HD   LYS   3          1HD       LYS   3  17.195  14.908   8.576
   22   2HD   LYS   3          2HD       LYS   3  16.944  13.720   9.856
   23   1HE   LYS   3          1HE       LYS   3  19.696  13.576   9.213
   24   2HE   LYS   3          2HE       LYS   3  19.302  15.303   9.321
   25   1HZ   LYS   3          1HZ       LYS   3  17.963  14.621  11.371
   26   2HZ   LYS   3          2HZ       LYS   3  19.653  14.684  11.525
   27   3HZ   LYS   3          3HZ       LYS   3  18.870  13.188  11.341
   28    H    ALA   4           H        ALA   4  15.806   8.735   6.083
   29    HA   ALA   4           HA       ALA   4  13.095   8.374   6.330
   30   1HB   ALA   4          1HB       ALA   4  15.237   6.831   5.671
   31   2HB   ALA   4          2HB       ALA   4  13.601   6.190   5.834
   32   3HB   ALA   4          3HB       ALA   4  14.741   6.051   7.174
   33    HA   PRO   5           HA       PRO   5  12.376   8.427  10.673
   34   1HB   PRO   5          1HB       PRO   5   9.746   7.665  10.601
   35   2HB   PRO   5          2HB       PRO   5  10.308   9.294  10.193
   36   1HG   PRO   5          1HG       PRO   5   9.372   7.133   8.421
   37   2HG   PRO   5          2HG       PRO   5   9.368   8.882   8.178
   38   1HD   PRO   5          1HD       PRO   5  11.186   7.043   7.068
   39   2HD   PRO   5          2HD       PRO   5  11.317   8.811   7.047
   40    H    ALA   6           H        ALA   6  11.769   6.908  12.408
   41    HA   ALA   6           HA       ALA   6  12.916   4.340  12.140
   42   1HB   ALA   6          1HB       ALA   6  11.458   4.025  14.314
   43   2HB   ALA   6          2HB       ALA   6  11.084   5.732  14.075
   44   3HB   ALA   6          3HB       ALA   6  12.756   5.219  14.303
   45    H    ASP   7           H        ASP   7  11.581   2.299  12.686
   46    HA   ASP   7           HA       ASP   7   9.566   1.922  10.603
   47   1HB   ASP   7          1HB       ASP   7  10.397   0.022  12.802
   48   2HB   ASP   7          2HB       ASP   7   9.835  -0.373  11.182
   49    H    GLY   8           H        GLY   8   7.429   1.044  11.133
   50   1HA   GLY   8          1HA       GLY   8   5.607   0.628  12.664
   51   2HA   GLY   8          2HA       GLY   8   6.462   1.564  13.887
   52    H    LEU   9           H        LEU   9   6.253   2.868  10.659
   53    HA   LEU   9           HA       LEU   9   4.916   5.254  11.603
   54   1HB   LEU   9          1HB       LEU   9   6.377   4.456   9.384
   55   2HB   LEU   9          2HB       LEU   9   4.752   4.684   8.731
   56    HG   LEU   9           HG       LEU   9   5.768   6.758  10.612
   57   1HD1  LEU   9          1HD1      LEU   9   6.906   6.161   7.902
   58   2HD1  LEU   9          2HD1      LEU   9   7.718   6.774   9.344
   59   3HD1  LEU   9          3HD1      LEU   9   6.705   7.848   8.379
   60   1HD2  LEU   9          1HD2      LEU   9   3.797   6.458   8.432
   61   2HD2  LEU   9          2HD2      LEU   9   4.671   7.993   8.422
   62   3HD2  LEU   9          3HD2      LEU   9   3.754   7.504   9.851
   63    H    LYS  10           H        LYS  10   2.776   5.376  12.059
   64    HA   LYS  10           HA       LYS  10   0.959   3.310  10.934
   65   1HB   LYS  10          1HB       LYS  10   1.077   5.110  13.286
   66   2HB   LYS  10          2HB       LYS  10  -0.532   4.759  12.655
   67   1HG   LYS  10          1HG       LYS  10   0.114   2.304  12.684
   68   2HG   LYS  10          2HG       LYS  10   1.545   2.776  13.601
   69   1HD   LYS  10          1HD       LYS  10  -0.026   3.921  15.242
   70   2HD   LYS  10          2HD       LYS  10  -1.354   3.117  14.401
   71   1HE   LYS  10          1HE       LYS  10  -0.864   1.090  15.331
   72   2HE   LYS  10          2HE       LYS  10   0.884   1.326  15.137
   73   1HZ   LYS  10          1HZ       LYS  10   0.496   1.479  17.439
   74   2HZ   LYS  10          2HZ       LYS  10  -0.889   2.443  17.234
   75   3HZ   LYS  10          3HZ       LYS  10   0.652   3.086  16.917
   76    H    MET  11           H        MET  11   0.093   3.872   9.002
   77    HA   MET  11           HA       MET  11  -0.521   6.699   8.363
   78   1HB   MET  11          1HB       MET  11   0.106   4.253   6.982
   79   2HB   MET  11          2HB       MET  11  -1.450   4.847   6.401
   80   1HG   MET  11          1HG       MET  11   1.117   6.452   6.550
   81   2HG   MET  11          2HG       MET  11   0.376   5.821   5.079
   82   1HE   MET  11          1HE       MET  11   0.055   9.857   5.625
   83   2HE   MET  11          2HE       MET  11   1.165   8.597   5.091
   84   3HE   MET  11          3HE       MET  11   0.989   8.936   6.811
   85    H    ASP  12           H        ASP  12  -2.389   7.349   9.408
   86    HA   ASP  12           HA       ASP  12  -4.694   5.428   9.431
   87   1HB   ASP  12          1HB       ASP  12  -5.440   7.145  11.245
   88   2HB   ASP  12          2HB       ASP  12  -4.133   6.031  11.624
   89    H    LYS  13           H        LYS  13  -3.753   7.548   7.338
   90    HA   LYS  13           HA       LYS  13  -5.527   9.699   7.130
   91   1HB   LYS  13          1HB       LYS  13  -4.242   7.795   5.184
   92   2HB   LYS  13          2HB       LYS  13  -5.260   9.110   4.601
   93   1HG   LYS  13          1HG       LYS  13  -2.855   9.432   6.423
   94   2HG   LYS  13          2HG       LYS  13  -2.871   9.778   4.692
   95   1HD   LYS  13          1HD       LYS  13  -4.720  11.429   5.102
   96   2HD   LYS  13          2HD       LYS  13  -4.512  11.161   6.832
   97   1HE   LYS  13          1HE       LYS  13  -2.029  11.787   5.316
   98   2HE   LYS  13          2HE       LYS  13  -3.190  13.116   5.508
   99   1HZ   LYS  13          1HZ       LYS  13  -1.654  11.705   7.525
  100   2HZ   LYS  13          2HZ       LYS  13  -3.282  11.983   7.925
  101   3HZ   LYS  13          3HZ       LYS  13  -2.263  13.287   7.540
  102    H    THR  14           H        THR  14  -6.127   6.276   6.636
  103    HA   THR  14           HA       THR  14  -8.982   6.885   5.934
  104    HB   THR  14           HB       THR  14  -8.837   4.510   4.979
  105    HG1  THR  14           1HG      THR  14  -7.065   3.576   5.612
  106   1HG2  THR  14          1HG2      THR  14  -7.362   5.366   3.024
  107   2HG2  THR  14          2HG2      THR  14  -7.284   6.868   3.947
  108   3HG2  THR  14          3HG2      THR  14  -8.843   6.248   3.401
  109    H    LYS  15           H        LYS  15 -10.351   4.766   6.567
  110    HA   LYS  15           HA       LYS  15 -10.356   4.604   9.449
  111   1HB   LYS  15          1HB       LYS  15 -11.854   3.580   7.114
  112   2HB   LYS  15          2HB       LYS  15 -11.927   2.548   8.543
  113   1HG   LYS  15          1HG       LYS  15 -13.422   3.946   9.474
  114   2HG   LYS  15          2HG       LYS  15 -12.235   5.250   9.408
  115   1HD   LYS  15          1HD       LYS  15 -12.906   5.708   7.056
  116   2HD   LYS  15          2HD       LYS  15 -14.142   4.455   7.188
  117   1HE   LYS  15          1HE       LYS  15 -15.448   6.265   7.792
  118   2HE   LYS  15          2HE       LYS  15 -14.747   5.931   9.388
  119   1HZ   LYS  15          1HZ       LYS  15 -14.361   8.227   8.826
  120   2HZ   LYS  15          2HZ       LYS  15 -13.667   7.793   7.338
  121   3HZ   LYS  15          3HZ       LYS  15 -12.882   7.398   8.791
  122    H    GLN  16           H        GLN  16  -8.814   2.773   6.924
  123    HA   GLN  16           HA       GLN  16  -8.128   0.571   8.824
  124   1HB   GLN  16          1HB       GLN  16  -8.159   0.948   5.829
  125   2HB   GLN  16          2HB       GLN  16  -7.266  -0.389   6.557
  126   1HG   GLN  16          1HG       GLN  16  -9.203  -1.538   6.616
  127   2HG   GLN  16          2HG       GLN  16  -9.758  -0.402   7.847
  128   1HE2  GLN  16          2HE2      GLN  16 -10.151  -1.385   4.523
  129   2HE2  GLN  16          1HE2      GLN  16 -11.322  -0.228   4.109
  130    HA   PRO  17           HA       PRO  17  -4.394   3.282   8.761
  131   1HB   PRO  17          1HB       PRO  17  -3.720   2.771  11.369
  132   2HB   PRO  17          2HB       PRO  17  -4.856   4.049  10.889
  133   1HG   PRO  17          1HG       PRO  17  -5.422   1.300  11.904
  134   2HG   PRO  17          2HG       PRO  17  -6.212   2.835  12.307
  135   1HD   PRO  17          1HD       PRO  17  -7.305   1.063  10.590
  136   2HD   PRO  17          2HD       PRO  17  -7.516   2.820  10.407
  137    H    VAL  18           H        VAL  18  -2.421   2.466   8.150
  138    HA   VAL  18           HA       VAL  18  -1.800  -0.381   8.850
  139    HB   VAL  18           HB       VAL  18  -1.460   1.293   6.357
  140   1HG1  VAL  18          1HG1      VAL  18  -0.232  -1.421   6.905
  141   2HG1  VAL  18          2HG1      VAL  18   0.664   0.097   6.881
  142   3HG1  VAL  18          3HG1      VAL  18  -0.108  -0.495   5.410
  143   1HG2  VAL  18          1HG2      VAL  18  -3.130  -0.957   7.257
  144   2HG2  VAL  18          2HG2      VAL  18  -2.383  -1.218   5.681
  145   3HG2  VAL  18          3HG2      VAL  18  -3.406   0.194   5.949
  146    H    VAL  19           H        VAL  19   0.197  -0.699   9.805
  147    HA   VAL  19           HA       VAL  19   1.875   1.658  10.391
  148    HB   VAL  19           HB       VAL  19   1.929  -1.275  11.167
  149   1HG1  VAL  19          1HG1      VAL  19   3.854   0.944  11.631
  150   2HG1  VAL  19          2HG1      VAL  19   4.138  -0.794  11.558
  151   3HG1  VAL  19          3HG1      VAL  19   3.474  -0.071  13.023
  152   1HG2  VAL  19          1HG2      VAL  19   0.178   0.596  11.983
  153   2HG2  VAL  19          2HG2      VAL  19   1.495   0.952  13.099
  154   3HG2  VAL  19          3HG2      VAL  19   0.781  -0.659  13.065
  155    H    PHE  20           H        PHE  20   3.348   2.216   8.757
  156    HA   PHE  20           HA       PHE  20   4.471   0.086   7.030
  157   1HB   PHE  20          1HB       PHE  20   3.715   2.244   6.086
  158   2HB   PHE  20          2HB       PHE  20   4.878   3.095   7.104
  159    HD1  PHE  20           HD1      PHE  20   4.866   0.133   4.789
  160    HD2  PHE  20           HD2      PHE  20   6.879   3.699   6.075
  161    HE1  PHE  20           HE1      PHE  20   6.651  -0.264   3.114
  162    HE2  PHE  20           HE2      PHE  20   8.657   3.302   4.400
  163    HZ   PHE  20           HZ       PHE  20   8.547   1.322   2.919
  164    H    ASN  21           H        ASN  21   6.346  -0.926   7.607
  165    HA   ASN  21           HA       ASN  21   8.116   0.345   9.627
  166   1HB   ASN  21          1HB       ASN  21   7.158  -2.281   8.921
  167   2HB   ASN  21          2HB       ASN  21   8.915  -2.261   8.876
  168   1HD2  ASN  21          2HD2      ASN  21   8.599  -3.733  10.876
  169   2HD2  ASN  21          1HD2      ASN  21   8.424  -2.970  12.381
  170    H    HIS  22           H        HIS  22   9.362   1.805   8.329
  171    HA   HIS  22           HA       HIS  22  10.351   1.456   5.739
  172   1HB   HIS  22          1HB       HIS  22  11.288   2.822   8.237
  173   2HB   HIS  22          2HB       HIS  22  12.373   2.787   6.849
  174    HD1  HIS  22           HD1      HIS  22   9.544   4.605   8.225
  175    HD2  HIS  22           HD2      HIS  22  11.015   3.890   4.386
  176    HE1  HIS  22           HE1      HIS  22   8.550   6.390   6.734
  177    H    SER  23           H        SER  23  11.570   0.076   8.770
  178    HA   SER  23           HA       SER  23  14.081  -0.901   8.007
  179   1HB   SER  23          1HB       SER  23  13.345  -2.841   9.593
  180   2HB   SER  23          2HB       SER  23  13.375  -1.202  10.239
  181    HG   SER  23           HG       SER  23  11.278  -2.894   9.837
  182    H    THR  24           H        THR  24  10.876  -2.353   7.398
  183    HA   THR  24           HA       THR  24  11.933  -4.665   5.987
  184    HB   THR  24           HB       THR  24   9.218  -3.969   5.299
  185    HG1  THR  24           1HG      THR  24   8.822  -2.796   7.003
  186   1HG2  THR  24          1HG2      THR  24  10.753  -6.109   6.592
  187   2HG2  THR  24          2HG2      THR  24   9.362  -6.217   5.512
  188   3HG2  THR  24          3HG2      THR  24   9.120  -5.929   7.235
  189    H    HIS  25           H        HIS  25  11.669  -1.397   5.175
  190    HA   HIS  25           HA       HIS  25  11.605  -2.028   2.255
  191   1HB   HIS  25          1HB       HIS  25  10.744   0.432   3.807
  192   2HB   HIS  25          2HB       HIS  25  10.571   0.195   2.071
  193    HD1  HIS  25           HD1      HIS  25   9.254  -1.042   5.365
  194    HD2  HIS  25           HD2      HIS  25   8.503  -1.592   1.304
  195    HE1  HIS  25           HE1      HIS  25   7.113  -2.385   5.210
  196    H    LYS  26           H        LYS  26  13.565  -0.979   4.804
  197    HA   LYS  26           HA       LYS  26  15.105   1.137   3.763
  198   1HB   LYS  26          1HB       LYS  26  16.748   0.388   5.341
  199   2HB   LYS  26          2HB       LYS  26  15.191  -0.079   6.024
  200   1HG   LYS  26          1HG       LYS  26  15.460  -2.353   5.292
  201   2HG   LYS  26          2HG       LYS  26  16.876  -1.936   4.328
  202   1HD   LYS  26          1HD       LYS  26  16.681  -1.751   7.348
  203   2HD   LYS  26          2HD       LYS  26  17.551  -2.994   6.448
  204   1HE   LYS  26          1HE       LYS  26  18.618  -0.730   5.342
  205   2HE   LYS  26          2HE       LYS  26  18.336  -0.200   7.013
  206   1HZ   LYS  26          1HZ       LYS  26  19.755  -2.665   6.153
  207   2HZ   LYS  26          2HZ       LYS  26  19.364  -2.294   7.765
  208   3HZ   LYS  26          3HZ       LYS  26  20.451  -1.311   6.903
  209    H    ALA  27           H        ALA  27  14.962  -2.228   2.815
  210    HA   ALA  27           HA       ALA  27  17.406  -2.043   1.152
  211   1HB   ALA  27          1HB       ALA  27  17.078  -4.398   0.895
  212   2HB   ALA  27          2HB       ALA  27  15.371  -4.278   1.321
  213   3HB   ALA  27          3HB       ALA  27  16.607  -4.046   2.557
  214    H    VAL  28           H        VAL  28  14.173  -1.178   0.871
  215    HA   VAL  28           HA       VAL  28  13.768  -1.932  -1.938
  216    HB   VAL  28           HB       VAL  28  12.319  -0.203   0.081
  217   1HG1  VAL  28          1HG1      VAL  28  11.835   0.701  -2.118
  218   2HG1  VAL  28          2HG1      VAL  28  10.438  -0.218  -1.563
  219   3HG1  VAL  28          3HG1      VAL  28  11.535  -0.916  -2.754
  220   1HG2  VAL  28          1HG2      VAL  28  10.654  -2.063  -0.059
  221   2HG2  VAL  28          2HG2      VAL  28  12.224  -2.594   0.543
  222   3HG2  VAL  28          3HG2      VAL  28  11.761  -2.926  -1.127
  223    H    LYS  29           H        LYS  29  13.064   0.063  -3.403
  224    HA   LYS  29           HA       LYS  29  15.381   1.898  -3.386
  225   1HB   LYS  29          1HB       LYS  29  13.588   0.722  -5.295
  226   2HB   LYS  29          2HB       LYS  29  13.548   2.479  -5.454
  227   1HG   LYS  29          1HG       LYS  29  15.372   2.006  -6.796
  228   2HG   LYS  29          2HG       LYS  29  16.173   2.231  -5.239
  229   1HD   LYS  29          1HD       LYS  29  15.401  -0.447  -5.210
  230   2HD   LYS  29          2HD       LYS  29  15.943  -0.182  -6.868
  231   1HE   LYS  29          1HE       LYS  29  17.677   1.017  -4.779
  232   2HE   LYS  29          2HE       LYS  29  17.656  -0.757  -4.832
  233   1HZ   LYS  29          1HZ       LYS  29  19.240  -0.118  -6.426
  234   2HZ   LYS  29          2HZ       LYS  29  18.261   1.129  -7.035
  235   3HZ   LYS  29          3HZ       LYS  29  17.852  -0.494  -7.325
  236    H    CYS  30           H        CYS  30  15.077   3.511  -1.952
  237    HA   CYS  30           HA       CYS  30  12.765   4.678  -0.938
  238   1HB   CYS  30          1HB       CYS  30  15.496   5.728  -1.655
  239   2HB   CYS  30          2HB       CYS  30  14.289   6.821  -0.980
  240    H    GLY  31           H        GLY  31  14.076   4.934  -4.154
  241   1HA   GLY  31          1HA       GLY  31  12.349   7.212  -4.871
  242   2HA   GLY  31          2HA       GLY  31  13.489   6.399  -5.945
  243    H    ASP  32           H        ASP  32  12.119   3.785  -4.775
  244    HA   ASP  32           HA       ASP  32  10.242   3.533  -7.010
  245   1HB   ASP  32          1HB       ASP  32  11.833   1.880  -5.399
  246   2HB   ASP  32          2HB       ASP  32  10.183   1.437  -4.985
  247    H    CYS  33           H        CYS  33  10.135   4.179  -3.579
  248    HA   CYS  33           HA       CYS  33   7.160   3.969  -3.508
  249   1HB   CYS  33          1HB       CYS  33   9.403   4.313  -1.499
  250   2HB   CYS  33          2HB       CYS  33   7.722   4.568  -1.036
  251    H    HIS  34           H        HIS  34   9.715   6.295  -2.536
  252    HA   HIS  34           HA       HIS  34   7.837   8.571  -2.786
  253   1HB   HIS  34          1HB       HIS  34  10.755   8.242  -2.005
  254   2HB   HIS  34          2HB       HIS  34   9.938   9.797  -2.044
  255    HD1  HIS  34           HD1      HIS  34   7.551   9.748  -0.542
  256    HD2  HIS  34           HD2      HIS  34  10.564   7.050   0.466
  257    HE1  HIS  34           HE1      HIS  34   7.106   9.030   1.847
  258    H    HIS  35           H        HIS  35   8.430   7.082  -5.212
  259    HA   HIS  35           HA       HIS  35  10.388   7.700  -6.941
  260   1HB   HIS  35          1HB       HIS  35   8.560   8.006  -8.674
  261   2HB   HIS  35          2HB       HIS  35   8.393   6.585  -7.659
  262    HD1  HIS  35           HD1      HIS  35   6.988   9.971  -8.221
  263    HD2  HIS  35           HD2      HIS  35   6.135   6.616  -5.922
  264    HE1  HIS  35           HE1      HIS  35   4.693  10.359  -7.237
  265    HA   PRO  36           HA       PRO  36  11.139  11.965  -7.296
  266   1HB   PRO  36          1HB       PRO  36  11.632  12.217  -9.986
  267   2HB   PRO  36          2HB       PRO  36  12.776  11.482  -8.844
  268   1HG   PRO  36          1HG       PRO  36  10.821  10.158 -10.675
  269   2HG   PRO  36          2HG       PRO  36  12.508   9.734 -10.334
  270   1HD   PRO  36          1HD       PRO  36  10.470   8.406  -9.199
  271   2HD   PRO  36          2HD       PRO  36  11.988   8.713  -8.321
  272    H    VAL  37           H        VAL  37   9.174  12.976  -6.827
  273    HA   VAL  37           HA       VAL  37   7.100  13.217  -8.930
  274    HB   VAL  37           HB       VAL  37   7.395  13.869  -6.001
  275   1HG1  VAL  37          1HG1      VAL  37   6.145  15.740  -6.413
  276   2HG1  VAL  37          2HG1      VAL  37   4.820  14.580  -6.517
  277   3HG1  VAL  37          3HG1      VAL  37   5.607  15.154  -7.988
  278   1HG2  VAL  37          1HG2      VAL  37   6.663  11.653  -6.342
  279   2HG2  VAL  37          2HG2      VAL  37   5.655  12.102  -7.717
  280   3HG2  VAL  37          3HG2      VAL  37   5.160  12.538  -6.082
  281    H    ASN  38           H        ASN  38   6.510  15.296  -9.791
  282    HA   ASN  38           HA       ASN  38   6.933  17.496 -10.556
  283   1HB   ASN  38          1HB       ASN  38   6.765  17.626  -7.972
  284   2HB   ASN  38          2HB       ASN  38   8.500  17.742  -7.996
  285   1HD2  ASN  38          2HD2      ASN  38   5.975  19.742  -7.692
  286   2HD2  ASN  38          1HD2      ASN  38   6.543  21.106  -8.526
  287    H    GLY  39           H        GLY  39   9.860  17.330  -8.636
  288   1HA   GLY  39          1HA       GLY  39  11.500  16.745 -11.038
  289   2HA   GLY  39          2HA       GLY  39  11.817  18.238 -10.147
  290    H    LYS  40           H        LYS  40  10.700  15.898  -8.007
  291    HA   LYS  40           HA       LYS  40  13.296  14.570  -7.546
  292   1HB   LYS  40          1HB       LYS  40  13.672  15.669  -5.391
  293   2HB   LYS  40          2HB       LYS  40  13.539  16.894  -6.652
  294   1HG   LYS  40          1HG       LYS  40  11.199  17.296  -6.062
  295   2HG   LYS  40          2HG       LYS  40  11.262  16.013  -4.855
  296   1HD   LYS  40          1HD       LYS  40  13.315  17.422  -3.944
  297   2HD   LYS  40          2HD       LYS  40  12.499  18.738  -4.788
  298   1HE   LYS  40          1HE       LYS  40  11.127  18.936  -2.995
  299   2HE   LYS  40          2HE       LYS  40  10.475  17.332  -3.384
  300   1HZ   LYS  40          1HZ       LYS  40  13.080  17.561  -2.034
  301   2HZ   LYS  40          2HZ       LYS  40  11.960  16.282  -1.999
  302   3HZ   LYS  40          3HZ       LYS  40  11.659  17.705  -1.119
  303    H    GLU  41           H        GLU  41  13.136  13.020  -5.706
  304    HA   GLU  41           HA       GLU  41  10.516  11.757  -5.578
  305   1HB   GLU  41          1HB       GLU  41  13.217  11.318  -4.297
  306   2HB   GLU  41          2HB       GLU  41  11.829  10.315  -3.882
  307   1HG   GLU  41          1HG       GLU  41  11.751   9.319  -5.966
  308   2HG   GLU  41          2HG       GLU  41  12.425  10.730  -6.781
  309    H    ASP  42           H        ASP  42   8.936  12.703  -4.314
  310    HA   ASP  42           HA       ASP  42   9.519  14.381  -2.036
  311   1HB   ASP  42          1HB       ASP  42   7.066  12.962  -3.081
  312   2HB   ASP  42          2HB       ASP  42   7.025  14.008  -1.662
  313    H    TYR  43           H        TYR  43  10.712  13.304  -0.471
  314    HA   TYR  43           HA       TYR  43  10.098  10.569   0.354
  315   1HB   TYR  43          1HB       TYR  43  11.921  12.760   1.393
  316   2HB   TYR  43          2HB       TYR  43  11.895  11.124   2.048
  317    HD1  TYR  43           HD1      TYR  43  13.384  13.239  -0.362
  318    HD2  TYR  43           HD2      TYR  43  12.092   9.186   0.245
  319    HE1  TYR  43           HE1      TYR  43  14.893  12.485  -2.179
  320    HE2  TYR  43           HE2      TYR  43  13.600   8.434  -1.573
  321    HH   TYR  43           HH       TYR  43  15.173  10.658  -3.695
  322    H    GLN  44           H        GLN  44   7.752  12.013   0.667
  323    HA   GLN  44           HA       GLN  44   7.587  12.406   3.639
  324   1HB   GLN  44          1HB       GLN  44   5.694  14.007   2.944
  325   2HB   GLN  44          2HB       GLN  44   7.338  14.527   2.575
  326   1HG   GLN  44          1HG       GLN  44   7.110  13.721   0.274
  327   2HG   GLN  44          2HG       GLN  44   5.492  13.113   0.629
  328   1HE2  GLN  44          2HE2      GLN  44   6.525  16.142   2.084
  329   2HE2  GLN  44          1HE2      GLN  44   5.555  17.152   1.123
  330    H    LYS  45           H        LYS  45   5.254  12.098   4.410
  331    HA   LYS  45           HA       LYS  45   4.309   9.538   4.189
  332   1HB   LYS  45          1HB       LYS  45   2.020  10.655   4.626
  333   2HB   LYS  45          2HB       LYS  45   3.322  11.012   5.756
  334   1HG   LYS  45          1HG       LYS  45   3.831  13.072   4.392
  335   2HG   LYS  45          2HG       LYS  45   2.372  12.743   3.460
  336   1HD   LYS  45          1HD       LYS  45   2.446  13.123   6.467
  337   2HD   LYS  45          2HD       LYS  45   1.976  14.368   5.310
  338   1HE   LYS  45          1HE       LYS  45   0.412  12.209   4.542
  339   2HE   LYS  45          2HE       LYS  45   0.415  12.099   6.313
  340   1HZ   LYS  45          1HZ       LYS  45  -0.620  14.203   4.597
  341   2HZ   LYS  45          2HZ       LYS  45   0.222  14.731   5.975
  342   3HZ   LYS  45          3HZ       LYS  45  -1.131  13.717   6.138
  343    H    CYS  46           H        CYS  46   3.298   8.318   2.655
  344    HA   CYS  46           HA       CYS  46   3.161   8.943  -0.063
  345   1HB   CYS  46          1HB       CYS  46   1.410   7.162   1.651
  346   2HB   CYS  46          2HB       CYS  46   1.519   7.053  -0.101
  347    H    ALA  47           H        ALA  47   0.695   9.422   2.437
  348    HA   ALA  47           HA       ALA  47  -1.052  10.824   0.454
  349   1HB   ALA  47          1HB       ALA  47  -1.661   9.918   3.269
  350   2HB   ALA  47          2HB       ALA  47  -1.813   8.859   1.869
  351   3HB   ALA  47          3HB       ALA  47  -2.814  10.305   1.994
  352    H    THR  48           H        THR  48   1.067  12.404   1.161
  353    HA   THR  48           HA       THR  48   0.990  13.941   3.493
  354    HB   THR  48           HB       THR  48   1.420  15.300   0.868
  355    HG1  THR  48           1HG      THR  48   3.246  13.375   1.809
  356   1HG2  THR  48          1HG2      THR  48   2.481  15.326   3.615
  357   2HG2  THR  48          2HG2      THR  48   2.402  16.625   2.425
  358   3HG2  THR  48          3HG2      THR  48   3.717  15.450   2.363
  359    H    ALA  49           H        ALA  49   0.429  16.577   2.869
  360    HA   ALA  49           HA       ALA  49  -2.467  16.668   3.129
  361   1HB   ALA  49          1HB       ALA  49  -0.199  18.649   2.942
  362   2HB   ALA  49          2HB       ALA  49  -1.219  18.275   4.331
  363   3HB   ALA  49          3HB       ALA  49  -1.873  19.202   2.980
  364    H    GLY  50           H        GLY  50  -0.425  16.464   0.443
  365   1HA   GLY  50          1HA       GLY  50  -2.658  17.206  -1.359
  366   2HA   GLY  50          2HA       GLY  50  -1.124  18.052  -1.596
  367    H    CYS  51           H        CYS  51  -0.903  14.892  -0.363
  368    HA   CYS  51           HA       CYS  51   0.212  13.911  -2.934
  369   1HB   CYS  51          1HB       CYS  51   0.729  13.829  -0.064
  370   2HB   CYS  51          2HB       CYS  51   0.851  12.253  -0.777
  371    H    HIS  52           H        HIS  52  -0.192  11.156  -1.354
  372    HA   HIS  52           HA       HIS  52  -2.657  10.440  -2.748
  373   1HB   HIS  52          1HB       HIS  52  -0.751   9.024  -0.877
  374   2HB   HIS  52          2HB       HIS  52  -2.129   8.224  -1.606
  375    HD1  HIS  52           HD1      HIS  52  -2.174   8.625  -4.343
  376    HD2  HIS  52           HD2      HIS  52   1.510   8.781  -2.438
  377    HE1  HIS  52           HE1      HIS  52  -0.429   8.242  -6.145
  378    H    ASP  53           H        ASP  53  -3.461  12.415  -1.084
  379    HA   ASP  53           HA       ASP  53  -4.471  11.134   1.414
  380   1HB   ASP  53          1HB       ASP  53  -3.140  13.370   1.207
  381   2HB   ASP  53          2HB       ASP  53  -4.679  14.043   0.668
  382    H    ASN  54           H        ASN  54  -5.667  10.790  -1.410
  383    HA   ASN  54           HA       ASN  54  -8.203  12.260  -1.281
  384   1HB   ASN  54          1HB       ASN  54  -6.727  11.139  -3.257
  385   2HB   ASN  54          2HB       ASN  54  -7.866   9.829  -2.968
  386   1HD2  ASN  54          2HD2      ASN  54  -9.573  10.007  -4.419
  387   2HD2  ASN  54          1HD2      ASN  54 -10.319  11.462  -4.876
  388    H    MET  55           H        MET  55  -9.451  11.667   0.490
  389    HA   MET  55           HA       MET  55  -9.554   8.923   1.477
  390   1HB   MET  55          1HB       MET  55 -11.253  11.367   2.076
  391   2HB   MET  55          2HB       MET  55 -11.108   9.929   3.086
  392   1HG   MET  55          1HG       MET  55  -8.506  10.523   2.885
  393   2HG   MET  55          2HG       MET  55  -9.160  12.145   2.654
  394   1HE   MET  55          1HE       MET  55  -7.841  11.161   6.412
  395   2HE   MET  55          2HE       MET  55  -7.514  12.347   5.151
  396   3HE   MET  55          3HE       MET  55  -7.348  10.628   4.799
  397    H    ASP  56           H        ASP  56 -10.603   9.735  -1.355
  398    HA   ASP  56           HA       ASP  56 -13.459   8.989  -1.127
  399   1HB   ASP  56          1HB       ASP  56 -12.080  10.709  -2.709
  400   2HB   ASP  56          2HB       ASP  56 -12.084   9.282  -3.748
  401    H    LYS  57           H        LYS  57 -10.435   7.449  -1.518
  402    HA   LYS  57           HA       LYS  57  -9.831   5.279  -2.262
  403   1HB   LYS  57          1HB       LYS  57 -12.661   4.727  -1.338
  404   2HB   LYS  57          2HB       LYS  57 -11.289   3.622  -1.289
  405   1HG   LYS  57          1HG       LYS  57 -10.981   4.355   0.823
  406   2HG   LYS  57          2HG       LYS  57 -10.354   5.830   0.090
  407   1HD   LYS  57          1HD       LYS  57 -12.007   6.768   1.387
  408   2HD   LYS  57          2HD       LYS  57 -12.973   6.397  -0.042
  409   1HE   LYS  57          1HE       LYS  57 -13.140   4.018   1.272
  410   2HE   LYS  57          2HE       LYS  57 -13.031   5.139   2.643
  411   1HZ   LYS  57          1HZ       LYS  57 -14.864   5.449   0.323
  412   2HZ   LYS  57          2HZ       LYS  57 -14.767   6.484   1.668
  413   3HZ   LYS  57          3HZ       LYS  57 -15.328   4.891   1.855
  414    H    LYS  58           H        LYS  58 -11.408   7.107  -4.170
  415    HA   LYS  58           HA       LYS  58 -12.329   4.941  -6.030
  416   1HB   LYS  58          1HB       LYS  58 -13.432   7.738  -5.595
  417   2HB   LYS  58          2HB       LYS  58 -14.039   6.580  -6.778
  418   1HG   LYS  58          1HG       LYS  58 -13.902   5.269  -4.238
  419   2HG   LYS  58          2HG       LYS  58 -14.744   6.804  -4.023
  420   1HD   LYS  58          1HD       LYS  58 -16.496   6.196  -5.382
  421   2HD   LYS  58          2HD       LYS  58 -15.481   5.187  -6.414
  422   1HE   LYS  58          1HE       LYS  58 -16.247   3.376  -5.288
  423   2HE   LYS  58          2HE       LYS  58 -15.444   3.996  -3.832
  424   1HZ   LYS  58          1HZ       LYS  58 -18.070   5.002  -4.771
  425   2HZ   LYS  58          2HZ       LYS  58 -17.329   5.269  -3.265
  426   3HZ   LYS  58          3HZ       LYS  58 -17.927   3.728  -3.660
  427    H    ASP  59           H        ASP  59 -10.563   7.933  -5.564
  428    HA   ASP  59           HA       ASP  59 -10.176   8.689  -8.295
  429   1HB   ASP  59          1HB       ASP  59  -9.659  10.228  -6.550
  430   2HB   ASP  59          2HB       ASP  59  -8.638   9.054  -5.717
  431    H    LYS  60           H        LYS  60  -9.517   7.024  -9.684
  432    HA   LYS  60           HA       LYS  60  -7.406   5.136  -8.904
  433   1HB   LYS  60          1HB       LYS  60  -9.390   5.554 -11.038
  434   2HB   LYS  60          2HB       LYS  60  -7.868   4.874 -11.617
  435   1HG   LYS  60          1HG       LYS  60  -9.114   3.735  -9.138
  436   2HG   LYS  60          2HG       LYS  60  -9.769   3.279 -10.710
  437   1HD   LYS  60          1HD       LYS  60  -6.801   3.179 -10.279
  438   2HD   LYS  60          2HD       LYS  60  -7.807   1.872  -9.653
  439   1HE   LYS  60          1HE       LYS  60  -7.762   0.970 -11.734
  440   2HE   LYS  60          2HE       LYS  60  -8.741   2.347 -12.278
  441   1HZ   LYS  60          1HZ       LYS  60  -6.634   2.220 -13.488
  442   2HZ   LYS  60          2HZ       LYS  60  -5.778   2.338 -12.026
  443   3HZ   LYS  60          3HZ       LYS  60  -6.729   3.639 -12.564
  444    H    SER  61           H        SER  61  -7.134   8.271  -9.512
  445    HA   SER  61           HA       SER  61  -5.150   8.310 -11.664
  446   1HB   SER  61          1HB       SER  61  -6.757  10.122 -10.116
  447   2HB   SER  61          2HB       SER  61  -5.078  10.650 -10.042
  448    HG   SER  61           HG       SER  61  -6.833  10.751 -12.095
  449    H    ALA  62           H        ALA  62  -3.299  10.130 -10.436
  450    HA   ALA  62           HA       ALA  62  -1.716   8.192  -8.813
  451   1HB   ALA  62          1HB       ALA  62  -0.443  10.693  -9.610
  452   2HB   ALA  62          2HB       ALA  62  -1.205   9.884 -10.979
  453   3HB   ALA  62          3HB       ALA  62   0.004   9.037 -10.016
  454    H    LYS  63           H        LYS  63  -3.975   9.925  -7.717
  455    HA   LYS  63           HA       LYS  63  -2.351  11.355  -5.635
  456   1HB   LYS  63          1HB       LYS  63  -3.829  12.532  -7.608
  457   2HB   LYS  63          2HB       LYS  63  -5.035  12.394  -6.328
  458   1HG   LYS  63          1HG       LYS  63  -4.058  14.024  -5.107
  459   2HG   LYS  63          2HG       LYS  63  -2.458  13.309  -5.306
  460   1HD   LYS  63          1HD       LYS  63  -1.991  15.066  -6.649
  461   2HD   LYS  63          2HD       LYS  63  -3.044  14.296  -7.837
  462   1HE   LYS  63          1HE       LYS  63  -4.995  15.496  -6.663
  463   2HE   LYS  63          2HE       LYS  63  -3.751  16.474  -5.858
  464   1HZ   LYS  63          1HZ       LYS  63  -3.751  16.027  -8.785
  465   2HZ   LYS  63          2HZ       LYS  63  -2.903  17.204  -7.901
  466   3HZ   LYS  63          3HZ       LYS  63  -4.588  17.324  -8.083
  467    H    GLY  64           H        GLY  64  -4.758   9.031  -6.303
  468   1HA   GLY  64          1HA       GLY  64  -6.391   9.406  -3.960
  469   2HA   GLY  64          2HA       GLY  64  -6.341   7.953  -4.949
  470    H    TYR  65           H        TYR  65  -6.434   7.903  -2.139
  471    HA   TYR  65           HA       TYR  65  -3.679   7.224  -1.257
  472   1HB   TYR  65          1HB       TYR  65  -5.268   8.658   0.080
  473   2HB   TYR  65          2HB       TYR  65  -6.302   7.242   0.262
  474    HD1  TYR  65           HD1      TYR  65  -2.573   7.391   0.233
  475    HD2  TYR  65           HD2      TYR  65  -6.117   6.701   2.553
  476    HE1  TYR  65           HE1      TYR  65  -1.181   6.584   2.119
  477    HE2  TYR  65           HE2      TYR  65  -4.726   5.896   4.442
  478    HH   TYR  65           HH       TYR  65  -1.426   5.142   4.100
  479    H    TYR  66           H        TYR  66  -6.713   5.705  -2.148
  480    HA   TYR  66           HA       TYR  66  -5.788   3.087  -1.083
  481   1HB   TYR  66          1HB       TYR  66  -8.006   3.489  -0.487
  482   2HB   TYR  66          2HB       TYR  66  -8.347   4.363  -1.980
  483    HD1  TYR  66           HD1      TYR  66  -8.503   1.190  -0.298
  484    HD2  TYR  66           HD2      TYR  66  -8.395   3.054  -4.162
  485    HE1  TYR  66           HE1      TYR  66  -9.399  -0.884  -1.318
  486    HE2  TYR  66           HE2      TYR  66  -9.298   0.979  -5.190
  487    HH   TYR  66           HH       TYR  66  -9.249  -1.932  -3.787
  488    H    HIS  67           H        HIS  67  -5.555   4.884  -3.908
  489    HA   HIS  67           HA       HIS  67  -5.911   2.654  -5.806
  490   1HB   HIS  67          1HB       HIS  67  -6.542   4.730  -6.681
  491   2HB   HIS  67          2HB       HIS  67  -5.210   5.575  -5.892
  492    HD1  HIS  67           HD1      HIS  67  -5.779   3.047  -8.680
  493    HD2  HIS  67           HD2      HIS  67  -2.969   5.891  -7.503
  494    HE1  HIS  67           HE1      HIS  67  -4.028   3.119 -10.504
  495    H    ALA  68           H        ALA  68  -3.164   4.901  -5.453
  496    HA   ALA  68           HA       ALA  68  -1.171   3.317  -6.584
  497   1HB   ALA  68          1HB       ALA  68  -1.299   5.447  -4.481
  498   2HB   ALA  68          2HB       ALA  68  -0.560   5.501  -6.082
  499   3HB   ALA  68          3HB       ALA  68   0.248   4.649  -4.764
  500    H    MET  69           H        MET  69  -2.735   2.824  -3.499
  501    HA   MET  69           HA       MET  69  -0.557   1.147  -2.441
  502   1HB   MET  69          1HB       MET  69  -3.353   1.802  -1.486
  503   2HB   MET  69          2HB       MET  69  -2.129   0.966  -0.532
  504   1HG   MET  69          1HG       MET  69  -1.141   3.444  -1.732
  505   2HG   MET  69          2HG       MET  69  -2.478   3.708  -0.617
  506   1HE   MET  69          1HE       MET  69   1.613   3.789   0.551
  507   2HE   MET  69          2HE       MET  69   0.415   4.887  -0.128
  508   3HE   MET  69          3HE       MET  69   1.040   3.563  -1.109
  509    H    HIS  70           H        HIS  70  -3.859   0.642  -3.722
  510    HA   HIS  70           HA       HIS  70  -3.413  -2.295  -3.492
  511   1HB   HIS  70          1HB       HIS  70  -5.897  -0.730  -4.239
  512   2HB   HIS  70          2HB       HIS  70  -5.822  -2.420  -3.740
  513    HD1  HIS  70           HD1      HIS  70  -6.036   1.006  -2.426
  514    HD2  HIS  70           HD2      HIS  70  -5.073  -2.755  -0.926
  515    HE1  HIS  70           HE1      HIS  70  -6.162   1.192   0.092
  516    H    ASP  71           H        ASP  71  -3.416   0.259  -5.797
  517    HA   ASP  71           HA       ASP  71  -4.131  -1.434  -8.092
  518   1HB   ASP  71          1HB       ASP  71  -3.093   1.399  -7.801
  519   2HB   ASP  71          2HB       ASP  71  -3.716   0.698  -9.290
  520    H    LYS  72           H        LYS  72  -2.688  -2.312  -9.550
  521    HA   LYS  72           HA       LYS  72   0.215  -2.139  -8.867
  522   1HB   LYS  72          1HB       LYS  72   0.292  -4.218 -10.272
  523   2HB   LYS  72          2HB       LYS  72  -0.817  -4.358  -8.907
  524   1HG   LYS  72          1HG       LYS  72  -2.119  -3.230 -11.265
  525   2HG   LYS  72          2HG       LYS  72  -1.450  -4.832 -11.577
  526   1HD   LYS  72          1HD       LYS  72  -2.881  -5.865 -10.118
  527   2HD   LYS  72          2HD       LYS  72  -2.890  -4.499  -9.001
  528   1HE   LYS  72          1HE       LYS  72  -4.261  -3.239 -10.764
  529   2HE   LYS  72          2HE       LYS  72  -4.471  -4.808 -11.567
  530   1HZ   LYS  72          1HZ       LYS  72  -5.319  -5.733  -9.523
  531   2HZ   LYS  72          2HZ       LYS  72  -6.236  -4.363  -9.935
  532   3HZ   LYS  72          3HZ       LYS  72  -5.068  -4.269  -8.705
  533    H    GLY  73           H        GLY  73   1.333  -2.791 -11.307
  534   1HA   GLY  73          1HA       GLY  73   2.149  -1.609 -13.186
  535   2HA   GLY  73          2HA       GLY  73   0.453  -1.662 -13.671
  536    H    THR  74           H        THR  74   1.391   0.008 -10.759
  537    HA   THR  74           HA       THR  74   0.263   2.520 -11.738
  538    HB   THR  74           HB       THR  74   1.271   3.151  -9.373
  539    HG1  THR  74           1HG      THR  74   2.547   1.138  -9.494
  540   1HG2  THR  74          1HG2      THR  74  -1.083   2.936  -9.591
  541   2HG2  THR  74          2HG2      THR  74  -0.645   1.812  -8.303
  542   3HG2  THR  74          3HG2      THR  74  -0.972   1.208  -9.928
  543    H    LYS  75           H        LYS  75   1.574   4.590 -11.537
  544    HA   LYS  75           HA       LYS  75   3.752   4.845 -13.186
  545   1HB   LYS  75          1HB       LYS  75   2.401   6.501 -11.587
  546   2HB   LYS  75          2HB       LYS  75   3.812   6.289 -10.554
  547   1HG   LYS  75          1HG       LYS  75   4.091   8.231 -12.057
  548   2HG   LYS  75          2HG       LYS  75   5.283   6.980 -12.405
  549   1HD   LYS  75          1HD       LYS  75   3.020   6.350 -13.972
  550   2HD   LYS  75          2HD       LYS  75   3.267   8.088 -14.149
  551   1HE   LYS  75          1HE       LYS  75   5.112   7.764 -15.427
  552   2HE   LYS  75          2HE       LYS  75   5.797   6.627 -14.247
  553   1HZ   LYS  75          1HZ       LYS  75   5.331   5.198 -15.952
  554   2HZ   LYS  75          2HZ       LYS  75   4.002   6.101 -16.508
  555   3HZ   LYS  75          3HZ       LYS  75   3.854   5.131 -15.121
  556    H    PHE  76           H        PHE  76   3.782   3.705  -9.844
  557    HA   PHE  76           HA       PHE  76   6.590   2.737 -10.237
  558   1HB   PHE  76          1HB       PHE  76   5.471   4.128  -7.784
  559   2HB   PHE  76          2HB       PHE  76   7.122   3.560  -7.999
  560    HD1  PHE  76           HD1      PHE  76   8.520   4.577  -9.886
  561    HD2  PHE  76           HD2      PHE  76   4.760   6.210  -8.604
  562    HE1  PHE  76           HE1      PHE  76   9.064   6.721 -11.010
  563    HE2  PHE  76           HE2      PHE  76   5.304   8.351  -9.725
  564    HZ   PHE  76           HZ       PHE  76   7.452   8.600 -10.926
  565    H    LYS  77           H        LYS  77   7.108   1.152  -8.282
  566    HA   LYS  77           HA       LYS  77   5.030  -0.860  -8.263
  567   1HB   LYS  77          1HB       LYS  77   6.564  -1.975  -6.676
  568   2HB   LYS  77          2HB       LYS  77   7.405  -1.412  -8.116
  569   1HG   LYS  77          1HG       LYS  77   8.039   0.663  -6.831
  570   2HG   LYS  77          2HG       LYS  77   7.366  -0.099  -5.390
  571   1HD   LYS  77          1HD       LYS  77   9.842  -0.443  -5.612
  572   2HD   LYS  77          2HD       LYS  77   8.933  -1.952  -5.579
  573   1HE   LYS  77          1HE       LYS  77   9.453  -0.703  -8.253
  574   2HE   LYS  77          2HE       LYS  77  10.785  -1.554  -7.445
  575   1HZ   LYS  77          1HZ       LYS  77   9.802  -3.509  -7.769
  576   2HZ   LYS  77          2HZ       LYS  77   8.712  -2.726  -8.810
  577   3HZ   LYS  77          3HZ       LYS  77   8.315  -2.952  -7.173
  578    H    SER  78           H        SER  78   3.243  -0.566  -7.187
  579    HA   SER  78           HA       SER  78   2.911   1.286  -4.974
  580   1HB   SER  78          1HB       SER  78   0.600  -0.081  -5.116
  581   2HB   SER  78          2HB       SER  78   1.034   1.154  -6.293
  582    HG   SER  78           HG       SER  78   0.621  -0.547  -7.547
  583    H    CYS  79           H        CYS  79   1.602   0.419  -2.999
  584    HA   CYS  79           HA       CYS  79   3.214  -1.335  -1.444
  585   1HB   CYS  79          1HB       CYS  79   0.285  -0.572  -1.214
  586   2HB   CYS  79          2HB       CYS  79   1.275  -1.203   0.097
  587    H    VAL  80           H        VAL  80  -0.142  -2.001  -2.487
  588    HA   VAL  80           HA       VAL  80   0.090  -4.858  -2.170
  589    HB   VAL  80           HB       VAL  80  -1.784  -2.969  -3.602
  590   1HG1  VAL  80          1HG1      VAL  80  -3.045  -5.475  -3.307
  591   2HG1  VAL  80          2HG1      VAL  80  -1.475  -5.804  -4.041
  592   3HG1  VAL  80          3HG1      VAL  80  -2.591  -4.678  -4.815
  593   1HG2  VAL  80          1HG2      VAL  80  -3.126  -4.475  -1.655
  594   2HG2  VAL  80          2HG2      VAL  80  -2.573  -2.810  -1.480
  595   3HG2  VAL  80          3HG2      VAL  80  -1.551  -4.139  -0.936
  596    H    GLY  81           H        GLY  81   0.825  -2.626  -4.772
  597   1HA   GLY  81          1HA       GLY  81   0.951  -4.609  -6.885
  598   2HA   GLY  81          2HA       GLY  81   1.638  -2.984  -6.954
  599    H    CYS  82           H        CYS  82   3.338  -3.094  -4.720
  600    HA   CYS  82           HA       CYS  82   5.588  -4.624  -5.805
  601   1HB   CYS  82          1HB       CYS  82   5.476  -2.319  -4.542
  602   2HB   CYS  82          2HB       CYS  82   5.448  -3.314  -3.089
  603    H    HIS  83           H        HIS  83   3.123  -4.990  -3.411
  604    HA   HIS  83           HA       HIS  83   4.391  -7.063  -1.834
  605   1HB   HIS  83          1HB       HIS  83   1.743  -5.719  -2.143
  606   2HB   HIS  83          2HB       HIS  83   1.769  -7.251  -1.288
  607    HD1  HIS  83           HD1      HIS  83   1.297  -5.976   0.983
  608    HD2  HIS  83           HD2      HIS  83   4.881  -4.940  -0.875
  609    HE1  HIS  83           HE1      HIS  83   2.668  -4.747   2.716
  610    H    LEU  84           H        LEU  84   1.597  -7.204  -4.119
  611    HA   LEU  84           HA       LEU  84   1.374  -9.984  -4.348
  612   1HB   LEU  84          1HB       LEU  84   0.408  -7.638  -5.539
  613   2HB   LEU  84          2HB       LEU  84   1.096  -8.561  -6.871
  614    HG   LEU  84           HG       LEU  84  -0.654  -9.916  -4.849
  615   1HD1  LEU  84          1HD1      LEU  84  -1.738  -8.662  -7.373
  616   2HD1  LEU  84          2HD1      LEU  84  -1.751  -7.799  -5.834
  617   3HD1  LEU  84          3HD1      LEU  84  -2.637  -9.315  -6.003
  618   1HD2  LEU  84          1HD2      LEU  84  -1.056 -11.453  -6.679
  619   2HD2  LEU  84          2HD2      LEU  84   0.684 -11.180  -6.578
  620   3HD2  LEU  84          3HD2      LEU  84  -0.267 -10.369  -7.823
  621    H    GLU  85           H        GLU  85   3.735  -7.784  -5.768
  622    HA   GLU  85           HA       GLU  85   4.887  -9.841  -7.531
  623   1HB   GLU  85          1HB       GLU  85   5.566  -6.987  -6.770
  624   2HB   GLU  85          2HB       GLU  85   6.543  -7.929  -7.898
  625   1HG   GLU  85          1HG       GLU  85   3.565  -7.625  -8.279
  626   2HG   GLU  85          2HG       GLU  85   4.698  -6.423  -8.902
  627    H    THR  86           H        THR  86   6.004  -7.957  -4.686
  628    HA   THR  86           HA       THR  86   8.480  -9.268  -4.292
  629    HB   THR  86           HB       THR  86   6.464  -7.856  -2.554
  630    HG1  THR  86           1HG      THR  86   7.750  -6.268  -2.982
  631   1HG2  THR  86          1HG2      THR  86   9.091  -8.995  -1.561
  632   2HG2  THR  86          2HG2      THR  86   7.505  -9.660  -1.170
  633   3HG2  THR  86          3HG2      THR  86   7.939  -8.039  -0.629
  634    H    ALA  87           H        ALA  87   5.255 -10.432  -3.863
  635    HA   ALA  87           HA       ALA  87   6.035 -12.599  -2.013
  636   1HB   ALA  87          1HB       ALA  87   3.553 -11.454  -3.225
  637   2HB   ALA  87          2HB       ALA  87   3.885 -11.872  -1.544
  638   3HB   ALA  87          3HB       ALA  87   3.497 -13.140  -2.708
  639    H    GLY  88           H        GLY  88   5.189 -12.133  -5.413
  640   1HA   GLY  88          1HA       GLY  88   5.410 -13.552  -7.264
  641   2HA   GLY  88          2HA       GLY  88   6.680 -14.360  -6.343
  642    H    ALA  89           H        ALA  89   6.226 -16.508  -6.381
  643    HA   ALA  89           HA       ALA  89   3.405 -17.429  -6.258
  644   1HB   ALA  89          1HB       ALA  89   5.350 -18.201  -7.828
  645   2HB   ALA  89          2HB       ALA  89   4.278 -19.421  -7.141
  646   3HB   ALA  89          3HB       ALA  89   5.868 -19.143  -6.430
  647    H    ASP  90           H        ASP  90   4.198 -16.272  -3.848
  648    HA   ASP  90           HA       ASP  90   4.655 -18.644  -2.081
  649   1HB   ASP  90          1HB       ASP  90   6.492 -17.045  -2.068
  650   2HB   ASP  90          2HB       ASP  90   5.378 -15.715  -1.766
  651    H    ALA  91           H        ALA  91   2.300 -18.909  -2.215
  652    HA   ALA  91           HA       ALA  91   0.212 -17.228  -1.673
  653   1HB   ALA  91          1HB       ALA  91  -0.749 -19.204  -0.387
  654   2HB   ALA  91          2HB       ALA  91   0.839 -19.959  -0.517
  655   3HB   ALA  91          3HB       ALA  91  -0.090 -19.600  -1.973
  656    H    ALA  92           H        ALA  92   2.744 -18.111   0.591
  657    HA   ALA  92           HA       ALA  92   1.390 -17.089   2.966
  658   1HB   ALA  92          1HB       ALA  92   3.459 -17.632   4.025
  659   2HB   ALA  92          2HB       ALA  92   4.362 -17.440   2.522
  660   3HB   ALA  92          3HB       ALA  92   3.296 -18.828   2.739
  661    H    LYS  93           H        LYS  93   3.780 -15.917   0.644
  662    HA   LYS  93           HA       LYS  93   4.142 -13.327   1.914
  663   1HB   LYS  93          1HB       LYS  93   4.960 -14.829  -0.504
  664   2HB   LYS  93          2HB       LYS  93   4.988 -13.078  -0.664
  665   1HG   LYS  93          1HG       LYS  93   6.333 -12.976   1.457
  666   2HG   LYS  93          2HG       LYS  93   6.403 -14.739   1.435
  667   1HD   LYS  93          1HD       LYS  93   7.430 -14.603  -0.856
  668   2HD   LYS  93          2HD       LYS  93   7.504 -12.850  -0.664
  669   1HE   LYS  93          1HE       LYS  93   9.565 -13.263   0.245
  670   2HE   LYS  93          2HE       LYS  93   8.650 -13.739   1.689
  671   1HZ   LYS  93          1HZ       LYS  93   8.395 -15.934   0.242
  672   2HZ   LYS  93          2HZ       LYS  93   9.694 -15.699   1.314
  673   3HZ   LYS  93          3HZ       LYS  93   9.897 -15.412  -0.348
  674    H    LYS  94           H        LYS  94   1.915 -14.751  -0.371
  675    HA   LYS  94           HA       LYS  94   0.949 -12.228  -1.488
  676   1HB   LYS  94          1HB       LYS  94   0.676 -15.043  -1.889
  677   2HB   LYS  94          2HB       LYS  94  -0.944 -14.381  -1.664
  678   1HG   LYS  94          1HG       LYS  94   0.456 -12.552  -3.321
  679   2HG   LYS  94          2HG       LYS  94   0.775 -14.165  -3.962
  680   1HD   LYS  94          1HD       LYS  94  -1.906 -14.318  -3.394
  681   2HD   LYS  94          2HD       LYS  94  -1.744 -12.635  -3.899
  682   1HE   LYS  94          1HE       LYS  94  -1.546 -13.264  -6.066
  683   2HE   LYS  94          2HE       LYS  94  -0.213 -14.365  -5.660
  684   1HZ   LYS  94          1HZ       LYS  94  -2.046 -15.668  -6.448
  685   2HZ   LYS  94          2HZ       LYS  94  -3.122 -14.906  -5.378
  686   3HZ   LYS  94          3HZ       LYS  94  -1.901 -15.924  -4.779
  687    H    LYS  95           H        LYS  95   0.222 -14.210   1.304
  688    HA   LYS  95           HA       LYS  95  -2.327 -12.830   1.865
  689   1HB   LYS  95          1HB       LYS  95  -2.512 -14.462   3.584
  690   2HB   LYS  95          2HB       LYS  95  -1.669 -15.300   2.282
  691   1HG   LYS  95          1HG       LYS  95  -0.062 -15.784   3.788
  692   2HG   LYS  95          2HG       LYS  95   0.376 -14.077   3.731
  693   1HD   LYS  95          1HD       LYS  95  -1.187 -13.589   5.558
  694   2HD   LYS  95          2HD       LYS  95  -1.687 -15.280   5.599
  695   1HE   LYS  95          1HE       LYS  95   1.211 -15.064   5.762
  696   2HE   LYS  95          2HE       LYS  95   0.422 -14.154   7.066
  697   1HZ   LYS  95          1HZ       LYS  95  -1.051 -16.126   7.373
  698   2HZ   LYS  95          2HZ       LYS  95   0.575 -16.404   7.779
  699   3HZ   LYS  95          3HZ       LYS  95  -0.049 -16.986   6.309
  700    H    GLU  96           H        GLU  96   1.038 -12.543   2.632
  701    HA   GLU  96           HA       GLU  96   0.573 -10.832   5.008
  702   1HB   GLU  96          1HB       GLU  96   2.985 -11.028   5.207
  703   2HB   GLU  96          2HB       GLU  96   2.352 -12.613   4.797
  704   1HG   GLU  96          1HG       GLU  96   2.947 -12.295   2.477
  705   2HG   GLU  96          2HG       GLU  96   3.464 -10.641   2.805
  706    H    LEU  97           H        LEU  97   1.952 -10.654   1.764
  707    HA   LEU  97           HA       LEU  97   2.476  -7.784   1.887
  708   1HB   LEU  97          1HB       LEU  97   2.391  -9.758  -0.405
  709   2HB   LEU  97          2HB       LEU  97   3.160  -8.171  -0.436
  710    HG   LEU  97           HG       LEU  97   3.962 -10.602   1.159
  711   1HD1  LEU  97          1HD1      LEU  97   5.236  -8.778  -0.866
  712   2HD1  LEU  97          2HD1      LEU  97   5.036 -10.529  -0.935
  713   3HD1  LEU  97          3HD1      LEU  97   6.209  -9.818   0.175
  714   1HD2  LEU  97          1HD2      LEU  97   4.866  -7.731   1.565
  715   2HD2  LEU  97          2HD2      LEU  97   5.570  -9.145   2.350
  716   3HD2  LEU  97          3HD2      LEU  97   3.908  -8.675   2.706
  717    H    THR  98           H        THR  98   0.401  -9.617  -0.381
  718    HA   THR  98           HA       THR  98  -1.225  -7.207  -0.837
  719    HB   THR  98           HB       THR  98  -2.332  -8.747  -2.477
  720    HG1  THR  98           1HG      THR  98  -1.614 -10.593  -0.975
  721   1HG2  THR  98          1HG2      THR  98   0.514  -9.247  -3.006
  722   2HG2  THR  98          2HG2      THR  98   0.160  -7.578  -2.561
  723   3HG2  THR  98          3HG2      THR  98  -0.655  -8.313  -3.940
  724    H    GLY  99           H        GLY  99  -1.387  -9.998   1.198
  725   1HA   GLY  99          1HA       GLY  99  -4.113 -10.518   1.440
  726   2HA   GLY  99          2HA       GLY  99  -3.007 -10.556   2.815
  727    H    CYS 100           H        CYS 100  -5.807  -9.213   1.866
  728    HA   CYS 100           HA       CYS 100  -5.356  -6.471   2.812
  729   1HB   CYS 100          1HB       CYS 100  -8.091  -7.515   2.545
  730   2HB   CYS 100          2HB       CYS 100  -7.388  -6.075   1.865
  731    H    LYS 101           H        LYS 101  -7.644  -9.012   3.829
  732    HA   LYS 101           HA       LYS 101  -7.731  -7.744   6.503
  733   1HB   LYS 101          1HB       LYS 101  -9.335  -9.842   5.036
  734   2HB   LYS 101          2HB       LYS 101  -9.629  -9.461   6.733
  735   1HG   LYS 101          1HG       LYS 101  -9.913  -7.053   6.079
  736   2HG   LYS 101          2HG       LYS 101  -9.795  -7.546   4.389
  737   1HD   LYS 101          1HD       LYS 101 -12.154  -7.367   5.087
  738   2HD   LYS 101          2HD       LYS 101 -11.741  -9.034   4.685
  739   1HE   LYS 101          1HE       LYS 101 -11.943  -9.751   6.864
  740   2HE   LYS 101          2HE       LYS 101 -11.356  -8.213   7.529
  741   1HZ   LYS 101          1HZ       LYS 101 -13.397  -7.159   7.017
  742   2HZ   LYS 101          2HZ       LYS 101 -13.804  -8.612   7.799
  743   3HZ   LYS 101          3HZ       LYS 101 -13.947  -8.483   6.111
  744    H    GLY 102           H        GLY 102  -5.513  -9.696   5.380
  745   1HA   GLY 102          1HA       GLY 102  -5.159 -11.083   7.936
  746   2HA   GLY 102          2HA       GLY 102  -5.454 -12.165   6.576
  747    H    SER 103           H        SER 103  -3.610  -9.114   6.574
  748    HA   SER 103           HA       SER 103  -1.201 -10.706   5.802
  749   1HB   SER 103          1HB       SER 103  -0.799  -9.039   4.171
  750   2HB   SER 103          2HB       SER 103  -2.513  -9.371   4.068
  751    HG   SER 103           HG       SER 103  -2.477  -7.225   4.233
  752    H    LYS 104           H        LYS 104   0.327  -8.226   5.630
  753    HA   LYS 104           HA       LYS 104   0.890  -7.807   8.533
  754   1HB   LYS 104          1HB       LYS 104   2.386  -7.280   5.945
  755   2HB   LYS 104          2HB       LYS 104   3.039  -6.960   7.551
  756   1HG   LYS 104          1HG       LYS 104   1.959  -9.694   7.005
  757   2HG   LYS 104          2HG       LYS 104   3.521  -9.270   6.306
  758   1HD   LYS 104          1HD       LYS 104   4.466  -8.807   8.452
  759   2HD   LYS 104          2HD       LYS 104   2.883  -8.843   9.231
  760   1HE   LYS 104          1HE       LYS 104   2.713 -11.193   9.061
  761   2HE   LYS 104          2HE       LYS 104   3.954 -11.278   7.794
  762   1HZ   LYS 104          1HZ       LYS 104   5.620 -10.611   9.328
  763   2HZ   LYS 104          2HZ       LYS 104   4.759 -11.875  10.069
  764   3HZ   LYS 104          3HZ       LYS 104   4.479 -10.265  10.534
  765    H    CYS 105           H        CYS 105  -0.103  -6.319   5.584
  766    HA   CYS 105           HA       CYS 105   0.301  -3.557   6.389
  767   1HB   CYS 105          1HB       CYS 105  -0.087  -5.066   4.091
  768   2HB   CYS 105          2HB       CYS 105  -1.591  -4.196   4.259
  769    H    HIS 106           H        HIS 106  -2.299  -5.910   6.655
  770    HA   HIS 106           HA       HIS 106  -4.061  -3.766   7.801
  771   1HB   HIS 106          1HB       HIS 106  -4.489  -6.028   5.905
  772   2HB   HIS 106          2HB       HIS 106  -5.811  -5.642   7.010
  773    HD1  HIS 106           HD1      HIS 106  -5.196  -2.525   7.075
  774    HD2  HIS 106           HD2      HIS 106  -5.717  -4.829   3.619
  775    HE1  HIS 106           HE1      HIS 106  -5.766  -0.905   5.222
  776    H    SER 107           H        SER 107  -2.965  -4.374   9.896
  777    HA   SER 107           HA       SER 107  -3.397  -7.068  10.965
  778   1HB   SER 107          1HB       SER 107  -1.459  -5.544  11.473
  779   2HB   SER 107          2HB       SER 107  -2.576  -4.481  12.325
  780    HG   SER 107           HG       SER 107  -1.434  -6.813  13.121
  781    HHA  HEC 201           HHA      HEC 201   5.999   8.661   5.678
  782    HHB  HEC 201           HHB      HEC 201  12.056   9.842   4.824
  783    HHC  HEC 201           HHC      HEC 201  12.585   4.660   1.174
  784    HHD  HEC 201           HHD      HEC 201   6.470   3.594   1.845
  785   1HMA  HEC 201          1HMA      HEC 201  11.236  10.637   7.059
  786   2HMA  HEC 201          2HMA      HEC 201   9.710  10.779   7.937
  787   3HMA  HEC 201          3HMA      HEC 201  10.100  11.924   6.652
  788   1HAA  HEC 201          1HAA      HEC 201   6.666   9.580   7.526
  789   2HAA  HEC 201          2HAA      HEC 201   7.806  10.893   7.812
  790   1HBA  HEC 201          1HBA      HEC 201   6.497  11.267   5.271
  791   2HBA  HEC 201          2HBA      HEC 201   5.293  11.061   6.543
  792   1HMB  HEC 201          1HMB      HEC 201  15.097   8.354   4.443
  793   2HMB  HEC 201          2HMB      HEC 201  13.986   9.720   4.340
  794   3HMB  HEC 201          3HMB      HEC 201  14.922   9.235   2.926
  795    HAB  HEC 201           HAB      HEC 201  14.448   5.490   1.321
  796   1HBB  HEC 201          1HBB      HEC 201  16.617   6.306   2.959
  797   2HBB  HEC 201          2HBB      HEC 201  15.847   4.720   2.909
  798   3HBB  HEC 201          3HBB      HEC 201  15.275   5.943   4.042
  799   1HMC  HEC 201          1HMC      HEC 201  11.408   1.602   0.567
  800   2HMC  HEC 201          2HMC      HEC 201  10.939   2.449  -0.908
  801   3HMC  HEC 201          3HMC      HEC 201  12.256   3.072   0.088
  802    HAC  HEC 201           HAC      HEC 201   7.150   2.164   0.680
  803   1HBC  HEC 201          1HBC      HEC 201   8.077   0.091  -0.252
  804   2HBC  HEC 201          2HBC      HEC 201   8.794   0.424   1.324
  805   3HBC  HEC 201          3HBC      HEC 201   9.706   0.760  -0.148
  806   1HMD  HEC 201          1HMD      HEC 201   4.815   3.363   2.875
  807   2HMD  HEC 201          2HMD      HEC 201   3.477   4.511   2.864
  808   3HMD  HEC 201          3HMD      HEC 201   4.023   3.801   4.384
  809   1HAD  HEC 201          1HAD      HEC 201   4.127   7.973   5.339
  810   2HAD  HEC 201          2HAD      HEC 201   3.118   7.017   4.262
  811   1HBD  HEC 201          1HBD      HEC 201   4.355   5.717   6.670
  812   2HBD  HEC 201          2HBD      HEC 201   2.907   6.705   6.860
  813    HHA  HEC 202           HHA      HEC 202   1.492   7.641  -9.502
  814    HHB  HEC 202           HHB      HEC 202   2.876   4.009  -4.911
  815    HHC  HEC 202           HHC      HEC 202   4.497   8.824  -1.250
  816    HHD  HEC 202           HHD      HEC 202   2.703  12.830  -5.870
  817   1HMA  HEC 202          1HMA      HEC 202   2.086   2.740  -7.264
  818   2HMA  HEC 202          2HMA      HEC 202   0.396   3.156  -7.550
  819   3HMA  HEC 202          3HMA      HEC 202   1.029   3.120  -5.904
  820   1HAA  HEC 202          1HAA      HEC 202   1.066   5.252 -10.053
  821   2HAA  HEC 202          2HAA      HEC 202  -0.013   4.344  -9.033
  822   1HBA  HEC 202          1HBA      HEC 202  -1.390   6.303  -8.660
  823   2HBA  HEC 202          2HBA      HEC 202  -0.265   7.304  -9.569
  824   1HMB  HEC 202          1HMB      HEC 202   5.029   3.525  -2.206
  825   2HMB  HEC 202          2HMB      HEC 202   3.367   3.553  -1.615
  826   3HMB  HEC 202          3HMB      HEC 202   3.694   3.184  -3.308
  827    HAB  HEC 202           HAB      HEC 202   4.136   6.919   0.037
  828   1HBB  HEC 202          1HBB      HEC 202   6.548   6.174  -1.260
  829   2HBB  HEC 202          2HBB      HEC 202   6.289   5.012   0.040
  830   3HBB  HEC 202          3HBB      HEC 202   6.352   6.737   0.401
  831   1HMC  HEC 202          1HMC      HEC 202   4.664  12.657  -1.004
  832   2HMC  HEC 202          2HMC      HEC 202   5.833  11.349  -1.176
  833   3HMC  HEC 202          3HMC      HEC 202   4.287  11.050  -0.384
  834    HAC  HEC 202           HAC      HEC 202   2.797  13.903  -4.067
  835   1HBC  HEC 202          1HBC      HEC 202   5.258  14.292  -3.928
  836   2HBC  HEC 202          2HBC      HEC 202   5.200  13.977  -2.193
  837   3HBC  HEC 202          3HBC      HEC 202   4.379  15.388  -2.861
  838   1HMD  HEC 202          1HMD      HEC 202   2.876  13.438  -8.420
  839   2HMD  HEC 202          2HMD      HEC 202   1.137  13.375  -8.131
  840   3HMD  HEC 202          3HMD      HEC 202   1.786  12.920  -9.707
  841   1HAD  HEC 202          1HAD      HEC 202   1.756   9.226 -10.743
  842   2HAD  HEC 202          2HAD      HEC 202   1.076  10.842 -10.852
  843   1HBD  HEC 202          1HBD      HEC 202   3.421  11.752 -10.718
  844   2HBD  HEC 202          2HBD      HEC 202   4.005  10.091 -10.832
  845    HHA  HEC 203           HHA      HEC 203   7.083  -6.910   4.617
  846    HHB  HEC 203           HHB      HEC 203   2.720  -2.126   4.921
  847    HHC  HEC 203           HHC      HEC 203   4.590  -0.011  -0.454
  848    HHD  HEC 203           HHD      HEC 203   8.988  -4.495  -0.891
  849   1HMA  HEC 203          1HMA      HEC 203   3.540  -3.398   7.635
  850   2HMA  HEC 203          2HMA      HEC 203   3.108  -5.107   7.573
  851   3HMA  HEC 203          3HMA      HEC 203   2.220  -3.937   6.597
  852   1HAA  HEC 203          1HAA      HEC 203   4.845  -6.183   7.723
  853   2HAA  HEC 203          2HAA      HEC 203   4.622  -7.373   6.448
  854   1HBA  HEC 203          1HBA      HEC 203   6.846  -7.840   6.324
  855   2HBA  HEC 203          2HBA      HEC 203   7.312  -6.154   6.551
  856   1HMB  HEC 203          1HMB      HEC 203   2.172   1.276   4.080
  857   2HMB  HEC 203          2HMB      HEC 203   2.239  -0.155   5.109
  858   3HMB  HEC 203          3HMB      HEC 203   1.045  -0.055   3.814
  859    HAB  HEC 203           HAB      HEC 203   2.834   0.844   0.086
  860   1HBB  HEC 203          1HBB      HEC 203   3.333   3.061   0.476
  861   2HBB  HEC 203          2HBB      HEC 203   4.439   2.329   1.640
  862   3HBB  HEC 203          3HBB      HEC 203   2.883   2.958   2.179
  863   1HMC  HEC 203          1HMC      HEC 203   5.527   0.284  -2.206
  864   2HMC  HEC 203          2HMC      HEC 203   7.190   0.177  -2.783
  865   3HMC  HEC 203          3HMC      HEC 203   5.942  -0.840  -3.501
  866    HAC  HEC 203           HAC      HEC 203   9.209  -3.344  -2.524
  867   1HBC  HEC 203          1HBC      HEC 203   9.846  -1.566  -3.909
  868   2HBC  HEC 203          2HBC      HEC 203   9.097  -0.712  -2.561
  869   3HBC  HEC 203          3HBC      HEC 203   8.196  -0.961  -4.052
  870   1HMD  HEC 203          1HMD      HEC 203  10.098  -7.751   0.341
  871   2HMD  HEC 203          2HMD      HEC 203  11.048  -6.426   1.014
  872   3HMD  HEC 203          3HMD      HEC 203  10.165  -6.201  -0.496
  873   1HAD  HEC 203          1HAD      HEC 203  10.168  -7.818   3.177
  874   2HAD  HEC 203          2HAD      HEC 203   8.700  -7.964   4.136
  875   1HBD  HEC 203          1HBD      HEC 203   7.675  -9.304   2.300
  876   2HBD  HEC 203          2HBD      HEC 203   9.204  -9.221   1.426
  877    HHA  HEC 204           HHA      HEC 204  -6.736   2.255   3.909
  878    HHB  HEC 204           HHB      HEC 204  -9.917  -1.993   0.672
  879    HHC  HEC 204           HHC      HEC 204  -4.725  -5.874   0.975
  880    HHD  HEC 204           HHD      HEC 204  -1.409  -0.941   2.772
  881   1HMA  HEC 204          1HMA      HEC 204 -10.927   1.073   0.836
  882   2HMA  HEC 204          2HMA      HEC 204 -11.611   0.532   2.370
  883   3HMA  HEC 204          3HMA      HEC 204 -11.232  -0.643   1.111
  884   1HAA  HEC 204          1HAA      HEC 204  -9.986   2.098   4.342
  885   2HAA  HEC 204          2HAA      HEC 204  -8.503   2.901   3.838
  886   1HBA  HEC 204          1HBA      HEC 204  -9.470   3.440   1.672
  887   2HBA  HEC 204          2HBA      HEC 204 -10.905   2.493   2.048
  888   1HMB  HEC 204          1HMB      HEC 204  -9.546  -4.624  -1.749
  889   2HMB  HEC 204          2HMB      HEC 204 -10.394  -3.730  -0.489
  890   3HMB  HEC 204          3HMB      HEC 204 -10.090  -5.456  -0.292
  891    HAB  HEC 204           HAB      HEC 204  -6.401  -6.917   0.171
  892   1HBB  HEC 204          1HBB      HEC 204  -5.471  -6.263  -1.893
  893   2HBB  HEC 204          2HBB      HEC 204  -7.024  -5.704  -2.517
  894   3HBB  HEC 204          3HBB      HEC 204  -6.717  -7.431  -2.335
  895   1HMC  HEC 204          1HMC      HEC 204  -2.952  -6.612   1.478
  896   2HMC  HEC 204          2HMC      HEC 204  -1.572  -6.042   0.539
  897   3HMC  HEC 204          3HMC      HEC 204  -1.458  -6.155   2.295
  898    HAC  HEC 204           HAC      HEC 204  -0.330  -2.451   2.984
  899   1HBC  HEC 204          1HBC      HEC 204   0.208  -2.618   0.499
  900   2HBC  HEC 204          2HBC      HEC 204   0.477  -4.342   0.749
  901   3HBC  HEC 204          3HBC      HEC 204   1.496  -3.162   1.574
  902   1HMD  HEC 204          1HMD      HEC 204  -1.113   1.153   4.511
  903   2HMD  HEC 204          2HMD      HEC 204  -0.941   1.488   2.788
  904   3HMD  HEC 204          3HMD      HEC 204  -1.563   2.734   3.871
  905   1HAD  HEC 204          1HAD      HEC 204  -3.664   3.918   3.720
  906   2HAD  HEC 204          2HAD      HEC 204  -5.294   3.513   4.247
  907   1HBD  HEC 204          1HBD      HEC 204  -3.957   2.268   6.187
  908   2HBD  HEC 204          2HBD      HEC 204  -2.747   3.482   5.783
  Start of MODEL    3
    1   1H    ALA   1          1H        ALA   1  21.432  14.431   2.118
    2   2H    ALA   1          2H        ALA   1  20.420  14.809   3.429
    3   3H    ALA   1          3H        ALA   1  20.139  15.508   1.907
    4    HA   ALA   1           HA       ALA   1  19.167  13.640   1.050
    5   1HB   ALA   1          1HB       ALA   1  21.379  12.515   2.610
    6   2HB   ALA   1          2HB       ALA   1  20.695  11.960   1.082
    7   3HB   ALA   1          3HB       ALA   1  19.954  11.477   2.608
    8    HA   PRO   2           HA       PRO   2  15.881  13.441   3.954
    9   1HB   PRO   2          1HB       PRO   2  14.568  11.185   3.133
   10   2HB   PRO   2          2HB       PRO   2  14.527  12.708   2.230
   11   1HG   PRO   2          1HG       PRO   2  16.139  10.259   1.736
   12   2HG   PRO   2          2HG       PRO   2  15.364  11.352   0.579
   13   1HD   PRO   2          1HD       PRO   2  18.036  11.392   1.141
   14   2HD   PRO   2          2HD       PRO   2  17.125  12.812   0.581
   15    H    LYS   3           H        LYS   3  15.682  12.647   6.037
   16    HA   LYS   3           HA       LYS   3  17.310  10.264   6.759
   17   1HB   LYS   3          1HB       LYS   3  15.830  12.307   8.427
   18   2HB   LYS   3          2HB       LYS   3  16.960  11.098   9.031
   19   1HG   LYS   3          1HG       LYS   3  18.812  12.190   8.172
   20   2HG   LYS   3          2HG       LYS   3  17.893  12.933   6.862
   21   1HD   LYS   3          1HD       LYS   3  16.689  14.254   8.746
   22   2HD   LYS   3          2HD       LYS   3  18.053  13.768   9.754
   23   1HE   LYS   3          1HE       LYS   3  19.616  14.768   8.091
   24   2HE   LYS   3          2HE       LYS   3  18.219  15.321   7.146
   25   1HZ   LYS   3          1HZ       LYS   3  17.426  16.256   9.394
   26   2HZ   LYS   3          2HZ       LYS   3  18.619  17.110   8.538
   27   3HZ   LYS   3          3HZ       LYS   3  19.053  16.131   9.857
   28    H    ALA   4           H        ALA   4  15.837   8.712   5.870
   29    HA   ALA   4           HA       ALA   4  13.128   8.342   6.143
   30   1HB   ALA   4          1HB       ALA   4  13.605   6.104   5.728
   31   2HB   ALA   4          2HB       ALA   4  14.932   6.069   6.890
   32   3HB   ALA   4          3HB       ALA   4  15.158   6.832   5.316
   33    HA   PRO   5           HA       PRO   5  12.482   8.392  10.508
   34   1HB   PRO   5          1HB       PRO   5   9.843   7.649  10.464
   35   2HB   PRO   5          2HB       PRO   5  10.410   9.284  10.089
   36   1HG   PRO   5          1HG       PRO   5   9.485   7.145   8.264
   37   2HG   PRO   5          2HG       PRO   5   9.388   8.901   8.096
   38   1HD   PRO   5          1HD       PRO   5  11.230   7.263   6.809
   39   2HD   PRO   5          2HD       PRO   5  11.374   9.019   7.013
   40    H    ALA   6           H        ALA   6  11.916   6.842  12.221
   41    HA   ALA   6           HA       ALA   6  13.041   4.273  11.871
   42   1HB   ALA   6          1HB       ALA   6  12.390   3.973  14.125
   43   2HB   ALA   6          2HB       ALA   6  10.945   4.964  13.928
   44   3HB   ALA   6          3HB       ALA   6  12.536   5.724  13.965
   45    H    ASP   7           H        ASP   7  11.606   2.275  12.604
   46    HA   ASP   7           HA       ASP   7   9.579   1.891  10.510
   47   1HB   ASP   7          1HB       ASP   7  10.468  -0.008  12.690
   48   2HB   ASP   7          2HB       ASP   7   9.859  -0.404  11.086
   49    H    GLY   8           H        GLY   8   7.454   0.972  11.126
   50   1HA   GLY   8          1HA       GLY   8   5.701   0.569  12.748
   51   2HA   GLY   8          2HA       GLY   8   6.572   1.589  13.892
   52    H    LEU   9           H        LEU   9   6.428   2.875  10.724
   53    HA   LEU   9           HA       LEU   9   4.981   5.209  11.530
   54   1HB   LEU   9          1HB       LEU   9   6.379   4.249   9.283
   55   2HB   LEU   9          2HB       LEU   9   4.749   4.598   8.700
   56    HG   LEU   9           HG       LEU   9   5.917   6.611  10.530
   57   1HD1  LEU   9          1HD1      LEU   9   7.905   6.536   9.363
   58   2HD1  LEU   9          2HD1      LEU   9   6.986   7.535   8.235
   59   3HD1  LEU   9          3HD1      LEU   9   7.159   5.803   7.941
   60   1HD2  LEU   9          1HD2      LEU   9   4.997   7.996   8.446
   61   2HD2  LEU   9          2HD2      LEU   9   3.893   7.321   9.650
   62   3HD2  LEU   9          3HD2      LEU   9   4.145   6.485   8.119
   63    H    LYS  10           H        LYS  10   2.830   5.351  11.940
   64    HA   LYS  10           HA       LYS  10   1.070   3.148  11.019
   65   1HB   LYS  10          1HB       LYS  10   1.172   5.118  13.191
   66   2HB   LYS  10          2HB       LYS  10  -0.444   4.881  12.521
   67   1HG   LYS  10          1HG       LYS  10   0.160   2.333  12.675
   68   2HG   LYS  10          2HG       LYS  10   1.357   2.879  13.851
   69   1HD   LYS  10          1HD       LYS  10  -0.289   3.741  15.306
   70   2HD   LYS  10          2HD       LYS  10  -1.520   3.760  14.043
   71   1HE   LYS  10          1HE       LYS  10  -1.354   1.223  13.979
   72   2HE   LYS  10          2HE       LYS  10  -0.358   1.333  15.444
   73   1HZ   LYS  10          1HZ       LYS  10  -2.974   2.699  15.200
   74   2HZ   LYS  10          2HZ       LYS  10  -2.073   2.403  16.610
   75   3HZ   LYS  10          3HZ       LYS  10  -2.841   1.120  15.803
   76    H    MET  11           H        MET  11   0.191   3.422   9.054
   77    HA   MET  11           HA       MET  11  -0.356   6.088   7.926
   78   1HB   MET  11          1HB       MET  11  -0.399   3.213   7.085
   79   2HB   MET  11          2HB       MET  11  -1.384   4.347   6.160
   80   1HG   MET  11          1HG       MET  11   0.526   5.691   5.621
   81   2HG   MET  11          2HG       MET  11   1.538   4.820   6.774
   82   1HE   MET  11          1HE       MET  11   0.751   5.337   3.261
   83   2HE   MET  11          2HE       MET  11  -0.729   4.459   3.638
   84   3HE   MET  11          3HE       MET  11   0.437   3.765   2.514
   85    H    ASP  12           H        ASP  12  -2.109   7.020   9.038
   86    HA   ASP  12           HA       ASP  12  -4.565   5.319   9.338
   87   1HB   ASP  12          1HB       ASP  12  -5.065   7.235  11.030
   88   2HB   ASP  12          2HB       ASP  12  -3.847   6.039  11.453
   89    H    LYS  13           H        LYS  13  -3.486   7.223   7.077
   90    HA   LYS  13           HA       LYS  13  -5.089   9.495   6.771
   91   1HB   LYS  13          1HB       LYS  13  -3.911   7.419   4.950
   92   2HB   LYS  13          2HB       LYS  13  -4.902   8.707   4.267
   93   1HG   LYS  13          1HG       LYS  13  -2.443   9.070   6.006
   94   2HG   LYS  13          2HG       LYS  13  -2.548   9.394   4.273
   95   1HD   LYS  13          1HD       LYS  13  -4.504  10.984   4.909
   96   2HD   LYS  13          2HD       LYS  13  -3.853  10.885   6.545
   97   1HE   LYS  13          1HE       LYS  13  -1.674  11.333   4.717
   98   2HE   LYS  13          2HE       LYS  13  -2.935  12.552   4.436
   99   1HZ   LYS  13          1HZ       LYS  13  -3.066  12.697   6.950
  100   2HZ   LYS  13          2HZ       LYS  13  -1.691  13.382   6.225
  101   3HZ   LYS  13          3HZ       LYS  13  -1.590  11.865   6.983
  102    H    THR  14           H        THR  14  -5.988   6.114   6.502
  103    HA   THR  14           HA       THR  14  -8.774   6.935   5.725
  104    HB   THR  14           HB       THR  14  -8.872   4.548   4.874
  105    HG1  THR  14           1HG      THR  14  -7.208   3.682   6.084
  106   1HG2  THR  14          1HG2      THR  14  -6.544   5.895   3.563
  107   2HG2  THR  14          2HG2      THR  14  -8.097   6.729   3.590
  108   3HG2  THR  14          3HG2      THR  14  -7.962   5.143   2.831
  109    H    LYS  15           H        LYS  15 -10.211   4.769   6.417
  110    HA   LYS  15           HA       LYS  15 -10.315   4.873   9.323
  111   1HB   LYS  15          1HB       LYS  15 -11.814   3.727   7.034
  112   2HB   LYS  15          2HB       LYS  15 -11.989   2.860   8.560
  113   1HG   LYS  15          1HG       LYS  15 -13.512   4.412   9.156
  114   2HG   LYS  15          2HG       LYS  15 -12.179   5.563   9.262
  115   1HD   LYS  15          1HD       LYS  15 -14.032   6.342   7.767
  116   2HD   LYS  15          2HD       LYS  15 -12.482   6.204   6.936
  117   1HE   LYS  15          1HE       LYS  15 -13.555   4.892   5.420
  118   2HE   LYS  15          2HE       LYS  15 -13.646   3.657   6.691
  119   1HZ   LYS  15          1HZ       LYS  15 -15.833   4.534   5.678
  120   2HZ   LYS  15          2HZ       LYS  15 -15.559   5.902   6.650
  121   3HZ   LYS  15          3HZ       LYS  15 -15.726   4.368   7.363
  122    H    GLN  16           H        GLN  16  -8.878   2.777   6.940
  123    HA   GLN  16           HA       GLN  16  -8.287   0.696   9.002
  124   1HB   GLN  16          1HB       GLN  16  -8.536   0.858   6.031
  125   2HB   GLN  16          2HB       GLN  16  -7.380  -0.312   6.670
  126   1HG   GLN  16          1HG       GLN  16  -9.012  -1.649   7.523
  127   2HG   GLN  16          2HG       GLN  16  -9.993  -0.280   8.046
  128   1HE2  GLN  16          2HE2      GLN  16 -10.758   1.066   5.887
  129   2HE2  GLN  16          1HE2      GLN  16 -11.479   0.080   4.708
  130    HA   PRO  17           HA       PRO  17  -4.469   3.252   8.768
  131   1HB   PRO  17          1HB       PRO  17  -3.770   2.815  11.388
  132   2HB   PRO  17          2HB       PRO  17  -4.871   4.110  10.873
  133   1HG   PRO  17          1HG       PRO  17  -5.514   1.415  11.986
  134   2HG   PRO  17          2HG       PRO  17  -6.241   2.988  12.355
  135   1HD   PRO  17          1HD       PRO  17  -7.434   1.218  10.713
  136   2HD   PRO  17          2HD       PRO  17  -7.562   2.974  10.459
  137    H    VAL  18           H        VAL  18  -2.474   2.404   8.252
  138    HA   VAL  18           HA       VAL  18  -1.919  -0.440   9.012
  139    HB   VAL  18           HB       VAL  18  -1.615   1.120   6.443
  140   1HG1  VAL  18          1HG1      VAL  18  -0.311  -0.727   5.541
  141   2HG1  VAL  18          2HG1      VAL  18  -0.405  -1.583   7.080
  142   3HG1  VAL  18          3HG1      VAL  18   0.506  -0.078   6.962
  143   1HG2  VAL  18          1HG2      VAL  18  -3.628   0.047   6.232
  144   2HG2  VAL  18          2HG2      VAL  18  -3.228  -1.154   7.459
  145   3HG2  VAL  18          3HG2      VAL  18  -2.609  -1.331   5.818
  146    H    VAL  19           H        VAL  19   0.111  -0.763   9.914
  147    HA   VAL  19           HA       VAL  19   1.821   1.589  10.385
  148    HB   VAL  19           HB       VAL  19   1.745  -1.304  11.248
  149   1HG1  VAL  19          1HG1      VAL  19   3.674  -0.172  12.828
  150   2HG1  VAL  19          2HG1      VAL  19   4.023   0.577  11.270
  151   3HG1  VAL  19          3HG1      VAL  19   4.013  -1.180  11.421
  152   1HG2  VAL  19          1HG2      VAL  19   0.251   0.509  12.254
  153   2HG2  VAL  19          2HG2      VAL  19   1.726   1.239  12.890
  154   3HG2  VAL  19          3HG2      VAL  19   1.252  -0.381  13.402
  155    H    PHE  20           H        PHE  20   3.469   2.109   8.964
  156    HA   PHE  20           HA       PHE  20   4.441  -0.001   7.092
  157   1HB   PHE  20          1HB       PHE  20   3.654   2.114   6.128
  158   2HB   PHE  20          2HB       PHE  20   4.763   3.022   7.149
  159    HD1  PHE  20           HD1      PHE  20   4.855   0.103   4.799
  160    HD2  PHE  20           HD2      PHE  20   6.803   3.666   6.186
  161    HE1  PHE  20           HE1      PHE  20   6.654  -0.224   3.125
  162    HE2  PHE  20           HE2      PHE  20   8.593   3.340   4.511
  163    HZ   PHE  20           HZ       PHE  20   8.524   1.396   2.981
  164    H    ASN  21           H        ASN  21   6.321  -1.017   7.664
  165    HA   ASN  21           HA       ASN  21   8.129   0.270   9.629
  166   1HB   ASN  21          1HB       ASN  21   7.192  -2.359   8.922
  167   2HB   ASN  21          2HB       ASN  21   8.947  -2.318   8.836
  168   1HD2  ASN  21          2HD2      ASN  21   8.786  -3.780  10.826
  169   2HD2  ASN  21          1HD2      ASN  21   8.599  -3.044  12.343
  170    H    HIS  22           H        HIS  22   9.343   1.757   8.343
  171    HA   HIS  22           HA       HIS  22  10.312   1.452   5.737
  172   1HB   HIS  22          1HB       HIS  22  11.235   2.799   8.247
  173   2HB   HIS  22          2HB       HIS  22  12.335   2.778   6.871
  174    HD1  HIS  22           HD1      HIS  22   9.538   4.618   8.243
  175    HD2  HIS  22           HD2      HIS  22  10.947   3.855   4.391
  176    HE1  HIS  22           HE1      HIS  22   8.562   6.415   6.756
  177    H    SER  23           H        SER  23  11.548   0.048   8.746
  178    HA   SER  23           HA       SER  23  14.071  -0.893   7.996
  179   1HB   SER  23          1HB       SER  23  13.601  -1.466  10.158
  180   2HB   SER  23          2HB       SER  23  11.882  -1.658   9.827
  181    HG   SER  23           HG       SER  23  12.730  -3.671  10.259
  182    H    THR  24           H        THR  24  10.888  -2.343   7.298
  183    HA   THR  24           HA       THR  24  12.020  -4.603   5.834
  184    HB   THR  24           HB       THR  24   9.251  -3.977   5.252
  185    HG1  THR  24           1HG      THR  24   8.562  -3.351   7.130
  186   1HG2  THR  24          1HG2      THR  24  10.858  -6.178   5.891
  187   2HG2  THR  24          2HG2      THR  24   9.122  -6.201   5.580
  188   3HG2  THR  24          3HG2      THR  24   9.721  -6.050   7.232
  189    H    HIS  25           H        HIS  25  11.808  -1.357   5.120
  190    HA   HIS  25           HA       HIS  25  11.570  -1.896   2.192
  191   1HB   HIS  25          1HB       HIS  25  10.736   0.493   3.863
  192   2HB   HIS  25          2HB       HIS  25  10.529   0.341   2.121
  193    HD1  HIS  25           HD1      HIS  25   9.262  -1.011   5.379
  194    HD2  HIS  25           HD2      HIS  25   8.498  -1.494   1.310
  195    HE1  HIS  25           HE1      HIS  25   7.143  -2.383   5.207
  196    H    LYS  26           H        LYS  26  13.662  -0.935   4.660
  197    HA   LYS  26           HA       LYS  26  15.126   1.231   3.564
  198   1HB   LYS  26          1HB       LYS  26  16.059  -1.212   5.112
  199   2HB   LYS  26          2HB       LYS  26  16.969   0.291   4.951
  200   1HG   LYS  26          1HG       LYS  26  14.882   1.451   5.916
  201   2HG   LYS  26          2HG       LYS  26  14.352  -0.164   6.383
  202   1HD   LYS  26          1HD       LYS  26  15.548   0.250   8.277
  203   2HD   LYS  26          2HD       LYS  26  16.929  -0.197   7.275
  204   1HE   LYS  26          1HE       LYS  26  17.408   1.946   8.355
  205   2HE   LYS  26          2HE       LYS  26  17.144   2.242   6.625
  206   1HZ   LYS  26          1HZ       LYS  26  15.833   3.633   8.358
  207   2HZ   LYS  26          2HZ       LYS  26  14.856   2.247   8.479
  208   3HZ   LYS  26          3HZ       LYS  26  15.029   3.041   6.987
  209    H    ALA  27           H        ALA  27  15.085  -2.188   2.745
  210    HA   ALA  27           HA       ALA  27  17.427  -2.007   0.972
  211   1HB   ALA  27          1HB       ALA  27  16.706  -4.396   0.507
  212   2HB   ALA  27          2HB       ALA  27  15.355  -4.129   1.609
  213   3HB   ALA  27          3HB       ALA  27  17.011  -4.044   2.209
  214    H    VAL  28           H        VAL  28  14.159  -1.175   0.756
  215    HA   VAL  28           HA       VAL  28  13.719  -1.912  -2.047
  216    HB   VAL  28           HB       VAL  28  12.309  -0.202   0.011
  217   1HG1  VAL  28          1HG1      VAL  28  11.482  -0.824  -2.833
  218   2HG1  VAL  28          2HG1      VAL  28  11.817   0.771  -2.157
  219   3HG1  VAL  28          3HG1      VAL  28  10.412  -0.140  -1.609
  220   1HG2  VAL  28          1HG2      VAL  28  11.067  -2.578  -1.261
  221   2HG2  VAL  28          2HG2      VAL  28  11.014  -2.048   0.420
  222   3HG2  VAL  28          3HG2      VAL  28  12.433  -2.899  -0.191
  223    H    LYS  29           H        LYS  29  12.988   0.097  -3.495
  224    HA   LYS  29           HA       LYS  29  15.319   1.910  -3.527
  225   1HB   LYS  29          1HB       LYS  29  13.426   0.790  -5.392
  226   2HB   LYS  29          2HB       LYS  29  13.484   2.547  -5.555
  227   1HG   LYS  29          1HG       LYS  29  15.273   2.034  -6.900
  228   2HG   LYS  29          2HG       LYS  29  16.109   2.085  -5.346
  229   1HD   LYS  29          1HD       LYS  29  15.134  -0.502  -5.426
  230   2HD   LYS  29          2HD       LYS  29  15.584  -0.205  -7.105
  231   1HE   LYS  29          1HE       LYS  29  17.787   0.790  -6.028
  232   2HE   LYS  29          2HE       LYS  29  17.330  -0.247  -4.662
  233   1HZ   LYS  29          1HZ       LYS  29  18.584  -1.595  -6.129
  234   2HZ   LYS  29          2HZ       LYS  29  17.728  -1.047  -7.491
  235   3HZ   LYS  29          3HZ       LYS  29  16.963  -2.045  -6.349
  236    H    CYS  30           H        CYS  30  15.074   3.513  -2.076
  237    HA   CYS  30           HA       CYS  30  12.793   4.694  -0.998
  238   1HB   CYS  30          1HB       CYS  30  15.539   5.692  -1.724
  239   2HB   CYS  30          2HB       CYS  30  14.364   6.810  -1.035
  240    H    GLY  31           H        GLY  31  14.056   4.981  -4.229
  241   1HA   GLY  31          1HA       GLY  31  12.346   7.299  -4.875
  242   2HA   GLY  31          2HA       GLY  31  13.464   6.499  -5.982
  243    H    ASP  32           H        ASP  32  12.064   3.895  -4.794
  244    HA   ASP  32           HA       ASP  32  10.181   3.656  -7.025
  245   1HB   ASP  32          1HB       ASP  32  11.756   1.987  -5.428
  246   2HB   ASP  32          2HB       ASP  32  10.107   1.580  -4.971
  247    H    CYS  33           H        CYS  33  10.066   4.161  -3.541
  248    HA   CYS  33           HA       CYS  33   7.095   4.049  -3.506
  249   1HB   CYS  33          1HB       CYS  33   9.330   4.331  -1.483
  250   2HB   CYS  33          2HB       CYS  33   7.656   4.626  -1.025
  251    H    HIS  34           H        HIS  34   9.695   6.335  -2.561
  252    HA   HIS  34           HA       HIS  34   7.829   8.629  -2.732
  253   1HB   HIS  34          1HB       HIS  34  10.737   8.241  -1.958
  254   2HB   HIS  34          2HB       HIS  34   9.955   9.816  -1.978
  255    HD1  HIS  34           HD1      HIS  34   7.519   9.748  -0.519
  256    HD2  HIS  34           HD2      HIS  34  10.531   7.057   0.510
  257    HE1  HIS  34           HE1      HIS  34   7.047   9.011   1.858
  258    H    HIS  35           H        HIS  35   8.433   7.189  -5.198
  259    HA   HIS  35           HA       HIS  35  10.378   7.904  -6.923
  260   1HB   HIS  35          1HB       HIS  35   8.524   8.139  -8.634
  261   2HB   HIS  35          2HB       HIS  35   8.394   6.721  -7.608
  262    HD1  HIS  35           HD1      HIS  35   7.037  10.183  -7.958
  263    HD2  HIS  35           HD2      HIS  35   6.083   6.637  -6.020
  264    HE1  HIS  35           HE1      HIS  35   4.738  10.527  -6.963
  265    HA   PRO  36           HA       PRO  36  10.797  12.239  -7.350
  266   1HB   PRO  36          1HB       PRO  36  11.039  12.561 -10.066
  267   2HB   PRO  36          2HB       PRO  36  12.327  11.884  -9.049
  268   1HG   PRO  36          1HG       PRO  36  10.320  10.472 -10.746
  269   2HG   PRO  36          2HG       PRO  36  12.049  10.144 -10.537
  270   1HD   PRO  36          1HD       PRO  36  10.151   8.693  -9.287
  271   2HD   PRO  36          2HD       PRO  36  11.733   9.021  -8.545
  272    H    VAL  37           H        VAL  37   9.117  13.645  -7.043
  273    HA   VAL  37           HA       VAL  37   6.702  13.385  -8.790
  274    HB   VAL  37           HB       VAL  37   7.255  14.241  -5.958
  275   1HG1  VAL  37          1HG1      VAL  37   5.900  16.063  -6.668
  276   2HG1  VAL  37          2HG1      VAL  37   4.775  14.926  -5.925
  277   3HG1  VAL  37          3HG1      VAL  37   4.898  15.024  -7.682
  278   1HG2  VAL  37          1HG2      VAL  37   6.620  11.870  -6.697
  279   2HG2  VAL  37          2HG2      VAL  37   5.032  12.530  -7.091
  280   3HG2  VAL  37          3HG2      VAL  37   5.622  12.583  -5.430
  281    H    ASN  38           H        ASN  38   9.335  14.944  -9.150
  282    HA   ASN  38           HA       ASN  38   8.330  17.195 -10.572
  283   1HB   ASN  38          1HB       ASN  38   7.792  17.696  -8.070
  284   2HB   ASN  38          2HB       ASN  38   9.506  17.975  -7.901
  285   1HD2  ASN  38          2HD2      ASN  38   6.897  19.798  -8.129
  286   2HD2  ASN  38          1HD2      ASN  38   7.435  21.040  -9.155
  287    H    GLY  39           H        GLY  39  10.941  17.508  -8.260
  288   1HA   GLY  39          1HA       GLY  39  12.935  16.905 -10.389
  289   2HA   GLY  39          2HA       GLY  39  13.089  18.362  -9.398
  290    H    LYS  40           H        LYS  40  11.666  16.084  -7.469
  291    HA   LYS  40           HA       LYS  40  14.085  14.594  -6.694
  292   1HB   LYS  40          1HB       LYS  40  14.048  15.695  -4.400
  293   2HB   LYS  40          2HB       LYS  40  14.585  16.742  -5.716
  294   1HG   LYS  40          1HG       LYS  40  12.444  17.824  -5.841
  295   2HG   LYS  40          2HG       LYS  40  11.715  16.638  -4.758
  296   1HD   LYS  40          1HD       LYS  40  13.897  17.629  -3.321
  297   2HD   LYS  40          2HD       LYS  40  13.207  19.051  -4.104
  298   1HE   LYS  40          1HE       LYS  40  11.226  18.906  -2.927
  299   2HE   LYS  40          2HE       LYS  40  11.296  17.136  -2.831
  300   1HZ   LYS  40          1HZ       LYS  40  11.849  18.474  -0.727
  301   2HZ   LYS  40          2HZ       LYS  40  13.328  18.808  -1.493
  302   3HZ   LYS  40          3HZ       LYS  40  12.885  17.201  -1.160
  303    H    GLU  41           H        GLU  41  13.367  12.658  -5.873
  304    HA   GLU  41           HA       GLU  41  10.706  11.842  -5.643
  305   1HB   GLU  41          1HB       GLU  41  13.317  11.037  -4.437
  306   2HB   GLU  41          2HB       GLU  41  11.854  10.269  -3.829
  307   1HG   GLU  41          1HG       GLU  41  11.508   9.107  -5.761
  308   2HG   GLU  41          2HG       GLU  41  12.043  10.448  -6.775
  309    H    ASP  42           H        ASP  42   9.132  12.796  -4.398
  310    HA   ASP  42           HA       ASP  42   9.633  14.410  -2.095
  311   1HB   ASP  42          1HB       ASP  42   7.233  12.910  -3.151
  312   2HB   ASP  42          2HB       ASP  42   7.143  13.961  -1.738
  313    H    TYR  43           H        TYR  43  10.738  13.478  -0.400
  314    HA   TYR  43           HA       TYR  43  10.204  10.695   0.408
  315   1HB   TYR  43          1HB       TYR  43  12.020  12.889   1.461
  316   2HB   TYR  43          2HB       TYR  43  12.048  11.216   2.017
  317    HD1  TYR  43           HD1      TYR  43  12.464   9.370   0.277
  318    HD2  TYR  43           HD2      TYR  43  13.199  13.534  -0.482
  319    HE1  TYR  43           HE1      TYR  43  13.937   8.764  -1.622
  320    HE2  TYR  43           HE2      TYR  43  14.673  12.927  -2.382
  321    HH   TYR  43           HH       TYR  43  15.056   9.548  -3.402
  322    H    GLN  44           H        GLN  44   7.850  12.077   0.750
  323    HA   GLN  44           HA       GLN  44   7.723  12.473   3.723
  324   1HB   GLN  44          1HB       GLN  44   5.894  14.153   3.106
  325   2HB   GLN  44          2HB       GLN  44   7.537  14.621   2.668
  326   1HG   GLN  44          1HG       GLN  44   7.191  13.921   0.376
  327   2HG   GLN  44          2HG       GLN  44   5.616  13.236   0.776
  328   1HE2  GLN  44          2HE2      GLN  44   7.162  16.412   1.547
  329   2HE2  GLN  44          1HE2      GLN  44   5.871  17.345   0.960
  330    H    LYS  45           H        LYS  45   5.312  12.286   4.436
  331    HA   LYS  45           HA       LYS  45   4.330   9.737   4.230
  332   1HB   LYS  45          1HB       LYS  45   2.070  10.846   4.633
  333   2HB   LYS  45          2HB       LYS  45   3.361  11.328   5.728
  334   1HG   LYS  45          1HG       LYS  45   3.805  13.257   4.080
  335   2HG   LYS  45          2HG       LYS  45   2.234  12.860   3.386
  336   1HD   LYS  45          1HD       LYS  45   1.945  14.609   5.060
  337   2HD   LYS  45          2HD       LYS  45   1.214  13.116   5.651
  338   1HE   LYS  45          1HE       LYS  45   2.849  12.795   7.270
  339   2HE   LYS  45          2HE       LYS  45   4.087  13.660   6.335
  340   1HZ   LYS  45          1HZ       LYS  45   2.328  15.596   6.628
  341   2HZ   LYS  45          2HZ       LYS  45   3.542  15.305   7.782
  342   3HZ   LYS  45          3HZ       LYS  45   1.965  14.726   8.039
  343    H    CYS  46           H        CYS  46   3.241   8.524   2.744
  344    HA   CYS  46           HA       CYS  46   3.222   9.108  -0.015
  345   1HB   CYS  46          1HB       CYS  46   1.496   7.303   1.699
  346   2HB   CYS  46          2HB       CYS  46   1.626   7.175  -0.051
  347    H    ALA  47           H        ALA  47   0.727   9.593   2.447
  348    HA   ALA  47           HA       ALA  47  -1.030  10.900   0.404
  349   1HB   ALA  47          1HB       ALA  47  -1.362   9.259   2.829
  350   2HB   ALA  47          2HB       ALA  47  -2.399   9.386   1.410
  351   3HB   ALA  47          3HB       ALA  47  -2.502  10.596   2.687
  352    H    THR  48           H        THR  48   1.031  12.532   1.163
  353    HA   THR  48           HA       THR  48   0.873  14.087   3.467
  354    HB   THR  48           HB       THR  48   1.297  15.385   0.801
  355    HG1  THR  48           1HG      THR  48   3.307  14.284   0.694
  356   1HG2  THR  48          1HG2      THR  48   1.975  15.895   3.505
  357   2HG2  THR  48          2HG2      THR  48   2.457  16.819   2.083
  358   3HG2  THR  48          3HG2      THR  48   3.480  15.507   2.671
  359    H    ALA  49           H        ALA  49   0.252  16.678   2.910
  360    HA   ALA  49           HA       ALA  49  -2.639  16.740   3.115
  361   1HB   ALA  49          1HB       ALA  49  -0.565  18.294   3.918
  362   2HB   ALA  49          2HB       ALA  49  -2.224  18.886   3.820
  363   3HB   ALA  49          3HB       ALA  49  -1.094  19.204   2.503
  364    H    GLY  50           H        GLY  50  -0.581  16.556   0.439
  365   1HA   GLY  50          1HA       GLY  50  -2.806  17.283  -1.376
  366   2HA   GLY  50          2HA       GLY  50  -1.281  18.151  -1.596
  367    H    CYS  51           H        CYS  51  -1.159  14.943  -0.401
  368    HA   CYS  51           HA       CYS  51   0.066  14.009  -2.944
  369   1HB   CYS  51          1HB       CYS  51   0.513  13.902  -0.077
  370   2HB   CYS  51          2HB       CYS  51   0.589  12.311  -0.763
  371    H    HIS  52           H        HIS  52  -0.408  11.227  -1.437
  372    HA   HIS  52           HA       HIS  52  -2.832  10.557  -2.933
  373   1HB   HIS  52          1HB       HIS  52  -1.027   9.073  -1.009
  374   2HB   HIS  52          2HB       HIS  52  -2.368   8.317  -1.844
  375    HD1  HIS  52           HD1      HIS  52  -2.244   8.706  -4.550
  376    HD2  HIS  52           HD2      HIS  52   1.326   8.895  -2.440
  377    HE1  HIS  52           HE1      HIS  52  -0.397   8.346  -6.252
  378    H    ASP  53           H        ASP  53  -3.529  12.544  -1.110
  379    HA   ASP  53           HA       ASP  53  -4.596  11.253   1.325
  380   1HB   ASP  53          1HB       ASP  53  -5.085  13.553   1.958
  381   2HB   ASP  53          2HB       ASP  53  -3.461  13.489   1.273
  382    H    ASN  54           H        ASN  54  -5.727  10.826  -1.575
  383    HA   ASN  54           HA       ASN  54  -8.409  12.003  -1.396
  384   1HB   ASN  54          1HB       ASN  54  -6.733  10.803  -3.333
  385   2HB   ASN  54          2HB       ASN  54  -8.153   9.773  -3.221
  386   1HD2  ASN  54          2HD2      ASN  54  -9.735  10.415  -4.666
  387   2HD2  ASN  54          1HD2      ASN  54 -10.059  12.018  -5.119
  388    H    MET  55           H        MET  55  -9.457  11.207   0.452
  389    HA   MET  55           HA       MET  55  -9.349   8.388   1.205
  390   1HB   MET  55          1HB       MET  55 -11.135  10.673   2.103
  391   2HB   MET  55          2HB       MET  55 -10.868   9.164   2.971
  392   1HG   MET  55          1HG       MET  55  -8.775  11.264   2.344
  393   2HG   MET  55          2HG       MET  55  -9.452  10.905   3.932
  394   1HE   MET  55          1HE       MET  55  -5.627   9.635   2.771
  395   2HE   MET  55          2HE       MET  55  -6.596  11.103   2.678
  396   3HE   MET  55          3HE       MET  55  -6.633   9.946   1.350
  397    H    ASP  56           H        ASP  56 -10.613   9.407  -1.481
  398    HA   ASP  56           HA       ASP  56 -13.425   8.638  -1.241
  399   1HB   ASP  56          1HB       ASP  56 -11.844  10.113  -2.973
  400   2HB   ASP  56          2HB       ASP  56 -12.166   8.647  -3.899
  401    H    LYS  57           H        LYS  57 -10.424   7.014  -1.629
  402    HA   LYS  57           HA       LYS  57  -9.897   4.754  -2.069
  403   1HB   LYS  57          1HB       LYS  57 -12.818   4.430  -1.333
  404   2HB   LYS  57          2HB       LYS  57 -11.553   3.214  -1.172
  405   1HG   LYS  57          1HG       LYS  57 -10.559   4.296   0.636
  406   2HG   LYS  57          2HG       LYS  57 -11.223   5.868   0.188
  407   1HD   LYS  57          1HD       LYS  57 -13.482   4.302   0.618
  408   2HD   LYS  57          2HD       LYS  57 -12.373   3.792   1.891
  409   1HE   LYS  57          1HE       LYS  57 -11.985   6.360   2.248
  410   2HE   LYS  57          2HE       LYS  57 -13.528   6.527   1.385
  411   1HZ   LYS  57          1HZ       LYS  57 -13.606   6.166   3.911
  412   2HZ   LYS  57          2HZ       LYS  57 -13.207   4.552   3.556
  413   3HZ   LYS  57          3HZ       LYS  57 -14.638   5.231   2.941
  414    H    LYS  58           H        LYS  58 -11.423   6.549  -4.159
  415    HA   LYS  58           HA       LYS  58 -12.035   4.284  -6.026
  416   1HB   LYS  58          1HB       LYS  58 -13.510   6.920  -5.721
  417   2HB   LYS  58          2HB       LYS  58 -13.933   5.621  -6.837
  418   1HG   LYS  58          1HG       LYS  58 -13.722   4.388  -4.319
  419   2HG   LYS  58          2HG       LYS  58 -14.589   5.895  -4.026
  420   1HD   LYS  58          1HD       LYS  58 -15.985   5.233  -6.121
  421   2HD   LYS  58          2HD       LYS  58 -15.343   3.614  -5.841
  422   1HE   LYS  58          1HE       LYS  58 -16.342   4.889  -3.386
  423   2HE   LYS  58          2HE       LYS  58 -17.599   4.631  -4.614
  424   1HZ   LYS  58          1HZ       LYS  58 -15.839   2.661  -3.317
  425   2HZ   LYS  58          2HZ       LYS  58 -16.396   2.363  -4.894
  426   3HZ   LYS  58          3HZ       LYS  58 -17.504   2.570  -3.623
  427    H    ASP  59           H        ASP  59 -10.392   7.260  -5.452
  428    HA   ASP  59           HA       ASP  59 -10.159   8.285  -8.112
  429   1HB   ASP  59          1HB       ASP  59  -9.518   9.690  -6.334
  430   2HB   ASP  59          2HB       ASP  59  -8.559   8.427  -5.562
  431    H    LYS  60           H        LYS  60  -9.487   6.917  -9.754
  432    HA   LYS  60           HA       LYS  60  -7.351   4.929  -9.266
  433   1HB   LYS  60          1HB       LYS  60  -9.522   5.456 -11.161
  434   2HB   LYS  60          2HB       LYS  60  -8.036   4.952 -11.967
  435   1HG   LYS  60          1HG       LYS  60  -8.930   3.447  -9.535
  436   2HG   LYS  60          2HG       LYS  60  -9.749   3.144 -11.067
  437   1HD   LYS  60          1HD       LYS  60  -7.141   3.105 -11.867
  438   2HD   LYS  60          2HD       LYS  60  -7.000   2.453 -10.234
  439   1HE   LYS  60          1HE       LYS  60  -7.531   0.472 -11.271
  440   2HE   LYS  60          2HE       LYS  60  -9.193   1.086 -11.148
  441   1HZ   LYS  60          1HZ       LYS  60  -7.360   1.146 -13.447
  442   2HZ   LYS  60          2HZ       LYS  60  -8.518   2.378 -13.284
  443   3HZ   LYS  60          3HZ       LYS  60  -9.009   0.756 -13.402
  444    H    SER  61           H        SER  61  -6.820   7.919  -9.250
  445    HA   SER  61           HA       SER  61  -5.034   8.162 -11.633
  446   1HB   SER  61          1HB       SER  61  -6.873   9.854 -10.616
  447   2HB   SER  61          2HB       SER  61  -5.470  10.382  -9.691
  448    HG   SER  61           HG       SER  61  -5.345  11.526 -11.536
  449    H    ALA  62           H        ALA  62  -3.306  10.108 -10.407
  450    HA   ALA  62           HA       ALA  62  -1.625   8.281  -8.756
  451   1HB   ALA  62          1HB       ALA  62   0.034   9.199  -9.983
  452   2HB   ALA  62          2HB       ALA  62  -0.461  10.829  -9.525
  453   3HB   ALA  62          3HB       ALA  62  -1.208  10.037 -10.912
  454    H    LYS  63           H        LYS  63  -3.983   9.819  -7.663
  455    HA   LYS  63           HA       LYS  63  -2.493  11.319  -5.536
  456   1HB   LYS  63          1HB       LYS  63  -3.805  12.549  -7.545
  457   2HB   LYS  63          2HB       LYS  63  -5.158  12.296  -6.441
  458   1HG   LYS  63          1HG       LYS  63  -4.416  14.275  -5.555
  459   2HG   LYS  63          2HG       LYS  63  -3.317  13.204  -4.685
  460   1HD   LYS  63          1HD       LYS  63  -1.611  13.523  -6.436
  461   2HD   LYS  63          2HD       LYS  63  -2.706  14.593  -7.312
  462   1HE   LYS  63          1HE       LYS  63  -2.352  15.338  -4.481
  463   2HE   LYS  63          2HE       LYS  63  -0.872  15.460  -5.453
  464   1HZ   LYS  63          1HZ       LYS  63  -3.411  16.875  -5.754
  465   2HZ   LYS  63          2HZ       LYS  63  -2.603  16.429  -7.180
  466   3HZ   LYS  63          3HZ       LYS  63  -1.831  17.420  -6.038
  467    H    GLY  64           H        GLY  64  -4.542   8.797  -6.221
  468   1HA   GLY  64          1HA       GLY  64  -6.209   9.177  -3.790
  469   2HA   GLY  64          2HA       GLY  64  -6.502   7.978  -5.042
  470    H    TYR  65           H        TYR  65  -5.713   8.129  -1.944
  471    HA   TYR  65           HA       TYR  65  -3.356   6.662  -1.489
  472   1HB   TYR  65          1HB       TYR  65  -5.497   7.648  -0.065
  473   2HB   TYR  65          2HB       TYR  65  -5.725   5.910   0.109
  474    HD1  TYR  65           HD1      TYR  65  -5.108   5.616   2.397
  475    HD2  TYR  65           HD2      TYR  65  -2.475   7.673  -0.295
  476    HE1  TYR  65           HE1      TYR  65  -3.314   5.566   4.106
  477    HE2  TYR  65           HE2      TYR  65  -0.683   7.622   1.410
  478    HH   TYR  65           HH       TYR  65  -1.230   6.121   4.602
  479    H    TYR  66           H        TYR  66  -6.637   5.242  -1.546
  480    HA   TYR  66           HA       TYR  66  -6.160   2.565  -1.601
  481   1HB   TYR  66          1HB       TYR  66  -8.260   4.133  -1.987
  482   2HB   TYR  66          2HB       TYR  66  -7.985   3.710  -3.677
  483    HD1  TYR  66           HD1      TYR  66  -8.175   1.386  -4.445
  484    HD2  TYR  66           HD2      TYR  66  -8.919   2.482  -0.366
  485    HE1  TYR  66           HE1      TYR  66  -9.260  -0.811  -4.060
  486    HE2  TYR  66           HE2      TYR  66 -10.009   0.283   0.022
  487    HH   TYR  66           HH       TYR  66 -10.231  -2.145  -2.580
  488    H    HIS  67           H        HIS  67  -6.588   4.235  -4.730
  489    HA   HIS  67           HA       HIS  67  -5.753   2.328  -6.487
  490   1HB   HIS  67          1HB       HIS  67  -6.449   4.526  -7.191
  491   2HB   HIS  67          2HB       HIS  67  -5.047   5.269  -6.416
  492    HD1  HIS  67           HD1      HIS  67  -5.642   2.533  -9.001
  493    HD2  HIS  67           HD2      HIS  67  -2.991   5.650  -8.222
  494    HE1  HIS  67           HE1      HIS  67  -3.925   2.483 -10.852
  495    H    ALA  68           H        ALA  68  -3.298   4.775  -5.791
  496    HA   ALA  68           HA       ALA  68  -1.047   3.328  -6.517
  497   1HB   ALA  68          1HB       ALA  68  -1.697   5.567  -4.678
  498   2HB   ALA  68          2HB       ALA  68  -0.562   5.514  -6.026
  499   3HB   ALA  68          3HB       ALA  68  -0.105   4.838  -4.462
  500    H    MET  69           H        MET  69  -2.949   2.887  -3.592
  501    HA   MET  69           HA       MET  69  -0.809   1.359  -2.256
  502   1HB   MET  69          1HB       MET  69  -3.675   2.041  -1.579
  503   2HB   MET  69          2HB       MET  69  -2.563   1.223  -0.484
  504   1HG   MET  69          1HG       MET  69  -1.384   3.619  -1.654
  505   2HG   MET  69          2HG       MET  69  -2.853   3.978  -0.749
  506   1HE   MET  69          1HE       MET  69   0.158   5.095   0.674
  507   2HE   MET  69          2HE       MET  69   0.309   4.236  -0.855
  508   3HE   MET  69          3HE       MET  69   1.184   3.658   0.560
  509    H    HIS  70           H        HIS  70  -3.862   0.648  -3.954
  510    HA   HIS  70           HA       HIS  70  -3.379  -2.246  -3.365
  511   1HB   HIS  70          1HB       HIS  70  -5.875  -0.781  -4.277
  512   2HB   HIS  70          2HB       HIS  70  -5.788  -2.470  -3.772
  513    HD1  HIS  70           HD1      HIS  70  -5.803   1.017  -2.445
  514    HD2  HIS  70           HD2      HIS  70  -5.386  -2.847  -0.950
  515    HE1  HIS  70           HE1      HIS  70  -6.004   1.202   0.073
  516    H    ASP  71           H        ASP  71  -3.185   0.075  -5.867
  517    HA   ASP  71           HA       ASP  71  -3.811  -1.786  -8.061
  518   1HB   ASP  71          1HB       ASP  71  -2.835   1.054  -7.765
  519   2HB   ASP  71          2HB       ASP  71  -2.915   0.279  -9.346
  520    H    LYS  72           H        LYS  72  -2.166  -2.317  -9.718
  521    HA   LYS  72           HA       LYS  72   0.575  -2.575  -8.534
  522   1HB   LYS  72          1HB       LYS  72   0.708  -4.657  -9.799
  523   2HB   LYS  72          2HB       LYS  72  -0.788  -4.657  -8.865
  524   1HG   LYS  72          1HG       LYS  72  -1.954  -3.744 -10.921
  525   2HG   LYS  72          2HG       LYS  72  -0.465  -4.056 -11.814
  526   1HD   LYS  72          1HD       LYS  72  -1.048  -6.406 -10.323
  527   2HD   LYS  72          2HD       LYS  72  -2.545  -5.909 -11.115
  528   1HE   LYS  72          1HE       LYS  72  -1.741  -6.817 -13.030
  529   2HE   LYS  72          2HE       LYS  72  -0.492  -5.556 -13.038
  530   1HZ   LYS  72          1HZ       LYS  72   0.891  -6.888 -11.638
  531   2HZ   LYS  72          2HZ       LYS  72   0.424  -7.846 -12.962
  532   3HZ   LYS  72          3HZ       LYS  72  -0.322  -8.060 -11.449
  533    H    GLY  73           H        GLY  73  -1.194  -2.167 -11.605
  534   1HA   GLY  73          1HA       GLY  73   1.214  -1.446 -13.079
  535   2HA   GLY  73          2HA       GLY  73  -0.443  -1.303 -13.675
  536    H    THR  74           H        THR  74   1.478   0.143 -11.031
  537    HA   THR  74           HA       THR  74   0.197   2.773 -11.639
  538    HB   THR  74           HB       THR  74   1.267   3.194  -9.292
  539    HG1  THR  74           1HG      THR  74   2.590   1.346  -9.357
  540   1HG2  THR  74          1HG2      THR  74  -0.621   1.852  -8.216
  541   2HG2  THR  74          2HG2      THR  74  -1.001   1.275  -9.839
  542   3HG2  THR  74          3HG2      THR  74  -1.104   2.995  -9.469
  543    H    LYS  75           H        LYS  75   1.609   4.695 -11.560
  544    HA   LYS  75           HA       LYS  75   3.792   4.828 -13.208
  545   1HB   LYS  75          1HB       LYS  75   2.501   6.547 -11.613
  546   2HB   LYS  75          2HB       LYS  75   3.925   6.312 -10.605
  547   1HG   LYS  75          1HG       LYS  75   4.216   8.226 -12.146
  548   2HG   LYS  75          2HG       LYS  75   5.379   6.946 -12.483
  549   1HD   LYS  75          1HD       LYS  75   3.125   6.300 -14.027
  550   2HD   LYS  75          2HD       LYS  75   3.321   8.044 -14.207
  551   1HE   LYS  75          1HE       LYS  75   5.674   7.741 -14.858
  552   2HE   LYS  75          2HE       LYS  75   5.519   5.987 -14.637
  553   1HZ   LYS  75          1HZ       LYS  75   5.007   7.225 -16.948
  554   2HZ   LYS  75          2HZ       LYS  75   3.459   7.242 -16.250
  555   3HZ   LYS  75          3HZ       LYS  75   4.272   5.769 -16.484
  556    H    PHE  76           H        PHE  76   3.789   3.733  -9.847
  557    HA   PHE  76           HA       PHE  76   6.561   2.663 -10.235
  558   1HB   PHE  76          1HB       PHE  76   5.511   4.159  -7.814
  559   2HB   PHE  76          2HB       PHE  76   7.137   3.520  -8.019
  560    HD1  PHE  76           HD1      PHE  76   8.427   4.349 -10.162
  561    HD2  PHE  76           HD2      PHE  76   5.018   6.330  -8.461
  562    HE1  PHE  76           HE1      PHE  76   9.051   6.441 -11.342
  563    HE2  PHE  76           HE2      PHE  76   5.642   8.419  -9.636
  564    HZ   PHE  76           HZ       PHE  76   7.652   8.468 -11.073
  565    H    LYS  77           H        LYS  77   7.059   1.098  -8.295
  566    HA   LYS  77           HA       LYS  77   4.926  -0.844  -8.154
  567   1HB   LYS  77          1HB       LYS  77   6.469  -1.948  -6.561
  568   2HB   LYS  77          2HB       LYS  77   7.287  -1.461  -8.042
  569   1HG   LYS  77          1HG       LYS  77   7.981   0.658  -6.832
  570   2HG   LYS  77          2HG       LYS  77   7.367  -0.080  -5.353
  571   1HD   LYS  77          1HD       LYS  77   9.822  -0.448  -5.663
  572   2HD   LYS  77          2HD       LYS  77   8.909  -1.954  -5.601
  573   1HE   LYS  77          1HE       LYS  77   8.984  -2.192  -8.008
  574   2HE   LYS  77          2HE       LYS  77   9.696  -0.577  -8.190
  575   1HZ   LYS  77          1HZ       LYS  77  11.657  -1.233  -7.163
  576   2HZ   LYS  77          2HZ       LYS  77  11.274  -2.583  -8.120
  577   3HZ   LYS  77          3HZ       LYS  77  10.956  -2.603  -6.451
  578    H    SER  78           H        SER  78   3.176  -0.484  -7.030
  579    HA   SER  78           HA       SER  78   2.943   1.457  -4.883
  580   1HB   SER  78          1HB       SER  78   0.614   0.030  -4.946
  581   2HB   SER  78          2HB       SER  78   0.991   1.351  -6.048
  582    HG   SER  78           HG       SER  78   0.360  -0.820  -6.934
  583    H    CYS  79           H        CYS  79   1.489   0.584  -2.926
  584    HA   CYS  79           HA       CYS  79   3.136  -1.032  -1.252
  585   1HB   CYS  79          1HB       CYS  79   0.202  -0.269  -1.181
  586   2HB   CYS  79          2HB       CYS  79   1.058  -0.987   0.180
  587    H    VAL  80           H        VAL  80  -0.168  -1.874  -2.317
  588    HA   VAL  80           HA       VAL  80   0.215  -4.713  -1.907
  589    HB   VAL  80           HB       VAL  80  -1.800  -2.969  -3.323
  590   1HG1  VAL  80          1HG1      VAL  80  -1.396  -5.859  -3.533
  591   2HG1  VAL  80          2HG1      VAL  80  -2.428  -4.798  -4.492
  592   3HG1  VAL  80          3HG1      VAL  80  -3.006  -5.436  -2.953
  593   1HG2  VAL  80          1HG2      VAL  80  -1.895  -2.821  -0.913
  594   2HG2  VAL  80          2HG2      VAL  80  -1.779  -4.573  -0.748
  595   3HG2  VAL  80          3HG2      VAL  80  -3.239  -3.847  -1.418
  596    H    GLY  81           H        GLY  81   0.682  -2.518  -4.614
  597   1HA   GLY  81          1HA       GLY  81   0.802  -4.497  -6.701
  598   2HA   GLY  81          2HA       GLY  81   1.498  -2.877  -6.789
  599    H    CYS  82           H        CYS  82   3.255  -3.037  -4.580
  600    HA   CYS  82           HA       CYS  82   5.460  -4.562  -5.765
  601   1HB   CYS  82          1HB       CYS  82   5.416  -2.269  -4.488
  602   2HB   CYS  82          2HB       CYS  82   5.417  -3.268  -3.037
  603    H    HIS  83           H        HIS  83   3.059  -4.962  -3.319
  604    HA   HIS  83           HA       HIS  83   4.368  -7.041  -1.783
  605   1HB   HIS  83          1HB       HIS  83   1.692  -5.740  -2.054
  606   2HB   HIS  83          2HB       HIS  83   1.767  -7.266  -1.194
  607    HD1  HIS  83           HD1      HIS  83   1.290  -5.972   1.072
  608    HD2  HIS  83           HD2      HIS  83   4.842  -4.907  -0.834
  609    HE1  HIS  83           HE1      HIS  83   2.663  -4.704   2.777
  610    H    LEU  84           H        LEU  84   1.592  -7.158  -4.086
  611    HA   LEU  84           HA       LEU  84   1.355  -9.939  -4.333
  612   1HB   LEU  84          1HB       LEU  84   0.425  -7.569  -5.522
  613   2HB   LEU  84          2HB       LEU  84   1.100  -8.508  -6.849
  614    HG   LEU  84           HG       LEU  84  -0.671  -9.839  -4.832
  615   1HD1  LEU  84          1HD1      LEU  84  -1.772  -7.721  -5.735
  616   2HD1  LEU  84          2HD1      LEU  84  -2.648  -9.224  -6.031
  617   3HD1  LEU  84          3HD1      LEU  84  -1.710  -8.478  -7.326
  618   1HD2  LEU  84          1HD2      LEU  84   0.548 -11.207  -6.484
  619   2HD2  LEU  84          2HD2      LEU  84  -0.147 -10.254  -7.794
  620   3HD2  LEU  84          3HD2      LEU  84  -1.187 -11.268  -6.794
  621    H    GLU  85           H        GLU  85   3.682  -7.715  -5.807
  622    HA   GLU  85           HA       GLU  85   4.862  -9.753  -7.553
  623   1HB   GLU  85          1HB       GLU  85   4.924  -6.898  -7.116
  624   2HB   GLU  85          2HB       GLU  85   6.573  -7.520  -7.187
  625   1HG   GLU  85          1HG       GLU  85   6.410  -7.692  -9.421
  626   2HG   GLU  85          2HG       GLU  85   5.070  -8.823  -9.230
  627    H    THR  86           H        THR  86   5.965  -7.942  -4.656
  628    HA   THR  86           HA       THR  86   8.424  -9.295  -4.266
  629    HB   THR  86           HB       THR  86   6.429  -7.834  -2.556
  630    HG1  THR  86           1HG      THR  86   9.190  -7.404  -2.958
  631   1HG2  THR  86          1HG2      THR  86   7.825  -8.093  -0.584
  632   2HG2  THR  86          2HG2      THR  86   8.974  -9.082  -1.485
  633   3HG2  THR  86          3HG2      THR  86   7.354  -9.694  -1.154
  634    H    ALA  87           H        ALA  87   5.192 -10.436  -3.914
  635    HA   ALA  87           HA       ALA  87   5.902 -12.600  -2.034
  636   1HB   ALA  87          1HB       ALA  87   3.470 -11.436  -3.317
  637   2HB   ALA  87          2HB       ALA  87   3.742 -11.877  -1.631
  638   3HB   ALA  87          3HB       ALA  87   3.382 -13.127  -2.821
  639    H    GLY  88           H        GLY  88   5.144 -12.158  -5.460
  640   1HA   GLY  88          1HA       GLY  88   5.426 -13.589  -7.295
  641   2HA   GLY  88          2HA       GLY  88   6.658 -14.400  -6.328
  642    H    ALA  89           H        ALA  89   6.172 -16.545  -6.459
  643    HA   ALA  89           HA       ALA  89   3.349 -17.444  -6.380
  644   1HB   ALA  89          1HB       ALA  89   4.231 -19.446  -7.235
  645   2HB   ALA  89          2HB       ALA  89   5.805 -19.173  -6.487
  646   3HB   ALA  89          3HB       ALA  89   5.325 -18.233  -7.899
  647    H    ASP  90           H        ASP  90   4.044 -16.300  -3.953
  648    HA   ASP  90           HA       ASP  90   4.451 -18.669  -2.169
  649   1HB   ASP  90          1HB       ASP  90   6.301 -17.084  -2.126
  650   2HB   ASP  90          2HB       ASP  90   5.192 -15.747  -1.843
  651    H    ALA  91           H        ALA  91   2.098 -18.918  -2.347
  652    HA   ALA  91           HA       ALA  91   0.012 -17.216  -1.867
  653   1HB   ALA  91          1HB       ALA  91   0.517 -19.897  -0.535
  654   2HB   ALA  91          2HB       ALA  91  -0.157 -19.657  -2.146
  655   3HB   ALA  91          3HB       ALA  91  -1.066 -19.144  -0.725
  656    H    ALA  92           H        ALA  92   2.479 -18.109   0.466
  657    HA   ALA  92           HA       ALA  92   1.089 -17.050   2.801
  658   1HB   ALA  92          1HB       ALA  92   3.886 -17.065   3.196
  659   2HB   ALA  92          2HB       ALA  92   3.561 -18.400   2.090
  660   3HB   ALA  92          3HB       ALA  92   2.753 -18.335   3.658
  661    H    LYS  93           H        LYS  93   3.547 -15.919   0.528
  662    HA   LYS  93           HA       LYS  93   3.873 -13.303   1.762
  663   1HB   LYS  93          1HB       LYS  93   4.786 -14.855  -0.590
  664   2HB   LYS  93          2HB       LYS  93   4.843 -13.106  -0.767
  665   1HG   LYS  93          1HG       LYS  93   6.084 -13.002   1.420
  666   2HG   LYS  93          2HG       LYS  93   6.146 -14.766   1.404
  667   1HD   LYS  93          1HD       LYS  93   7.257 -14.613  -0.865
  668   2HD   LYS  93          2HD       LYS  93   7.372 -12.871  -0.617
  669   1HE   LYS  93          1HE       LYS  93   8.635 -13.301   1.510
  670   2HE   LYS  93          2HE       LYS  93   8.629 -15.031   1.111
  671   1HZ   LYS  93          1HZ       LYS  93   9.970 -12.813  -0.269
  672   2HZ   LYS  93          2HZ       LYS  93   9.431 -14.134  -1.191
  673   3HZ   LYS  93          3HZ       LYS  93  10.545 -14.373   0.069
  674    H    LYS  94           H        LYS  94   1.762 -14.766  -0.618
  675    HA   LYS  94           HA       LYS  94   0.853 -12.252  -1.805
  676   1HB   LYS  94          1HB       LYS  94   0.484 -15.128  -2.086
  677   2HB   LYS  94          2HB       LYS  94  -1.053 -14.273  -2.215
  678   1HG   LYS  94          1HG       LYS  94   0.435 -12.645  -3.742
  679   2HG   LYS  94          2HG       LYS  94   1.344 -14.137  -3.982
  680   1HD   LYS  94          1HD       LYS  94  -1.414 -14.803  -4.164
  681   2HD   LYS  94          2HD       LYS  94  -1.156 -13.370  -5.160
  682   1HE   LYS  94          1HE       LYS  94   0.885 -14.604  -6.132
  683   2HE   LYS  94          2HE       LYS  94   0.209 -16.062  -5.380
  684   1HZ   LYS  94          1HZ       LYS  94  -1.949 -15.439  -6.452
  685   2HZ   LYS  94          2HZ       LYS  94  -0.731 -15.913  -7.539
  686   3HZ   LYS  94          3HZ       LYS  94  -1.106 -14.267  -7.343
  687    H    LYS  95           H        LYS  95   0.462 -13.522   1.230
  688    HA   LYS  95           HA       LYS  95  -2.294 -12.367   1.542
  689   1HB   LYS  95          1HB       LYS  95  -2.653 -14.376   2.563
  690   2HB   LYS  95          2HB       LYS  95  -0.944 -14.790   2.444
  691   1HG   LYS  95          1HG       LYS  95  -0.443 -13.626   4.497
  692   2HG   LYS  95          2HG       LYS  95  -2.069 -12.944   4.567
  693   1HD   LYS  95          1HD       LYS  95  -2.927 -14.823   5.491
  694   2HD   LYS  95          2HD       LYS  95  -2.073 -15.865   4.354
  695   1HE   LYS  95          1HE       LYS  95   0.052 -15.250   5.758
  696   2HE   LYS  95          2HE       LYS  95  -1.125 -14.798   7.007
  697   1HZ   LYS  95          1HZ       LYS  95  -1.528 -17.314   5.561
  698   2HZ   LYS  95          2HZ       LYS  95  -1.930 -16.912   7.162
  699   3HZ   LYS  95          3HZ       LYS  95  -0.322 -17.274   6.752
  700    H    GLU  96           H        GLU  96   0.801 -12.867   3.157
  701    HA   GLU  96           HA       GLU  96   0.692 -10.896   5.154
  702   1HB   GLU  96          1HB       GLU  96   2.541 -12.610   3.707
  703   2HB   GLU  96          2HB       GLU  96   3.304 -11.098   4.160
  704   1HG   GLU  96          1HG       GLU  96   2.219 -11.530   6.494
  705   2HG   GLU  96          2HG       GLU  96   2.059 -13.191   5.916
  706    H    LEU  97           H        LEU  97   1.802 -10.692   1.782
  707    HA   LEU  97           HA       LEU  97   2.406  -7.824   1.970
  708   1HB   LEU  97          1HB       LEU  97   2.327  -9.715  -0.386
  709   2HB   LEU  97          2HB       LEU  97   3.192  -8.180  -0.289
  710    HG   LEU  97           HG       LEU  97   3.765 -10.736   1.211
  711   1HD1  LEU  97          1HD1      LEU  97   5.278  -8.906  -0.650
  712   2HD1  LEU  97          2HD1      LEU  97   4.895 -10.613  -0.878
  713   3HD1  LEU  97          3HD1      LEU  97   6.086 -10.130   0.329
  714   1HD2  LEU  97          1HD2      LEU  97   4.475  -7.888   1.878
  715   2HD2  LEU  97          2HD2      LEU  97   5.606  -9.186   2.265
  716   3HD2  LEU  97          3HD2      LEU  97   3.985  -9.191   2.961
  717    H    THR  98           H        THR  98   0.341  -9.668  -0.297
  718    HA   THR  98           HA       THR  98  -1.261  -7.239  -0.764
  719    HB   THR  98           HB       THR  98  -2.325  -8.775  -2.468
  720    HG1  THR  98           1HG      THR  98  -0.215 -10.531  -1.908
  721   1HG2  THR  98          1HG2      THR  98  -0.658  -8.224  -3.914
  722   2HG2  THR  98          2HG2      THR  98   0.569  -9.058  -2.958
  723   3HG2  THR  98          3HG2      THR  98   0.059  -7.429  -2.514
  724    H    GLY  99           H        GLY  99  -1.511 -10.139   1.125
  725   1HA   GLY  99          1HA       GLY  99  -4.268 -10.578   1.232
  726   2HA   GLY  99          2HA       GLY  99  -3.212 -10.757   2.635
  727    H    CYS 100           H        CYS 100  -5.941  -9.281   1.794
  728    HA   CYS 100           HA       CYS 100  -5.426  -6.582   2.784
  729   1HB   CYS 100          1HB       CYS 100  -8.177  -7.604   2.850
  730   2HB   CYS 100          2HB       CYS 100  -7.546  -6.185   2.056
  731    H    LYS 101           H        LYS 101  -7.576  -9.146   3.996
  732    HA   LYS 101           HA       LYS 101  -7.199  -8.043   6.730
  733   1HB   LYS 101          1HB       LYS 101  -9.102 -10.172   5.699
  734   2HB   LYS 101          2HB       LYS 101  -9.228  -9.290   7.221
  735   1HG   LYS 101          1HG       LYS 101  -9.483  -7.171   5.963
  736   2HG   LYS 101          2HG       LYS 101  -9.400  -8.073   4.448
  737   1HD   LYS 101          1HD       LYS 101 -11.664  -8.171   4.635
  738   2HD   LYS 101          2HD       LYS 101 -11.342  -9.460   5.796
  739   1HE   LYS 101          1HE       LYS 101 -11.742  -8.086   7.638
  740   2HE   LYS 101          2HE       LYS 101 -11.331  -6.606   6.750
  741   1HZ   LYS 101          1HZ       LYS 101 -13.330  -6.589   5.653
  742   2HZ   LYS 101          2HZ       LYS 101 -13.819  -7.236   7.147
  743   3HZ   LYS 101          3HZ       LYS 101 -13.571  -8.260   5.814
  744    H    GLY 102           H        GLY 102  -5.570  -8.995   7.895
  745   1HA   GLY 102          1HA       GLY 102  -4.846 -10.995   9.129
  746   2HA   GLY 102          2HA       GLY 102  -5.293 -11.962   7.723
  747    H    SER 103           H        SER 103  -3.912  -9.321   6.402
  748    HA   SER 103           HA       SER 103  -1.396 -10.723   5.858
  749   1HB   SER 103          1HB       SER 103  -1.075  -8.787   4.352
  750   2HB   SER 103          2HB       SER 103  -2.674  -9.487   4.151
  751    HG   SER 103           HG       SER 103  -2.511  -7.113   4.407
  752    H    LYS 104           H        LYS 104   0.171  -8.289   5.603
  753    HA   LYS 104           HA       LYS 104   0.939  -7.901   8.464
  754   1HB   LYS 104          1HB       LYS 104   2.260  -7.488   5.766
  755   2HB   LYS 104          2HB       LYS 104   3.019  -7.028   7.289
  756   1HG   LYS 104          1HG       LYS 104   1.957  -9.777   7.260
  757   2HG   LYS 104          2HG       LYS 104   3.278  -9.499   6.123
  758   1HD   LYS 104          1HD       LYS 104   4.530  -8.398   8.058
  759   2HD   LYS 104          2HD       LYS 104   3.288  -9.069   9.116
  760   1HE   LYS 104          1HE       LYS 104   3.828 -11.344   8.357
  761   2HE   LYS 104          2HE       LYS 104   5.041 -10.693   7.237
  762   1HZ   LYS 104          1HZ       LYS 104   5.203  -9.742   9.975
  763   2HZ   LYS 104          2HZ       LYS 104   6.447 -10.173   8.901
  764   3HZ   LYS 104          3HZ       LYS 104   5.601 -11.375   9.754
  765    H    CYS 105           H        CYS 105  -0.197  -6.370   5.584
  766    HA   CYS 105           HA       CYS 105   0.310  -3.625   6.393
  767   1HB   CYS 105          1HB       CYS 105  -0.199  -5.085   4.097
  768   2HB   CYS 105          2HB       CYS 105  -1.696  -4.216   4.343
  769    H    HIS 106           H        HIS 106  -2.439  -5.869   6.556
  770    HA   HIS 106           HA       HIS 106  -4.054  -3.707   7.873
  771   1HB   HIS 106          1HB       HIS 106  -4.631  -6.023   6.073
  772   2HB   HIS 106          2HB       HIS 106  -5.887  -5.524   7.205
  773    HD1  HIS 106           HD1      HIS 106  -5.192  -2.450   7.114
  774    HD2  HIS 106           HD2      HIS 106  -5.822  -4.870   3.759
  775    HE1  HIS 106           HE1      HIS 106  -5.749  -0.888   5.206
  776    H    SER 107           H        SER 107  -2.618  -4.464   9.813
  777    HA   SER 107           HA       SER 107  -2.871  -7.022  11.012
  778   1HB   SER 107          1HB       SER 107  -2.001  -4.321  11.674
  779   2HB   SER 107          2HB       SER 107  -2.716  -5.126  13.068
  780    HG   SER 107           HG       SER 107  -0.420  -5.722  11.616
  781    HHA  HEC 201           HHA      HEC 201   6.003   8.725   5.675
  782    HHB  HEC 201           HHB      HEC 201  12.073   9.849   4.734
  783    HHC  HEC 201           HHC      HEC 201  12.515   4.702   1.088
  784    HHD  HEC 201           HHD      HEC 201   6.403   3.611   1.891
  785   1HMA  HEC 201          1HMA      HEC 201   9.855  10.995   7.777
  786   2HMA  HEC 201          2HMA      HEC 201  10.109  12.064   6.397
  787   3HMA  HEC 201          3HMA      HEC 201  11.317  10.842   6.798
  788   1HAA  HEC 201          1HAA      HEC 201   6.464   9.873   7.178
  789   2HAA  HEC 201          2HAA      HEC 201   7.785  10.834   7.836
  790   1HBA  HEC 201          1HBA      HEC 201   6.792  11.653   5.167
  791   2HBA  HEC 201          2HBA      HEC 201   5.688  11.919   6.517
  792   1HMB  HEC 201          1HMB      HEC 201  14.784   9.348   2.734
  793   2HMB  HEC 201          2HMB      HEC 201  15.169   8.387   4.162
  794   3HMB  HEC 201          3HMB      HEC 201  13.998   9.701   4.273
  795    HAB  HEC 201           HAB      HEC 201  14.372   5.459   1.238
  796   1HBB  HEC 201          1HBB      HEC 201  15.836   6.661   3.601
  797   2HBB  HEC 201          2HBB      HEC 201  16.647   5.741   2.334
  798   3HBB  HEC 201          3HBB      HEC 201  15.426   4.965   3.341
  799   1HMC  HEC 201          1HMC      HEC 201  11.325   1.633   0.493
  800   2HMC  HEC 201          2HMC      HEC 201  10.788   2.476  -0.960
  801   3HMC  HEC 201          3HMC      HEC 201  12.135   3.113  -0.017
  802    HAC  HEC 201           HAC      HEC 201   7.062   2.204   0.661
  803   1HBC  HEC 201          1HBC      HEC 201   7.919   0.079  -0.061
  804   2HBC  HEC 201          2HBC      HEC 201   8.819   0.530   1.387
  805   3HBC  HEC 201          3HBC      HEC 201   9.554   0.725  -0.204
  806   1HMD  HEC 201          1HMD      HEC 201   3.713   4.164   4.521
  807   2HMD  HEC 201          2HMD      HEC 201   3.364   4.679   2.869
  808   3HMD  HEC 201          3HMD      HEC 201   4.558   3.415   3.168
  809   1HAD  HEC 201          1HAD      HEC 201   4.263   8.057   5.534
  810   2HAD  HEC 201          2HAD      HEC 201   3.251   7.510   4.202
  811   1HBD  HEC 201          1HBD      HEC 201   2.684   5.494   5.326
  812   2HBD  HEC 201          2HBD      HEC 201   3.961   5.716   6.521
  813    HHA  HEC 202           HHA      HEC 202   1.621   7.677  -9.513
  814    HHB  HEC 202           HHB      HEC 202   2.783   4.104  -4.822
  815    HHC  HEC 202           HHC      HEC 202   4.542   8.947  -1.247
  816    HHD  HEC 202           HHD      HEC 202   2.595  12.904  -5.844
  817   1HMA  HEC 202          1HMA      HEC 202   0.435   3.238  -7.579
  818   2HMA  HEC 202          2HMA      HEC 202   0.942   3.224  -5.892
  819   3HMA  HEC 202          3HMA      HEC 202   2.095   2.815  -7.162
  820   1HAA  HEC 202          1HAA      HEC 202   1.128   5.272 -10.034
  821   2HAA  HEC 202          2HAA      HEC 202   0.010   4.426  -9.004
  822   1HBA  HEC 202          1HBA      HEC 202  -1.252   6.493  -8.643
  823   2HBA  HEC 202          2HBA      HEC 202  -0.130   7.365  -9.683
  824   1HMB  HEC 202          1HMB      HEC 202   2.808   3.563  -2.132
  825   2HMB  HEC 202          2HMB      HEC 202   4.229   3.316  -3.146
  826   3HMB  HEC 202          3HMB      HEC 202   4.423   3.752  -1.449
  827    HAB  HEC 202           HAB      HEC 202   4.196   7.069   0.084
  828   1HBB  HEC 202          1HBB      HEC 202   6.435   6.958   0.278
  829   2HBB  HEC 202          2HBB      HEC 202   6.549   6.199  -1.311
  830   3HBB  HEC 202          3HBB      HEC 202   6.338   5.202   0.127
  831   1HMC  HEC 202          1HMC      HEC 202   4.653  12.801  -1.047
  832   2HMC  HEC 202          2HMC      HEC 202   4.315  11.202  -0.386
  833   3HMC  HEC 202          3HMC      HEC 202   5.832  11.502  -1.232
  834    HAC  HEC 202           HAC      HEC 202   2.680  13.991  -4.029
  835   1HBC  HEC 202          1HBC      HEC 202   4.770  14.956  -3.841
  836   2HBC  HEC 202          2HBC      HEC 202   5.296  13.811  -2.608
  837   3HBC  HEC 202          3HBC      HEC 202   4.278  15.180  -2.162
  838   1HMD  HEC 202          1HMD      HEC 202   1.508  12.953  -9.656
  839   2HMD  HEC 202          2HMD      HEC 202   2.850  13.465  -8.631
  840   3HMD  HEC 202          3HMD      HEC 202   1.205  13.461  -7.994
  841   1HAD  HEC 202          1HAD      HEC 202   1.908   9.282 -10.760
  842   2HAD  HEC 202          2HAD      HEC 202   1.148  10.862 -10.880
  843   1HBD  HEC 202          1HBD      HEC 202   3.587  11.752 -10.486
  844   2HBD  HEC 202          2HBD      HEC 202   4.053  10.140 -11.030
  845    HHA  HEC 203           HHA      HEC 203   7.105  -6.825   4.653
  846    HHB  HEC 203           HHB      HEC 203   2.715  -2.061   4.947
  847    HHC  HEC 203           HHC      HEC 203   4.651   0.073  -0.425
  848    HHD  HEC 203           HHD      HEC 203   8.956  -4.485  -0.891
  849   1HMA  HEC 203          1HMA      HEC 203   3.484  -3.407   7.660
  850   2HMA  HEC 203          2HMA      HEC 203   3.023  -5.104   7.510
  851   3HMA  HEC 203          3HMA      HEC 203   2.186  -3.874   6.562
  852   1HAA  HEC 203          1HAA      HEC 203   4.795  -6.146   7.722
  853   2HAA  HEC 203          2HAA      HEC 203   4.638  -7.322   6.425
  854   1HBA  HEC 203          1HBA      HEC 203   6.852  -7.790   6.436
  855   2HBA  HEC 203          2HBA      HEC 203   7.298  -6.086   6.542
  856   1HMB  HEC 203          1HMB      HEC 203   1.101   0.392   3.535
  857   2HMB  HEC 203          2HMB      HEC 203   2.381   1.225   4.418
  858   3HMB  HEC 203          3HMB      HEC 203   1.867  -0.385   4.920
  859    HAB  HEC 203           HAB      HEC 203   2.745   0.943   0.174
  860   1HBB  HEC 203          1HBB      HEC 203   3.222   3.352   1.625
  861   2HBB  HEC 203          2HBB      HEC 203   4.040   2.792   0.169
  862   3HBB  HEC 203          3HBB      HEC 203   4.674   2.361   1.758
  863   1HMC  HEC 203          1HMC      HEC 203   7.221   0.220  -2.755
  864   2HMC  HEC 203          2HMC      HEC 203   5.971  -0.783  -3.491
  865   3HMC  HEC 203          3HMC      HEC 203   5.554   0.332  -2.189
  866    HAC  HEC 203           HAC      HEC 203   9.168  -3.371  -2.532
  867   1HBC  HEC 203          1HBC      HEC 203   9.106  -0.742  -2.591
  868   2HBC  HEC 203          2HBC      HEC 203   8.181  -0.984  -4.069
  869   3HBC  HEC 203          3HBC      HEC 203   9.821  -1.620  -3.943
  870   1HMD  HEC 203          1HMD      HEC 203  10.935  -6.771   1.059
  871   2HMD  HEC 203          2HMD      HEC 203  10.248  -6.033  -0.389
  872   3HMD  HEC 203          3HMD      HEC 203   9.826  -7.691   0.042
  873   1HAD  HEC 203          1HAD      HEC 203  10.142  -7.837   3.098
  874   2HAD  HEC 203          2HAD      HEC 203   8.786  -7.810   4.218
  875   1HBD  HEC 203          1HBD      HEC 203   8.108  -9.021   1.635
  876   2HBD  HEC 203          2HBD      HEC 203   9.391  -9.879   2.489
  877    HHA  HEC 204           HHA      HEC 204  -6.836   2.174   3.904
  878    HHB  HEC 204           HHB      HEC 204 -10.109  -2.352   1.029
  879    HHC  HEC 204           HHC      HEC 204  -4.820  -5.946   1.004
  880    HHD  HEC 204           HHD      HEC 204  -1.482  -0.992   2.665
  881   1HMA  HEC 204          1HMA      HEC 204 -11.258   0.842   1.277
  882   2HMA  HEC 204          2HMA      HEC 204 -11.712   0.321   2.901
  883   3HMA  HEC 204          3HMA      HEC 204 -11.478  -0.874   1.624
  884   1HAA  HEC 204          1HAA      HEC 204 -10.053   2.028   4.467
  885   2HAA  HEC 204          2HAA      HEC 204  -8.568   2.800   3.925
  886   1HBA  HEC 204          1HBA      HEC 204  -9.664   3.020   1.634
  887   2HBA  HEC 204          2HBA      HEC 204 -11.163   2.524   2.412
  888   1HMB  HEC 204          1HMB      HEC 204 -10.520  -3.880  -0.338
  889   2HMB  HEC 204          2HMB      HEC 204 -10.314  -5.560   0.156
  890   3HMB  HEC 204          3HMB      HEC 204  -9.739  -5.028  -1.425
  891    HAB  HEC 204           HAB      HEC 204  -6.460  -7.035   0.321
  892   1HBB  HEC 204          1HBB      HEC 204  -7.324  -5.861  -2.316
  893   2HBB  HEC 204          2HBB      HEC 204  -6.962  -7.580  -2.158
  894   3HBB  HEC 204          3HBB      HEC 204  -5.716  -6.381  -1.811
  895   1HMC  HEC 204          1HMC      HEC 204  -1.562  -6.206   2.312
  896   2HMC  HEC 204          2HMC      HEC 204  -1.620  -6.073   0.554
  897   3HMC  HEC 204          3HMC      HEC 204  -3.030  -6.653   1.443
  898    HAC  HEC 204           HAC      HEC 204  -0.440  -2.494   3.020
  899   1HBC  HEC 204          1HBC      HEC 204   0.443  -4.336   0.775
  900   2HBC  HEC 204          2HBC      HEC 204   1.430  -3.168   1.654
  901   3HBC  HEC 204          3HBC      HEC 204   0.173  -2.607   0.551
  902   1HMD  HEC 204          1HMD      HEC 204  -1.656   2.617   4.045
  903   2HMD  HEC 204          2HMD      HEC 204  -1.129   0.962   4.348
  904   3HMD  HEC 204          3HMD      HEC 204  -1.070   1.620   2.713
  905   1HAD  HEC 204          1HAD      HEC 204  -3.790   3.867   3.559
  906   2HAD  HEC 204          2HAD      HEC 204  -5.374   3.451   4.203
  907   1HBD  HEC 204          1HBD      HEC 204  -4.269   2.559   6.249
  908   2HBD  HEC 204          2HBD      HEC 204  -2.719   3.099   5.609
  Start of MODEL    4
    1   1H    ALA   1          1H        ALA   1  18.416  14.884   1.111
    2   2H    ALA   1          2H        ALA   1  20.099  15.093   1.029
    3   3H    ALA   1          3H        ALA   1  19.217  15.784   2.305
    4    HA   ALA   1           HA       ALA   1  19.600  12.870   1.829
    5   1HB   ALA   1          1HB       ALA   1  21.622  13.829   2.614
    6   2HB   ALA   1          2HB       ALA   1  20.827  13.259   4.082
    7   3HB   ALA   1          3HB       ALA   1  20.772  14.970   3.656
    8    HA   PRO   2           HA       PRO   2  15.713  13.419   4.175
    9   1HB   PRO   2          1HB       PRO   2  14.566  11.117   3.243
   10   2HB   PRO   2          2HB       PRO   2  14.496  12.653   2.364
   11   1HG   PRO   2          1HG       PRO   2  16.250  10.296   1.919
   12   2HG   PRO   2          2HG       PRO   2  15.494  11.377   0.739
   13   1HD   PRO   2          1HD       PRO   2  18.126  11.524   1.467
   14   2HD   PRO   2          2HD       PRO   2  17.188  12.907   0.864
   15    H    LYS   3           H        LYS   3  15.544  12.630   6.252
   16    HA   LYS   3           HA       LYS   3  17.186  10.266   6.993
   17   1HB   LYS   3          1HB       LYS   3  15.774  12.487   8.455
   18   2HB   LYS   3          2HB       LYS   3  16.426  11.086   9.303
   19   1HG   LYS   3          1HG       LYS   3  18.433  11.998   7.501
   20   2HG   LYS   3          2HG       LYS   3  17.833  13.406   8.377
   21   1HD   LYS   3          1HD       LYS   3  18.049  11.910  10.491
   22   2HD   LYS   3          2HD       LYS   3  19.083  10.896   9.483
   23   1HE   LYS   3          1HE       LYS   3  20.798  12.401   9.536
   24   2HE   LYS   3          2HE       LYS   3  19.704  13.784   9.334
   25   1HZ   LYS   3          1HZ       LYS   3  20.319  12.281  11.807
   26   2HZ   LYS   3          2HZ       LYS   3  18.914  13.226  11.669
   27   3HZ   LYS   3          3HZ       LYS   3  20.445  13.951  11.532
   28    H    ALA   4           H        ALA   4  15.762   8.690   6.052
   29    HA   ALA   4           HA       ALA   4  13.054   8.272   6.256
   30   1HB   ALA   4          1HB       ALA   4  15.344   6.760   5.746
   31   2HB   ALA   4          2HB       ALA   4  13.680   6.203   5.563
   32   3HB   ALA   4          3HB       ALA   4  14.555   5.895   7.064
   33    HA   PRO   5           HA       PRO   5  12.304   8.283  10.597
   34   1HB   PRO   5          1HB       PRO   5   9.685   7.478  10.498
   35   2HB   PRO   5          2HB       PRO   5  10.225   9.124  10.129
   36   1HG   PRO   5          1HG       PRO   5   9.361   6.972   8.297
   37   2HG   PRO   5          2HG       PRO   5   9.277   8.727   8.108
   38   1HD   PRO   5          1HD       PRO   5  11.158   7.042   6.911
   39   2HD   PRO   5          2HD       PRO   5  11.262   8.807   7.033
   40    H    ALA   6           H        ALA   6  11.801   6.746  12.305
   41    HA   ALA   6           HA       ALA   6  12.906   4.146  11.886
   42   1HB   ALA   6          1HB       ALA   6  11.344   5.536  14.058
   43   2HB   ALA   6          2HB       ALA   6  13.051   5.095  14.042
   44   3HB   ALA   6          3HB       ALA   6  11.820   3.848  14.235
   45    H    ASP   7           H        ASP   7  11.500   2.201  12.806
   46    HA   ASP   7           HA       ASP   7   9.374   1.714  10.881
   47   1HB   ASP   7          1HB       ASP   7  10.597   0.266  13.238
   48   2HB   ASP   7          2HB       ASP   7   9.260  -0.423  12.319
   49    H    GLY   8           H        GLY   8   7.323   0.582  11.991
   50   1HA   GLY   8          1HA       GLY   8   5.489   0.737  13.470
   51   2HA   GLY   8          2HA       GLY   8   6.425   1.851  14.462
   52    H    LEU   9           H        LEU   9   6.363   2.728  11.157
   53    HA   LEU   9           HA       LEU   9   4.905   5.166  11.719
   54   1HB   LEU   9          1HB       LEU   9   6.606   4.213   9.752
   55   2HB   LEU   9          2HB       LEU   9   5.054   4.287   8.915
   56    HG   LEU   9           HG       LEU   9   5.813   6.607  10.634
   57   1HD1  LEU   9          1HD1      LEU   9   7.074   5.892   7.978
   58   2HD1  LEU   9          2HD1      LEU   9   7.883   6.360   9.475
   59   3HD1  LEU   9          3HD1      LEU   9   6.980   7.559   8.548
   60   1HD2  LEU   9          1HD2      LEU   9   4.169   6.046   8.193
   61   2HD2  LEU   9          2HD2      LEU   9   4.828   7.671   8.399
   62   3HD2  LEU   9          3HD2      LEU   9   3.755   6.988   9.626
   63    H    LYS  10           H        LYS  10   2.718   5.308  11.888
   64    HA   LYS  10           HA       LYS  10   1.087   3.110  10.685
   65   1HB   LYS  10          1HB       LYS  10   1.053   4.716  13.140
   66   2HB   LYS  10          2HB       LYS  10  -0.532   4.557  12.382
   67   1HG   LYS  10          1HG       LYS  10   0.095   2.030  12.170
   68   2HG   LYS  10          2HG       LYS  10   1.284   2.395  13.421
   69   1HD   LYS  10          1HD       LYS  10  -0.609   3.419  14.770
   70   2HD   LYS  10          2HD       LYS  10  -1.720   2.733  13.584
   71   1HE   LYS  10          1HE       LYS  10  -1.100   0.495  14.139
   72   2HE   LYS  10          2HE       LYS  10   0.333   1.038  15.035
   73   1HZ   LYS  10          1HZ       LYS  10  -0.910   1.796  16.769
   74   2HZ   LYS  10          2HZ       LYS  10  -1.922   0.528  16.267
   75   3HZ   LYS  10          3HZ       LYS  10  -2.270   2.127  15.810
   76    H    MET  11           H        MET  11   0.193   3.654   8.780
   77    HA   MET  11           HA       MET  11  -0.397   6.473   8.102
   78   1HB   MET  11          1HB       MET  11  -1.181   5.218   5.945
   79   2HB   MET  11          2HB       MET  11   0.541   5.236   6.310
   80   1HG   MET  11          1HG       MET  11  -0.946   3.018   7.554
   81   2HG   MET  11          2HG       MET  11  -0.909   2.978   5.793
   82   1HE   MET  11          1HE       MET  11   2.622   2.547   4.742
   83   2HE   MET  11          2HE       MET  11   1.547   3.940   4.653
   84   3HE   MET  11          3HE       MET  11   0.900   2.323   4.399
   85    H    ASP  12           H        ASP  12  -2.211   7.092   9.289
   86    HA   ASP  12           HA       ASP  12  -4.577   5.257   9.258
   87   1HB   ASP  12          1HB       ASP  12  -5.282   6.955  11.085
   88   2HB   ASP  12          2HB       ASP  12  -3.967   5.845  11.449
   89    H    LYS  13           H        LYS  13  -3.590   7.323   7.158
   90    HA   LYS  13           HA       LYS  13  -5.262   9.551   6.942
   91   1HB   LYS  13          1HB       LYS  13  -4.114   7.560   4.994
   92   2HB   LYS  13          2HB       LYS  13  -5.031   8.953   4.426
   93   1HG   LYS  13          1HG       LYS  13  -2.622   9.106   6.263
   94   2HG   LYS  13          2HG       LYS  13  -2.573   9.398   4.523
   95   1HD   LYS  13          1HD       LYS  13  -4.315  11.193   4.858
   96   2HD   LYS  13          2HD       LYS  13  -4.110  10.979   6.597
   97   1HE   LYS  13          1HE       LYS  13  -1.539  11.278   5.231
   98   2HE   LYS  13          2HE       LYS  13  -2.595  12.686   5.003
   99   1HZ   LYS  13          1HZ       LYS  13  -2.503  11.448   7.653
  100   2HZ   LYS  13          2HZ       LYS  13  -2.730  13.077   7.228
  101   3HZ   LYS  13          3HZ       LYS  13  -1.175  12.394   7.188
  102    H    THR  14           H        THR  14  -6.036   6.156   6.463
  103    HA   THR  14           HA       THR  14  -8.859   6.916   5.772
  104    HB   THR  14           HB       THR  14  -8.852   4.542   4.810
  105    HG1  THR  14           1HG      THR  14  -7.126   3.444   5.167
  106   1HG2  THR  14          1HG2      THR  14  -7.631   5.253   2.777
  107   2HG2  THR  14          2HG2      THR  14  -6.938   6.600   3.681
  108   3HG2  THR  14          3HG2      THR  14  -8.676   6.533   3.394
  109    H    LYS  15           H        LYS  15 -10.411   5.034   6.470
  110    HA   LYS  15           HA       LYS  15 -10.440   4.832   9.313
  111   1HB   LYS  15          1HB       LYS  15 -11.898   3.777   6.965
  112   2HB   LYS  15          2HB       LYS  15 -12.025   2.782   8.416
  113   1HG   LYS  15          1HG       LYS  15 -13.482   4.237   9.318
  114   2HG   LYS  15          2HG       LYS  15 -12.303   5.541   9.161
  115   1HD   LYS  15          1HD       LYS  15 -14.270   6.174   7.904
  116   2HD   LYS  15          2HD       LYS  15 -12.997   5.776   6.749
  117   1HE   LYS  15          1HE       LYS  15 -13.958   3.604   6.313
  118   2HE   LYS  15          2HE       LYS  15 -15.112   3.790   7.648
  119   1HZ   LYS  15          1HZ       LYS  15 -15.070   5.110   5.035
  120   2HZ   LYS  15          2HZ       LYS  15 -15.628   6.010   6.364
  121   3HZ   LYS  15          3HZ       LYS  15 -16.392   4.553   5.940
  122    H    GLN  16           H        GLN  16  -8.897   2.892   6.859
  123    HA   GLN  16           HA       GLN  16  -8.271   0.753   8.851
  124   1HB   GLN  16          1HB       GLN  16  -8.522   1.001   5.890
  125   2HB   GLN  16          2HB       GLN  16  -7.330  -0.154   6.489
  126   1HG   GLN  16          1HG       GLN  16  -9.339  -0.847   8.096
  127   2HG   GLN  16          2HG       GLN  16 -10.305  -0.178   6.780
  128   1HE2  GLN  16          2HE2      GLN  16  -9.146  -0.950   4.481
  129   2HE2  GLN  16          1HE2      GLN  16  -8.926  -2.631   4.400
  130    HA   PRO  17           HA       PRO  17  -4.481   3.383   8.678
  131   1HB   PRO  17          1HB       PRO  17  -3.820   2.961  11.309
  132   2HB   PRO  17          2HB       PRO  17  -4.918   4.250  10.773
  133   1HG   PRO  17          1HG       PRO  17  -5.564   1.562  11.898
  134   2HG   PRO  17          2HG       PRO  17  -6.309   3.134  12.238
  135   1HD   PRO  17          1HD       PRO  17  -7.459   1.333  10.594
  136   2HD   PRO  17          2HD       PRO  17  -7.607   3.087  10.328
  137    H    VAL  18           H        VAL  18  -2.505   2.527   8.168
  138    HA   VAL  18           HA       VAL  18  -1.995  -0.341   8.870
  139    HB   VAL  18           HB       VAL  18  -1.474   1.375   6.436
  140   1HG1  VAL  18          1HG1      VAL  18   0.581   0.093   7.042
  141   2HG1  VAL  18          2HG1      VAL  18  -0.130  -0.431   5.516
  142   3HG1  VAL  18          3HG1      VAL  18  -0.363  -1.393   6.976
  143   1HG2  VAL  18          1HG2      VAL  18  -3.192  -0.932   7.179
  144   2HG2  VAL  18          2HG2      VAL  18  -2.456  -1.010   5.579
  145   3HG2  VAL  18          3HG2      VAL  18  -3.482   0.358   6.011
  146    H    VAL  19           H        VAL  19   0.288  -0.880   9.204
  147    HA   VAL  19           HA       VAL  19   1.886   1.437  10.220
  148    HB   VAL  19           HB       VAL  19   1.886  -1.537  10.823
  149   1HG1  VAL  19          1HG1      VAL  19   3.751   0.681  11.572
  150   2HG1  VAL  19          2HG1      VAL  19   4.105  -1.012  11.234
  151   3HG1  VAL  19          3HG1      VAL  19   3.391  -0.553  12.779
  152   1HG2  VAL  19          1HG2      VAL  19   0.716  -1.024  12.752
  153   2HG2  VAL  19          2HG2      VAL  19   0.088   0.234  11.690
  154   3HG2  VAL  19          3HG2      VAL  19   1.371   0.611  12.839
  155    H    PHE  20           H        PHE  20   3.680   1.976   8.985
  156    HA   PHE  20           HA       PHE  20   4.673  -0.078   7.044
  157   1HB   PHE  20          1HB       PHE  20   3.824   2.045   6.109
  158   2HB   PHE  20          2HB       PHE  20   4.971   2.944   7.100
  159    HD1  PHE  20           HD1      PHE  20   4.992   0.004   4.766
  160    HD2  PHE  20           HD2      PHE  20   6.966   3.586   6.069
  161    HE1  PHE  20           HE1      PHE  20   6.753  -0.337   3.054
  162    HE2  PHE  20           HE2      PHE  20   8.719   3.243   4.359
  163    HZ   PHE  20           HZ       PHE  20   8.617   1.284   2.852
  164    H    ASN  21           H        ASN  21   6.499  -1.088   7.736
  165    HA   ASN  21           HA       ASN  21   8.309   0.255   9.660
  166   1HB   ASN  21          1HB       ASN  21   7.384  -2.382   9.036
  167   2HB   ASN  21          2HB       ASN  21   9.129  -2.349   8.820
  168   1HD2  ASN  21          2HD2      ASN  21   6.651  -1.263  11.205
  169   2HD2  ASN  21          1HD2      ASN  21   7.615  -1.579  12.567
  170    H    HIS  22           H        HIS  22   9.487   1.751   8.341
  171    HA   HIS  22           HA       HIS  22  10.405   1.447   5.721
  172   1HB   HIS  22          1HB       HIS  22  11.365   2.828   8.197
  173   2HB   HIS  22          2HB       HIS  22  12.432   2.815   6.796
  174    HD1  HIS  22           HD1      HIS  22   9.603   4.593   8.212
  175    HD2  HIS  22           HD2      HIS  22  10.994   3.871   4.344
  176    HE1  HIS  22           HE1      HIS  22   8.553   6.355   6.733
  177    H    SER  23           H        SER  23  11.742   0.049   8.695
  178    HA   SER  23           HA       SER  23  14.256  -0.848   7.833
  179   1HB   SER  23          1HB       SER  23  13.729  -2.766   9.453
  180   2HB   SER  23          2HB       SER  23  13.537  -1.139  10.098
  181    HG   SER  23           HG       SER  23  11.753  -2.665  10.462
  182    H    THR  24           H        THR  24  11.068  -2.374   7.327
  183    HA   THR  24           HA       THR  24  12.094  -4.668   5.887
  184    HB   THR  24           HB       THR  24   9.368  -3.787   5.265
  185    HG1  THR  24           1HG      THR  24   9.774  -4.346   7.965
  186   1HG2  THR  24          1HG2      THR  24   9.138  -6.020   5.311
  187   2HG2  THR  24          2HG2      THR  24   9.546  -6.045   7.027
  188   3HG2  THR  24          3HG2      THR  24  10.822  -6.164   5.815
  189    H    HIS  25           H        HIS  25  11.769  -1.382   5.076
  190    HA   HIS  25           HA       HIS  25  11.783  -2.013   2.157
  191   1HB   HIS  25          1HB       HIS  25  10.866   0.443   3.680
  192   2HB   HIS  25          2HB       HIS  25  10.702   0.174   1.947
  193    HD1  HIS  25           HD1      HIS  25   9.409  -1.049   5.262
  194    HD2  HIS  25           HD2      HIS  25   8.645  -1.634   1.207
  195    HE1  HIS  25           HE1      HIS  25   7.282  -2.413   5.125
  196    H    LYS  26           H        LYS  26  13.674  -0.923   4.743
  197    HA   LYS  26           HA       LYS  26  15.198   1.219   3.755
  198   1HB   LYS  26          1HB       LYS  26  16.845   0.456   5.323
  199   2HB   LYS  26          2HB       LYS  26  15.291  -0.048   5.987
  200   1HG   LYS  26          1HG       LYS  26  15.592  -2.298   5.091
  201   2HG   LYS  26          2HG       LYS  26  17.096  -1.813   4.308
  202   1HD   LYS  26          1HD       LYS  26  16.695  -1.544   7.290
  203   2HD   LYS  26          2HD       LYS  26  17.312  -3.028   6.563
  204   1HE   LYS  26          1HE       LYS  26  19.271  -1.960   5.759
  205   2HE   LYS  26          2HE       LYS  26  18.569  -0.342   5.956
  206   1HZ   LYS  26          1HZ       LYS  26  20.143  -1.344   7.782
  207   2HZ   LYS  26          2HZ       LYS  26  18.712  -2.100   8.297
  208   3HZ   LYS  26          3HZ       LYS  26  18.797  -0.406   8.213
  209    H    ALA  27           H        ALA  27  15.094  -2.113   2.720
  210    HA   ALA  27           HA       ALA  27  17.524  -1.818   1.037
  211   1HB   ALA  27          1HB       ALA  27  17.000  -3.851   2.444
  212   2HB   ALA  27          2HB       ALA  27  17.247  -4.213   0.736
  213   3HB   ALA  27          3HB       ALA  27  15.612  -4.148   1.397
  214    H    VAL  28           H        VAL  28  14.302  -1.029   0.803
  215    HA   VAL  28           HA       VAL  28  13.852  -1.905  -1.974
  216    HB   VAL  28           HB       VAL  28  12.350  -0.206   0.031
  217   1HG1  VAL  28          1HG1      VAL  28  11.751   0.627  -2.149
  218   2HG1  VAL  28          2HG1      VAL  28  10.441  -0.418  -1.601
  219   3HG1  VAL  28          3HG1      VAL  28  11.602  -1.010  -2.788
  220   1HG2  VAL  28          1HG2      VAL  28  11.047  -2.096   0.426
  221   2HG2  VAL  28          2HG2      VAL  28  12.626  -2.828   0.142
  222   3HG2  VAL  28          3HG2      VAL  28  11.421  -2.804  -1.145
  223    H    LYS  29           H        LYS  29  13.036  -0.027  -3.475
  224    HA   LYS  29           HA       LYS  29  15.238   1.898  -3.664
  225   1HB   LYS  29          1HB       LYS  29  13.173   0.743  -5.335
  226   2HB   LYS  29          2HB       LYS  29  13.242   2.495  -5.529
  227   1HG   LYS  29          1HG       LYS  29  14.935   2.026  -6.977
  228   2HG   LYS  29          2HG       LYS  29  15.890   1.906  -5.497
  229   1HD   LYS  29          1HD       LYS  29  16.385  -0.130  -6.524
  230   2HD   LYS  29          2HD       LYS  29  15.027  -0.584  -5.493
  231   1HE   LYS  29          1HE       LYS  29  13.717   0.266  -7.752
  232   2HE   LYS  29          2HE       LYS  29  15.179  -0.470  -8.440
  233   1HZ   LYS  29          1HZ       LYS  29  13.811  -2.293  -8.122
  234   2HZ   LYS  29          2HZ       LYS  29  13.147  -1.687  -6.680
  235   3HZ   LYS  29          3HZ       LYS  29  14.732  -2.297  -6.698
  236    H    CYS  30           H        CYS  30  15.088   3.542  -2.233
  237    HA   CYS  30           HA       CYS  30  12.809   4.676  -1.029
  238   1HB   CYS  30          1HB       CYS  30  15.557   5.626  -1.774
  239   2HB   CYS  30          2HB       CYS  30  14.402   6.810  -1.168
  240    H    GLY  31           H        GLY  31  13.985   4.910  -4.276
  241   1HA   GLY  31          1HA       GLY  31  12.276   7.228  -4.929
  242   2HA   GLY  31          2HA       GLY  31  13.375   6.407  -6.042
  243    H    ASP  32           H        ASP  32  11.861   3.925  -4.569
  244    HA   ASP  32           HA       ASP  32  10.074   3.452  -6.842
  245   1HB   ASP  32          1HB       ASP  32  11.435   1.725  -5.622
  246   2HB   ASP  32          2HB       ASP  32  10.418   1.991  -4.213
  247    H    CYS  33           H        CYS  33   9.685   3.830  -3.324
  248    HA   CYS  33           HA       CYS  33   6.772   4.135  -3.518
  249   1HB   CYS  33          1HB       CYS  33   8.792   4.586  -1.285
  250   2HB   CYS  33          2HB       CYS  33   7.045   4.512  -1.066
  251    H    HIS  34           H        HIS  34   9.472   6.275  -2.482
  252    HA   HIS  34           HA       HIS  34   7.786   8.677  -2.851
  253   1HB   HIS  34          1HB       HIS  34  10.676   8.210  -2.030
  254   2HB   HIS  34          2HB       HIS  34   9.889   9.779  -2.034
  255    HD1  HIS  34           HD1      HIS  34   7.455   9.687  -0.562
  256    HD2  HIS  34           HD2      HIS  34  10.498   7.020   0.439
  257    HE1  HIS  34           HE1      HIS  34   7.016   8.951   1.823
  258    H    HIS  35           H        HIS  35   8.117   7.284  -5.278
  259    HA   HIS  35           HA       HIS  35  10.207   7.616  -6.973
  260   1HB   HIS  35          1HB       HIS  35   8.397   8.303  -8.693
  261   2HB   HIS  35          2HB       HIS  35   8.174   6.789  -7.840
  262    HD1  HIS  35           HD1      HIS  35   7.005  10.323  -7.875
  263    HD2  HIS  35           HD2      HIS  35   5.900   6.700  -6.164
  264    HE1  HIS  35           HE1      HIS  35   4.731  10.702  -6.831
  265    HA   PRO  36           HA       PRO  36  11.484  11.761  -7.235
  266   1HB   PRO  36          1HB       PRO  36  12.098  11.988  -9.897
  267   2HB   PRO  36          2HB       PRO  36  13.097  11.087  -8.737
  268   1HG   PRO  36          1HG       PRO  36  11.068  10.070 -10.675
  269   2HG   PRO  36          2HG       PRO  36  12.660   9.411 -10.261
  270   1HD   PRO  36          1HD       PRO  36  10.374   8.384  -9.260
  271   2HD   PRO  36          2HD       PRO  36  11.892   8.403  -8.333
  272    H    VAL  37           H        VAL  37   9.698  13.060  -6.833
  273    HA   VAL  37           HA       VAL  37   7.816  13.641  -9.076
  274    HB   VAL  37           HB       VAL  37   7.815  13.962  -6.074
  275   1HG1  VAL  37          1HG1      VAL  37   5.668  15.157  -6.273
  276   2HG1  VAL  37          2HG1      VAL  37   5.823  15.153  -8.030
  277   3HG1  VAL  37          3HG1      VAL  37   6.962  16.072  -7.046
  278   1HG2  VAL  37          1HG2      VAL  37   6.624  12.187  -8.050
  279   2HG2  VAL  37          2HG2      VAL  37   5.390  12.932  -7.035
  280   3HG2  VAL  37          3HG2      VAL  37   6.700  12.010  -6.297
  281    H    ASN  38           H        ASN  38   7.475  15.881  -9.677
  282    HA   ASN  38           HA       ASN  38   8.315  18.043 -10.210
  283   1HB   ASN  38          1HB       ASN  38   7.480  17.980  -7.770
  284   2HB   ASN  38          2HB       ASN  38   9.170  17.961  -7.322
  285   1HD2  ASN  38          2HD2      ASN  38   6.808  20.128  -7.392
  286   2HD2  ASN  38          1HD2      ASN  38   7.626  21.504  -7.957
  287    H    GLY  39           H        GLY  39  10.268  15.695 -10.378
  288   1HA   GLY  39          1HA       GLY  39  12.529  15.670 -11.111
  289   2HA   GLY  39          2HA       GLY  39  12.705  17.331 -10.539
  290    H    LYS  40           H        LYS  40  11.224  15.994  -8.008
  291    HA   LYS  40           HA       LYS  40  13.731  14.822  -6.831
  292   1HB   LYS  40          1HB       LYS  40  13.197  16.216  -4.798
  293   2HB   LYS  40          2HB       LYS  40  13.618  17.171  -6.220
  294   1HG   LYS  40          1HG       LYS  40  11.502  18.006  -6.451
  295   2HG   LYS  40          2HG       LYS  40  10.742  16.508  -5.914
  296   1HD   LYS  40          1HD       LYS  40  10.400  18.329  -4.273
  297   2HD   LYS  40          2HD       LYS  40  11.356  17.016  -3.586
  298   1HE   LYS  40          1HE       LYS  40  13.439  18.292  -4.123
  299   2HE   LYS  40          2HE       LYS  40  12.427  19.641  -4.680
  300   1HZ   LYS  40          1HZ       LYS  40  11.364  19.731  -2.542
  301   2HZ   LYS  40          2HZ       LYS  40  13.044  19.835  -2.313
  302   3HZ   LYS  40          3HZ       LYS  40  12.229  18.377  -1.997
  303    H    GLU  41           H        GLU  41  13.338  13.070  -5.467
  304    HA   GLU  41           HA       GLU  41  10.723  11.832  -5.461
  305   1HB   GLU  41          1HB       GLU  41  13.318  11.374  -3.970
  306   2HB   GLU  41          2HB       GLU  41  11.915  10.326  -3.768
  307   1HG   GLU  41          1HG       GLU  41  12.048   9.508  -5.947
  308   2HG   GLU  41          2HG       GLU  41  12.900  10.934  -6.539
  309    H    ASP  42           H        ASP  42   9.065  12.751  -4.257
  310    HA   ASP  42           HA       ASP  42   9.519  14.379  -1.916
  311   1HB   ASP  42          1HB       ASP  42   7.116  12.923  -3.036
  312   2HB   ASP  42          2HB       ASP  42   7.033  14.030  -1.667
  313    H    TYR  43           H        TYR  43  10.681  13.265  -0.348
  314    HA   TYR  43           HA       TYR  43  10.009  10.519   0.415
  315   1HB   TYR  43          1HB       TYR  43  11.861  12.628   1.575
  316   2HB   TYR  43          2HB       TYR  43  11.831  10.938   2.078
  317    HD1  TYR  43           HD1      TYR  43  12.990  13.307  -0.408
  318    HD2  TYR  43           HD2      TYR  43  12.364   9.130   0.382
  319    HE1  TYR  43           HE1      TYR  43  14.502  12.724  -2.284
  320    HE2  TYR  43           HE2      TYR  43  13.873   8.551  -1.495
  321    HH   TYR  43           HH       TYR  43  16.019  10.521  -2.804
  322    H    GLN  44           H        GLN  44   7.678  11.924   0.760
  323    HA   GLN  44           HA       GLN  44   7.536  12.360   3.730
  324   1HB   GLN  44          1HB       GLN  44   5.603  13.918   3.018
  325   2HB   GLN  44          2HB       GLN  44   7.241  14.464   2.655
  326   1HG   GLN  44          1HG       GLN  44   7.044  13.654   0.360
  327   2HG   GLN  44          2HG       GLN  44   5.445  12.994   0.704
  328   1HE2  GLN  44          2HE2      GLN  44   7.206  16.143   0.858
  329   2HE2  GLN  44          1HE2      GLN  44   5.857  17.082   0.434
  330    H    LYS  45           H        LYS  45   5.171  12.057   4.504
  331    HA   LYS  45           HA       LYS  45   4.308   9.436   4.233
  332   1HB   LYS  45          1HB       LYS  45   3.091  12.045   4.983
  333   2HB   LYS  45          2HB       LYS  45   1.984  10.700   4.718
  334   1HG   LYS  45          1HG       LYS  45   3.133   9.341   6.354
  335   2HG   LYS  45          2HG       LYS  45   4.406  10.549   6.527
  336   1HD   LYS  45          1HD       LYS  45   2.928  12.107   7.565
  337   2HD   LYS  45          2HD       LYS  45   1.505  11.172   7.102
  338   1HE   LYS  45          1HE       LYS  45   3.214   9.430   8.586
  339   2HE   LYS  45          2HE       LYS  45   3.045  10.939   9.506
  340   1HZ   LYS  45          1HZ       LYS  45   1.201   9.319   9.864
  341   2HZ   LYS  45          2HZ       LYS  45   0.768   9.519   8.233
  342   3HZ   LYS  45          3HZ       LYS  45   0.690  10.836   9.304
  343    H    CYS  46           H        CYS  46   3.354   8.288   2.640
  344    HA   CYS  46           HA       CYS  46   3.059   9.004  -0.002
  345   1HB   CYS  46          1HB       CYS  46   1.325   7.190   1.688
  346   2HB   CYS  46          2HB       CYS  46   1.427   7.121  -0.067
  347    H    ALA  47           H        ALA  47   0.607   9.406   2.538
  348    HA   ALA  47           HA       ALA  47  -1.146  10.859   0.610
  349   1HB   ALA  47          1HB       ALA  47  -2.368  10.625   3.115
  350   2HB   ALA  47          2HB       ALA  47  -1.437   9.141   2.928
  351   3HB   ALA  47          3HB       ALA  47  -2.639   9.587   1.718
  352    H    THR  48           H        THR  48   0.915  12.489   1.089
  353    HA   THR  48           HA       THR  48   1.028  14.027   3.434
  354    HB   THR  48           HB       THR  48   1.259  15.329   0.747
  355    HG1  THR  48           1HG      THR  48   3.376  14.170   0.721
  356   1HG2  THR  48          1HG2      THR  48   2.183  15.791   3.391
  357   2HG2  THR  48          2HG2      THR  48   2.545  16.729   1.942
  358   3HG2  THR  48          3HG2      THR  48   3.596  15.394   2.413
  359    H    ALA  49           H        ALA  49   0.408  16.679   2.726
  360    HA   ALA  49           HA       ALA  49  -2.466  16.738   3.245
  361   1HB   ALA  49          1HB       ALA  49  -1.219  19.267   2.524
  362   2HB   ALA  49          2HB       ALA  49  -0.208  18.355   3.644
  363   3HB   ALA  49          3HB       ALA  49  -1.870  18.754   4.081
  364    H    GLY  50           H        GLY  50  -0.599  16.582   0.416
  365   1HA   GLY  50          1HA       GLY  50  -2.975  17.235  -1.229
  366   2HA   GLY  50          2HA       GLY  50  -1.498  18.150  -1.563
  367    H    CYS  51           H        CYS  51  -1.067  15.001  -0.360
  368    HA   CYS  51           HA       CYS  51   0.001  14.086  -2.963
  369   1HB   CYS  51          1HB       CYS  51   0.497  13.914  -0.089
  370   2HB   CYS  51          2HB       CYS  51   0.667  12.372  -0.865
  371    H    HIS  52           H        HIS  52  -0.412  11.286  -1.412
  372    HA   HIS  52           HA       HIS  52  -2.846  10.581  -2.871
  373   1HB   HIS  52          1HB       HIS  52  -0.985   9.151  -0.961
  374   2HB   HIS  52          2HB       HIS  52  -2.346   8.358  -1.726
  375    HD1  HIS  52           HD1      HIS  52  -2.316   8.714  -4.458
  376    HD2  HIS  52           HD2      HIS  52   1.318   8.935  -2.464
  377    HE1  HIS  52           HE1      HIS  52  -0.521   8.313  -6.210
  378    H    ASP  53           H        ASP  53  -3.591  12.578  -1.139
  379    HA   ASP  53           HA       ASP  53  -4.635  11.323   1.340
  380   1HB   ASP  53          1HB       ASP  53  -5.085  13.665   1.948
  381   2HB   ASP  53          2HB       ASP  53  -3.429  13.494   1.365
  382    H    ASN  54           H        ASN  54  -5.808  10.887  -1.519
  383    HA   ASN  54           HA       ASN  54  -8.420  12.216  -1.373
  384   1HB   ASN  54          1HB       ASN  54  -6.858  11.072  -3.333
  385   2HB   ASN  54          2HB       ASN  54  -8.091   9.839  -3.088
  386   1HD2  ASN  54          2HD2      ASN  54  -9.831  10.148  -4.457
  387   2HD2  ASN  54          1HD2      ASN  54 -10.431  11.655  -4.958
  388    H    MET  55           H        MET  55  -9.657  11.546   0.375
  389    HA   MET  55           HA       MET  55  -9.618   8.795   1.352
  390   1HB   MET  55          1HB       MET  55 -11.520  11.081   1.950
  391   2HB   MET  55          2HB       MET  55 -11.168   9.696   2.983
  392   1HG   MET  55          1HG       MET  55  -8.681  10.916   2.327
  393   2HG   MET  55          2HG       MET  55  -9.779  12.197   2.843
  394   1HE   MET  55          1HE       MET  55  -7.029  10.154   4.491
  395   2HE   MET  55          2HE       MET  55  -7.401  11.311   5.767
  396   3HE   MET  55          3HE       MET  55  -7.381  11.840   4.087
  397    H    ASP  56           H        ASP  56 -10.843   9.882  -1.436
  398    HA   ASP  56           HA       ASP  56 -13.591   8.886  -1.292
  399   1HB   ASP  56          1HB       ASP  56 -12.363  10.685  -2.820
  400   2HB   ASP  56          2HB       ASP  56 -12.056   9.277  -3.837
  401    H    LYS  57           H        LYS  57 -10.491   7.477  -1.671
  402    HA   LYS  57           HA       LYS  57  -9.790   5.332  -2.398
  403   1HB   LYS  57          1HB       LYS  57 -12.565   4.638  -1.415
  404   2HB   LYS  57          2HB       LYS  57 -11.119   3.632  -1.341
  405   1HG   LYS  57          1HG       LYS  57 -10.475   4.579   0.596
  406   2HG   LYS  57          2HG       LYS  57 -10.665   6.200  -0.066
  407   1HD   LYS  57          1HD       LYS  57 -12.173   5.792   1.877
  408   2HD   LYS  57          2HD       LYS  57 -13.064   6.148   0.398
  409   1HE   LYS  57          1HE       LYS  57 -13.030   3.517   0.101
  410   2HE   LYS  57          2HE       LYS  57 -12.801   3.540   1.861
  411   1HZ   LYS  57          1HZ       LYS  57 -15.078   3.691   1.705
  412   2HZ   LYS  57          2HZ       LYS  57 -15.037   4.596   0.267
  413   3HZ   LYS  57          3HZ       LYS  57 -14.656   5.334   1.749
  414    H    LYS  58           H        LYS  58 -11.525   7.032  -4.313
  415    HA   LYS  58           HA       LYS  58 -12.240   4.771  -6.143
  416   1HB   LYS  58          1HB       LYS  58 -13.813   7.304  -5.567
  417   2HB   LYS  58          2HB       LYS  58 -14.260   6.081  -6.757
  418   1HG   LYS  58          1HG       LYS  58 -13.723   5.073  -4.020
  419   2HG   LYS  58          2HG       LYS  58 -15.167   6.067  -4.200
  420   1HD   LYS  58          1HD       LYS  58 -15.535   4.533  -6.340
  421   2HD   LYS  58          2HD       LYS  58 -14.530   3.412  -5.421
  422   1HE   LYS  58          1HE       LYS  58 -16.379   4.438  -3.555
  423   2HE   LYS  58          2HE       LYS  58 -17.321   4.074  -5.016
  424   1HZ   LYS  58          1HZ       LYS  58 -16.725   1.889  -4.983
  425   2HZ   LYS  58          2HZ       LYS  58 -16.684   2.190  -3.310
  426   3HZ   LYS  58          3HZ       LYS  58 -15.242   2.177  -4.211
  427    H    ASP  59           H        ASP  59 -10.502   7.639  -5.668
  428    HA   ASP  59           HA       ASP  59 -10.677   8.932  -8.204
  429   1HB   ASP  59          1HB       ASP  59  -9.646   9.977  -6.292
  430   2HB   ASP  59          2HB       ASP  59  -8.484   8.661  -6.131
  431    H    LYS  60           H        LYS  60  -8.899   6.082  -7.148
  432    HA   LYS  60           HA       LYS  60  -7.410   4.661  -8.336
  433   1HB   LYS  60          1HB       LYS  60  -9.929   5.052  -9.585
  434   2HB   LYS  60          2HB       LYS  60  -8.732   4.984 -10.878
  435   1HG   LYS  60          1HG       LYS  60  -8.656   2.965  -8.650
  436   2HG   LYS  60          2HG       LYS  60  -9.766   2.748 -10.004
  437   1HD   LYS  60          1HD       LYS  60  -6.793   3.232 -10.335
  438   2HD   LYS  60          2HD       LYS  60  -7.526   1.627 -10.317
  439   1HE   LYS  60          1HE       LYS  60  -8.307   1.849 -12.444
  440   2HE   LYS  60          2HE       LYS  60  -8.867   3.507 -12.149
  441   1HZ   LYS  60          1HZ       LYS  60  -6.171   2.571 -12.884
  442   2HZ   LYS  60          2HZ       LYS  60  -6.357   4.021 -12.021
  443   3HZ   LYS  60          3HZ       LYS  60  -7.076   3.841 -13.550
  444    H    SER  61           H        SER  61  -6.804   7.637  -8.402
  445    HA   SER  61           HA       SER  61  -5.340   7.745 -11.018
  446   1HB   SER  61          1HB       SER  61  -7.162   9.480  -9.872
  447   2HB   SER  61          2HB       SER  61  -5.619  10.205  -9.430
  448    HG   SER  61           HG       SER  61  -5.767  10.962 -11.402
  449    H    ALA  62           H        ALA  62  -3.537   9.766 -10.344
  450    HA   ALA  62           HA       ALA  62  -1.619   8.278  -8.672
  451   1HB   ALA  62          1HB       ALA  62  -1.643  10.265 -10.785
  452   2HB   ALA  62          2HB       ALA  62  -0.324   9.216 -10.267
  453   3HB   ALA  62          3HB       ALA  62  -0.579  10.769  -9.472
  454    H    LYS  63           H        LYS  63  -4.117  10.088  -7.760
  455    HA   LYS  63           HA       LYS  63  -2.576  11.504  -5.604
  456   1HB   LYS  63          1HB       LYS  63  -4.025  12.649  -7.609
  457   2HB   LYS  63          2HB       LYS  63  -5.274  12.466  -6.375
  458   1HG   LYS  63          1HG       LYS  63  -2.734  13.466  -5.300
  459   2HG   LYS  63          2HG       LYS  63  -3.454  14.543  -6.498
  460   1HD   LYS  63          1HD       LYS  63  -5.665  14.165  -5.186
  461   2HD   LYS  63          2HD       LYS  63  -4.618  13.588  -3.889
  462   1HE   LYS  63          1HE       LYS  63  -4.406  15.774  -3.290
  463   2HE   LYS  63          2HE       LYS  63  -3.394  15.959  -4.737
  464   1HZ   LYS  63          1HZ       LYS  63  -5.240  17.488  -4.854
  465   2HZ   LYS  63          2HZ       LYS  63  -6.352  16.228  -4.608
  466   3HZ   LYS  63          3HZ       LYS  63  -5.436  16.287  -6.037
  467    H    GLY  64           H        GLY  64  -4.775   9.042  -6.279
  468   1HA   GLY  64          1HA       GLY  64  -6.456   9.374  -3.922
  469   2HA   GLY  64          2HA       GLY  64  -6.444   7.978  -4.993
  470    H    TYR  65           H        TYR  65  -6.404   7.942  -2.105
  471    HA   TYR  65           HA       TYR  65  -3.655   7.123  -1.374
  472   1HB   TYR  65          1HB       TYR  65  -5.330   8.521   0.009
  473   2HB   TYR  65          2HB       TYR  65  -6.157   6.990   0.305
  474    HD1  TYR  65           HD1      TYR  65  -2.534   7.929   0.058
  475    HD2  TYR  65           HD2      TYR  65  -5.660   6.210   2.446
  476    HE1  TYR  65           HE1      TYR  65  -0.879   7.357   1.812
  477    HE2  TYR  65           HE2      TYR  65  -4.004   5.638   4.201
  478    HH   TYR  65           HH       TYR  65  -0.549   6.083   3.680
  479    H    TYR  66           H        TYR  66  -6.690   5.673  -2.310
  480    HA   TYR  66           HA       TYR  66  -5.859   3.029  -1.248
  481   1HB   TYR  66          1HB       TYR  66  -8.102   3.484  -0.786
  482   2HB   TYR  66          2HB       TYR  66  -8.340   4.337  -2.311
  483    HD1  TYR  66           HD1      TYR  66  -8.581   1.177  -0.600
  484    HD2  TYR  66           HD2      TYR  66  -8.293   3.018  -4.462
  485    HE1  TYR  66           HE1      TYR  66  -9.413  -0.910  -1.646
  486    HE2  TYR  66           HE2      TYR  66  -9.136   0.930  -5.522
  487    HH   TYR  66           HH       TYR  66  -9.230  -1.491  -4.985
  488    H    HIS  67           H        HIS  67  -5.437   4.840  -4.050
  489    HA   HIS  67           HA       HIS  67  -5.634   2.558  -5.937
  490   1HB   HIS  67          1HB       HIS  67  -6.389   4.650  -6.779
  491   2HB   HIS  67          2HB       HIS  67  -5.002   5.508  -6.108
  492    HD1  HIS  67           HD1      HIS  67  -5.815   2.929  -8.773
  493    HD2  HIS  67           HD2      HIS  67  -2.809   5.655  -7.823
  494    HE1  HIS  67           HE1      HIS  67  -4.155   2.858 -10.682
  495    H    ALA  68           H        ALA  68  -3.077   4.986  -5.343
  496    HA   ALA  68           HA       ALA  68  -0.917   3.581  -6.422
  497   1HB   ALA  68          1HB       ALA  68  -0.356   5.723  -5.822
  498   2HB   ALA  68          2HB       ALA  68   0.222   4.932  -4.355
  499   3HB   ALA  68          3HB       ALA  68  -1.370   5.689  -4.380
  500    H    MET  69           H        MET  69  -2.699   2.758  -3.574
  501    HA   MET  69           HA       MET  69  -0.458   1.190  -2.438
  502   1HB   MET  69          1HB       MET  69  -3.286   1.767  -1.538
  503   2HB   MET  69          2HB       MET  69  -2.079   0.916  -0.576
  504   1HG   MET  69          1HG       MET  69  -0.991   3.387  -1.621
  505   2HG   MET  69          2HG       MET  69  -2.461   3.695  -0.702
  506   1HE   MET  69          1HE       MET  69   0.493   4.802   0.868
  507   2HE   MET  69          2HE       MET  69   0.615   4.126  -0.754
  508   3HE   MET  69          3HE       MET  69   1.560   3.426   0.559
  509    H    HIS  70           H        HIS  70  -3.764   0.601  -3.705
  510    HA   HIS  70           HA       HIS  70  -3.239  -2.310  -3.529
  511   1HB   HIS  70          1HB       HIS  70  -5.707  -0.788  -4.399
  512   2HB   HIS  70          2HB       HIS  70  -5.629  -2.476  -3.890
  513    HD1  HIS  70           HD1      HIS  70  -5.971   0.947  -2.603
  514    HD2  HIS  70           HD2      HIS  70  -4.970  -2.781  -1.041
  515    HE1  HIS  70           HE1      HIS  70  -6.209   1.140  -0.093
  516    H    ASP  71           H        ASP  71  -3.263   0.260  -5.851
  517    HA   ASP  71           HA       ASP  71  -3.791  -1.435  -8.180
  518   1HB   ASP  71          1HB       ASP  71  -2.921   1.409  -7.658
  519   2HB   ASP  71          2HB       ASP  71  -3.061   0.770  -9.288
  520    H    LYS  72           H        LYS  72  -2.249  -2.728  -9.091
  521    HA   LYS  72           HA       LYS  72   0.586  -2.426  -8.357
  522   1HB   LYS  72          1HB       LYS  72   0.793  -4.555  -9.521
  523   2HB   LYS  72          2HB       LYS  72  -0.658  -4.605  -8.519
  524   1HG   LYS  72          1HG       LYS  72  -1.993  -3.914 -10.535
  525   2HG   LYS  72          2HG       LYS  72  -0.526  -4.081 -11.502
  526   1HD   LYS  72          1HD       LYS  72  -0.754  -6.450  -9.957
  527   2HD   LYS  72          2HD       LYS  72  -2.349  -6.135 -10.643
  528   1HE   LYS  72          1HE       LYS  72  -1.421  -6.013 -12.893
  529   2HE   LYS  72          2HE       LYS  72   0.228  -6.163 -12.254
  530   1HZ   LYS  72          1HZ       LYS  72  -0.884  -8.298 -13.014
  531   2HZ   LYS  72          2HZ       LYS  72  -1.881  -8.151 -11.646
  532   3HZ   LYS  72          3HZ       LYS  72  -0.199  -8.311 -11.462
  533    H    GLY  73           H        GLY  73  -1.390  -2.250 -11.319
  534   1HA   GLY  73          1HA       GLY  73   0.851  -1.518 -13.012
  535   2HA   GLY  73          2HA       GLY  73  -0.855  -1.395 -13.454
  536    H    THR  74           H        THR  74   1.266   0.125 -11.011
  537    HA   THR  74           HA       THR  74  -0.020   2.751 -11.650
  538    HB   THR  74           HB       THR  74   1.173   3.188  -9.329
  539    HG1  THR  74           1HG      THR  74   2.308   1.376  -9.049
  540   1HG2  THR  74          1HG2      THR  74  -0.821   2.087  -8.186
  541   2HG2  THR  74          2HG2      THR  74  -1.281   1.477  -9.777
  542   3HG2  THR  74          3HG2      THR  74  -1.218   3.214  -9.484
  543    H    LYS  75           H        LYS  75   1.450   4.656 -11.582
  544    HA   LYS  75           HA       LYS  75   3.614   4.711 -13.269
  545   1HB   LYS  75          1HB       LYS  75   2.401   6.479 -11.642
  546   2HB   LYS  75          2HB       LYS  75   3.858   6.212 -10.688
  547   1HG   LYS  75          1HG       LYS  75   4.064   8.117 -12.306
  548   2HG   LYS  75          2HG       LYS  75   5.266   6.852 -12.554
  549   1HD   LYS  75          1HD       LYS  75   2.894   6.222 -14.062
  550   2HD   LYS  75          2HD       LYS  75   3.418   7.861 -14.449
  551   1HE   LYS  75          1HE       LYS  75   5.583   5.825 -14.289
  552   2HE   LYS  75          2HE       LYS  75   4.472   5.686 -15.667
  553   1HZ   LYS  75          1HZ       LYS  75   5.987   7.250 -16.411
  554   2HZ   LYS  75          2HZ       LYS  75   6.174   7.963 -14.881
  555   3HZ   LYS  75          3HZ       LYS  75   4.758   8.233 -15.780
  556    H    PHE  76           H        PHE  76   3.567   3.590  -9.935
  557    HA   PHE  76           HA       PHE  76   6.320   2.461 -10.289
  558   1HB   PHE  76          1HB       PHE  76   5.210   3.879  -7.845
  559   2HB   PHE  76          2HB       PHE  76   6.825   3.203  -8.008
  560    HD1  PHE  76           HD1      PHE  76   4.726   6.046  -8.543
  561    HD2  PHE  76           HD2      PHE  76   8.297   4.114  -9.943
  562    HE1  PHE  76           HE1      PHE  76   5.443   8.158  -9.620
  563    HE2  PHE  76           HE2      PHE  76   9.016   6.231 -11.019
  564    HZ   PHE  76           HZ       PHE  76   7.582   8.245 -10.854
  565    H    LYS  77           H        LYS  77   6.665   0.876  -8.227
  566    HA   LYS  77           HA       LYS  77   4.400  -0.977  -8.332
  567   1HB   LYS  77          1HB       LYS  77   5.880  -2.373  -6.953
  568   2HB   LYS  77          2HB       LYS  77   6.748  -1.739  -8.346
  569   1HG   LYS  77          1HG       LYS  77   7.460   0.183  -6.774
  570   2HG   LYS  77          2HG       LYS  77   6.929  -0.876  -5.467
  571   1HD   LYS  77          1HD       LYS  77   9.325  -1.211  -5.878
  572   2HD   LYS  77          2HD       LYS  77   8.431  -2.660  -6.332
  573   1HE   LYS  77          1HE       LYS  77   8.462  -1.006  -8.636
  574   2HE   LYS  77          2HE       LYS  77  10.118  -1.021  -7.995
  575   1HZ   LYS  77          1HZ       LYS  77   9.814  -3.478  -7.698
  576   2HZ   LYS  77          2HZ       LYS  77   9.901  -2.958  -9.313
  577   3HZ   LYS  77          3HZ       LYS  77   8.399  -3.356  -8.625
  578    H    SER  78           H        SER  78   2.719  -0.682  -7.083
  579    HA   SER  78           HA       SER  78   2.640   1.158  -4.845
  580   1HB   SER  78          1HB       SER  78   0.668   1.082  -6.042
  581   2HB   SER  78          2HB       SER  78   0.819  -0.639  -6.375
  582    HG   SER  78           HG       SER  78  -0.217  -1.061  -4.592
  583    H    CYS  79           H        CYS  79   1.709   0.486  -2.710
  584    HA   CYS  79           HA       CYS  79   3.237  -1.310  -1.243
  585   1HB   CYS  79          1HB       CYS  79   0.289  -0.673  -0.910
  586   2HB   CYS  79          2HB       CYS  79   1.387  -1.182   0.369
  587    H    VAL  80           H        VAL  80   0.076  -1.978  -2.766
  588    HA   VAL  80           HA       VAL  80   0.272  -4.863  -2.206
  589    HB   VAL  80           HB       VAL  80  -1.630  -3.006  -3.640
  590   1HG1  VAL  80          1HG1      VAL  80  -2.857  -5.526  -3.343
  591   2HG1  VAL  80          2HG1      VAL  80  -1.283  -5.838  -4.075
  592   3HG1  VAL  80          3HG1      VAL  80  -2.413  -4.728  -4.852
  593   1HG2  VAL  80          1HG2      VAL  80  -2.624  -4.789  -1.528
  594   2HG2  VAL  80          2HG2      VAL  80  -2.790  -3.040  -1.682
  595   3HG2  VAL  80          3HG2      VAL  80  -1.331  -3.726  -0.971
  596    H    GLY  81           H        GLY  81   0.900  -2.639  -4.863
  597   1HA   GLY  81          1HA       GLY  81   1.041  -4.608  -6.963
  598   2HA   GLY  81          2HA       GLY  81   1.765  -2.999  -7.018
  599    H    CYS  82           H        CYS  82   3.428  -3.229  -4.722
  600    HA   CYS  82           HA       CYS  82   5.651  -4.787  -5.855
  601   1HB   CYS  82          1HB       CYS  82   5.639  -2.482  -4.625
  602   2HB   CYS  82          2HB       CYS  82   5.538  -3.440  -3.152
  603    H    HIS  83           H        HIS  83   3.214  -5.088  -3.413
  604    HA   HIS  83           HA       HIS  83   4.462  -7.170  -1.839
  605   1HB   HIS  83          1HB       HIS  83   1.817  -5.816  -2.153
  606   2HB   HIS  83          2HB       HIS  83   1.850  -7.328  -1.262
  607    HD1  HIS  83           HD1      HIS  83   1.392  -5.972   0.974
  608    HD2  HIS  83           HD2      HIS  83   4.984  -5.039  -0.923
  609    HE1  HIS  83           HE1      HIS  83   2.785  -4.711   2.666
  610    H    LEU  84           H        LEU  84   1.693  -7.295  -4.158
  611    HA   LEU  84           HA       LEU  84   1.415 -10.079  -4.335
  612   1HB   LEU  84          1HB       LEU  84   0.511  -7.731  -5.579
  613   2HB   LEU  84          2HB       LEU  84   1.181  -8.702  -6.885
  614    HG   LEU  84           HG       LEU  84  -0.605  -9.975  -4.844
  615   1HD1  LEU  84          1HD1      LEU  84  -1.665  -8.731  -7.383
  616   2HD1  LEU  84          2HD1      LEU  84  -1.649  -7.842  -5.859
  617   3HD1  LEU  84          3HD1      LEU  84  -2.575  -9.337  -5.999
  618   1HD2  LEU  84          1HD2      LEU  84  -1.132 -11.438  -6.783
  619   2HD2  LEU  84          2HD2      LEU  84   0.600 -11.398  -6.451
  620   3HD2  LEU  84          3HD2      LEU  84  -0.063 -10.463  -7.791
  621    H    GLU  85           H        GLU  85   3.839  -7.952  -5.766
  622    HA   GLU  85           HA       GLU  85   4.952 -10.066  -7.491
  623   1HB   GLU  85          1HB       GLU  85   5.702  -7.215  -6.785
  624   2HB   GLU  85          2HB       GLU  85   6.631  -8.199  -7.917
  625   1HG   GLU  85          1HG       GLU  85   4.690  -8.457  -9.362
  626   2HG   GLU  85          2HG       GLU  85   3.671  -7.608  -8.198
  627    H    THR  86           H        THR  86   6.089  -8.153  -4.673
  628    HA   THR  86           HA       THR  86   8.545  -9.522  -4.266
  629    HB   THR  86           HB       THR  86   6.608  -7.944  -2.590
  630    HG1  THR  86           1HG      THR  86   8.011  -6.440  -3.005
  631   1HG2  THR  86          1HG2      THR  86   8.079  -8.111  -0.654
  632   2HG2  THR  86          2HG2      THR  86   9.166  -9.183  -1.537
  633   3HG2  THR  86          3HG2      THR  86   7.543  -9.728  -1.114
  634    H    ALA  87           H        ALA  87   5.307 -10.589  -3.821
  635    HA   ALA  87           HA       ALA  87   6.040 -12.688  -1.859
  636   1HB   ALA  87          1HB       ALA  87   3.951 -11.717  -1.408
  637   2HB   ALA  87          2HB       ALA  87   3.488 -13.154  -2.319
  638   3HB   ALA  87          3HB       ALA  87   3.540 -11.583  -3.117
  639    H    GLY  88           H        GLY  88   5.154 -12.314  -5.257
  640   1HA   GLY  88          1HA       GLY  88   5.244 -13.825  -7.046
  641   2HA   GLY  88          2HA       GLY  88   6.485 -14.665  -6.116
  642    H    ALA  89           H        ALA  89   5.779 -16.775  -6.455
  643    HA   ALA  89           HA       ALA  89   2.959 -17.507  -6.038
  644   1HB   ALA  89          1HB       ALA  89   3.639 -19.539  -6.969
  645   2HB   ALA  89          2HB       ALA  89   5.262 -19.413  -6.293
  646   3HB   ALA  89          3HB       ALA  89   4.805 -18.422  -7.677
  647    H    ASP  90           H        ASP  90   3.920 -16.384  -3.685
  648    HA   ASP  90           HA       ASP  90   4.355 -18.754  -1.912
  649   1HB   ASP  90          1HB       ASP  90   6.237 -17.197  -2.005
  650   2HB   ASP  90          2HB       ASP  90   5.168 -15.845  -1.640
  651    H    ALA  91           H        ALA  91   1.990 -18.945  -1.954
  652    HA   ALA  91           HA       ALA  91  -0.022 -17.196  -1.352
  653   1HB   ALA  91          1HB       ALA  91  -1.158 -19.073  -0.381
  654   2HB   ALA  91          2HB       ALA  91   0.359 -19.795   0.154
  655   3HB   ALA  91          3HB       ALA  91  -0.036 -19.745  -1.564
  656    H    ALA  92           H        ALA  92   2.558 -18.150   0.831
  657    HA   ALA  92           HA       ALA  92   1.342 -17.047   3.241
  658   1HB   ALA  92          1HB       ALA  92   3.208 -17.969   4.206
  659   2HB   ALA  92          2HB       ALA  92   4.286 -17.250   3.010
  660   3HB   ALA  92          3HB       ALA  92   3.418 -18.738   2.633
  661    H    LYS  93           H        LYS  93   3.684 -15.981   0.818
  662    HA   LYS  93           HA       LYS  93   4.117 -13.368   2.031
  663   1HB   LYS  93          1HB       LYS  93   4.910 -14.954  -0.341
  664   2HB   LYS  93          2HB       LYS  93   4.987 -13.210  -0.544
  665   1HG   LYS  93          1HG       LYS  93   6.314 -13.101   1.596
  666   2HG   LYS  93          2HG       LYS  93   6.350 -14.866   1.592
  667   1HD   LYS  93          1HD       LYS  93   7.347 -14.713  -0.750
  668   2HD   LYS  93          2HD       LYS  93   7.556 -12.988  -0.450
  669   1HE   LYS  93          1HE       LYS  93   9.399 -13.367   0.814
  670   2HE   LYS  93          2HE       LYS  93   8.542 -14.578   1.789
  671   1HZ   LYS  93          1HZ       LYS  93   9.931 -14.944  -0.795
  672   2HZ   LYS  93          2HZ       LYS  93   8.727 -16.031  -0.287
  673   3HZ   LYS  93          3HZ       LYS  93  10.132 -15.817   0.646
  674    H    LYS  94           H        LYS  94   1.879 -14.803  -0.246
  675    HA   LYS  94           HA       LYS  94   0.974 -12.281  -1.415
  676   1HB   LYS  94          1HB       LYS  94   0.605 -15.122  -1.723
  677   2HB   LYS  94          2HB       LYS  94  -0.976 -14.342  -1.637
  678   1HG   LYS  94          1HG       LYS  94   0.470 -12.630  -3.268
  679   2HG   LYS  94          2HG       LYS  94   1.043 -14.225  -3.759
  680   1HD   LYS  94          1HD       LYS  94  -1.659 -14.656  -3.541
  681   2HD   LYS  94          2HD       LYS  94  -1.608 -12.991  -4.123
  682   1HE   LYS  94          1HE       LYS  94  -0.410 -13.594  -6.088
  683   2HE   LYS  94          2HE       LYS  94   0.030 -15.181  -5.425
  684   1HZ   LYS  94          1HZ       LYS  94  -2.718 -14.239  -6.061
  685   2HZ   LYS  94          2HZ       LYS  94  -2.348 -15.719  -5.312
  686   3HZ   LYS  94          3HZ       LYS  94  -1.845 -15.422  -6.907
  687    H    LYS  95           H        LYS  95   0.212 -14.185   1.411
  688    HA   LYS  95           HA       LYS  95  -2.332 -12.768   1.925
  689   1HB   LYS  95          1HB       LYS  95  -2.572 -14.385   3.635
  690   2HB   LYS  95          2HB       LYS  95  -1.675 -15.248   2.387
  691   1HG   LYS  95          1HG       LYS  95  -0.185 -15.716   4.028
  692   2HG   LYS  95          2HG       LYS  95   0.341 -14.044   3.837
  693   1HD   LYS  95          1HD       LYS  95  -1.350 -13.358   5.542
  694   2HD   LYS  95          2HD       LYS  95  -1.747 -15.059   5.787
  695   1HE   LYS  95          1HE       LYS  95   1.134 -14.242   5.985
  696   2HE   LYS  95          2HE       LYS  95   0.051 -13.883   7.346
  697   1HZ   LYS  95          1HZ       LYS  95   1.163 -16.204   7.206
  698   2HZ   LYS  95          2HZ       LYS  95  -0.041 -16.526   6.052
  699   3HZ   LYS  95          3HZ       LYS  95  -0.474 -16.094   7.637
  700    H    GLU  96           H        GLU  96   1.032 -12.534   2.722
  701    HA   GLU  96           HA       GLU  96   0.577 -10.776   5.064
  702   1HB   GLU  96          1HB       GLU  96   2.981 -11.012   5.287
  703   2HB   GLU  96          2HB       GLU  96   2.330 -12.591   4.884
  704   1HG   GLU  96          1HG       GLU  96   2.948 -12.291   2.562
  705   2HG   GLU  96          2HG       GLU  96   3.501 -10.649   2.894
  706    H    LEU  97           H        LEU  97   1.988 -10.670   1.828
  707    HA   LEU  97           HA       LEU  97   2.550  -7.806   1.908
  708   1HB   LEU  97          1HB       LEU  97   2.455  -9.812  -0.356
  709   2HB   LEU  97          2HB       LEU  97   3.255  -8.240  -0.397
  710    HG   LEU  97           HG       LEU  97   3.992 -10.666   1.237
  711   1HD1  LEU  97          1HD1      LEU  97   5.352 -10.808  -0.563
  712   2HD1  LEU  97          2HD1      LEU  97   6.259  -9.519   0.227
  713   3HD1  LEU  97          3HD1      LEU  97   5.076  -9.128  -1.019
  714   1HD2  LEU  97          1HD2      LEU  97   4.877  -7.790   1.637
  715   2HD2  LEU  97          2HD2      LEU  97   5.647  -9.186   2.389
  716   3HD2  LEU  97          3HD2      LEU  97   3.979  -8.775   2.792
  717    H    THR  98           H        THR  98   0.466  -9.654  -0.338
  718    HA   THR  98           HA       THR  98  -1.132  -7.231  -0.842
  719    HB   THR  98           HB       THR  98  -2.238  -8.806  -2.472
  720    HG1  THR  98           1HG      THR  98  -1.384 -10.847  -2.650
  721   1HG2  THR  98          1HG2      THR  98  -0.573  -8.360  -3.953
  722   2HG2  THR  98          2HG2      THR  98   0.638  -9.199  -2.982
  723   3HG2  THR  98          3HG2      THR  98   0.188  -7.540  -2.590
  724    H    GLY  99           H        GLY  99  -1.320  -9.971   1.242
  725   1HA   GLY  99          1HA       GLY  99  -4.054 -10.501   1.430
  726   2HA   GLY  99          2HA       GLY  99  -2.974 -10.525   2.823
  727    H    CYS 100           H        CYS 100  -5.761  -9.207   1.843
  728    HA   CYS 100           HA       CYS 100  -5.328  -6.446   2.737
  729   1HB   CYS 100          1HB       CYS 100  -8.054  -7.513   2.475
  730   2HB   CYS 100          2HB       CYS 100  -7.359  -6.079   1.776
  731    H    LYS 101           H        LYS 101  -7.596  -8.990   3.800
  732    HA   LYS 101           HA       LYS 101  -7.696  -7.666   6.450
  733   1HB   LYS 101          1HB       LYS 101  -9.554  -8.777   4.755
  734   2HB   LYS 101          2HB       LYS 101  -9.331 -10.058   5.947
  735   1HG   LYS 101          1HG       LYS 101  -9.666  -8.334   7.754
  736   2HG   LYS 101          2HG       LYS 101 -10.089  -7.176   6.492
  737   1HD   LYS 101          1HD       LYS 101 -11.955  -8.571   5.776
  738   2HD   LYS 101          2HD       LYS 101 -11.500  -9.823   6.933
  739   1HE   LYS 101          1HE       LYS 101 -11.929  -8.278   8.806
  740   2HE   LYS 101          2HE       LYS 101 -12.359  -6.997   7.655
  741   1HZ   LYS 101          1HZ       LYS 101 -14.368  -8.082   8.281
  742   2HZ   LYS 101          2HZ       LYS 101 -13.701  -9.622   8.012
  743   3HZ   LYS 101          3HZ       LYS 101 -14.007  -8.584   6.701
  744    H    GLY 102           H        GLY 102  -5.476  -9.626   5.382
  745   1HA   GLY 102          1HA       GLY 102  -5.138 -10.980   7.956
  746   2HA   GLY 102          2HA       GLY 102  -5.427 -12.082   6.609
  747    H    SER 103           H        SER 103  -3.592  -9.031   6.570
  748    HA   SER 103           HA       SER 103  -1.174 -10.624   5.829
  749   1HB   SER 103          1HB       SER 103  -0.775  -8.970   4.177
  750   2HB   SER 103          2HB       SER 103  -2.485  -9.326   4.069
  751    HG   SER 103           HG       SER 103  -2.946  -7.445   5.058
  752    H    LYS 104           H        LYS 104   0.350  -8.149   5.624
  753    HA   LYS 104           HA       LYS 104   0.899  -7.676   8.520
  754   1HB   LYS 104          1HB       LYS 104   2.414  -7.157   5.941
  755   2HB   LYS 104          2HB       LYS 104   3.056  -6.873   7.557
  756   1HG   LYS 104          1HG       LYS 104   1.955  -9.560   7.293
  757   2HG   LYS 104          2HG       LYS 104   3.240  -9.258   6.122
  758   1HD   LYS 104          1HD       LYS 104   4.538  -8.265   8.150
  759   2HD   LYS 104          2HD       LYS 104   3.371  -9.153   9.129
  760   1HE   LYS 104          1HE       LYS 104   4.532 -10.736   6.920
  761   2HE   LYS 104          2HE       LYS 104   5.694 -10.252   8.173
  762   1HZ   LYS 104          1HZ       LYS 104   4.731 -12.153   9.062
  763   2HZ   LYS 104          2HZ       LYS 104   3.182 -11.776   8.475
  764   3HZ   LYS 104          3HZ       LYS 104   3.830 -10.911   9.785
  765    H    CYS 105           H        CYS 105  -0.085  -6.243   5.541
  766    HA   CYS 105           HA       CYS 105   0.300  -3.465   6.300
  767   1HB   CYS 105          1HB       CYS 105  -0.065  -5.017   4.027
  768   2HB   CYS 105          2HB       CYS 105  -1.575  -4.153   4.170
  769    H    HIS 106           H        HIS 106  -2.264  -5.837   6.613
  770    HA   HIS 106           HA       HIS 106  -4.061  -3.696   7.710
  771   1HB   HIS 106          1HB       HIS 106  -4.455  -5.985   5.838
  772   2HB   HIS 106          2HB       HIS 106  -5.788  -5.594   6.925
  773    HD1  HIS 106           HD1      HIS 106  -5.205  -2.474   6.958
  774    HD2  HIS 106           HD2      HIS 106  -5.664  -4.822   3.522
  775    HE1  HIS 106           HE1      HIS 106  -5.772  -0.881   5.081
  776    H    SER 107           H        SER 107  -2.791  -4.388   9.759
  777    HA   SER 107           HA       SER 107  -3.436  -7.039  10.856
  778   1HB   SER 107          1HB       SER 107  -2.347  -4.855  12.549
  779   2HB   SER 107          2HB       SER 107  -1.772  -6.507  12.343
  780    HG   SER 107           HG       SER 107  -0.294  -5.303  11.300
  781    HHA  HEC 201           HHA      HEC 201   5.922   8.569   5.660
  782    HHB  HEC 201           HHB      HEC 201  12.004   9.797   4.836
  783    HHC  HEC 201           HHC      HEC 201  12.543   4.732   1.067
  784    HHD  HEC 201           HHD      HEC 201   6.441   3.529   1.826
  785   1HMA  HEC 201          1HMA      HEC 201  11.212  10.641   6.960
  786   2HMA  HEC 201          2HMA      HEC 201   9.736  10.658   7.931
  787   3HMA  HEC 201          3HMA      HEC 201   9.992  11.885   6.689
  788   1HAA  HEC 201          1HAA      HEC 201   6.341   9.766   7.120
  789   2HAA  HEC 201          2HAA      HEC 201   7.659  10.677   7.854
  790   1HBA  HEC 201          1HBA      HEC 201   6.683  11.566   5.181
  791   2HBA  HEC 201          2HBA      HEC 201   5.661  11.903   6.580
  792   1HMB  HEC 201          1HMB      HEC 201  14.843   9.296   2.921
  793   2HMB  HEC 201          2HMB      HEC 201  15.074   8.311   4.366
  794   3HMB  HEC 201          3HMB      HEC 201  13.947   9.667   4.394
  795    HAB  HEC 201           HAB      HEC 201  14.346   5.621   1.113
  796   1HBB  HEC 201          1HBB      HEC 201  15.459   4.867   3.047
  797   2HBB  HEC 201          2HBB      HEC 201  15.696   6.505   3.658
  798   3HBB  HEC 201          3HBB      HEC 201  16.646   5.929   2.288
  799   1HMC  HEC 201          1HMC      HEC 201  11.492   3.184  -0.916
  800   2HMC  HEC 201          2HMC      HEC 201  10.837   1.675  -0.278
  801   3HMC  HEC 201          3HMC      HEC 201  12.170   2.478   0.551
  802    HAC  HEC 201           HAC      HEC 201   7.105   2.210   0.622
  803   1HBC  HEC 201          1HBC      HEC 201   9.364   0.582  -0.470
  804   2HBC  HEC 201          2HBC      HEC 201   7.812   0.049   0.174
  805   3HBC  HEC 201          3HBC      HEC 201   9.088   0.572   1.270
  806   1HMD  HEC 201          1HMD      HEC 201   4.621   3.290   3.072
  807   2HMD  HEC 201          2HMD      HEC 201   3.786   3.967   4.469
  808   3HMD  HEC 201          3HMD      HEC 201   3.387   4.530   2.844
  809   1HAD  HEC 201          1HAD      HEC 201   4.243   7.828   5.612
  810   2HAD  HEC 201          2HAD      HEC 201   3.216   7.332   4.273
  811   1HBD  HEC 201          1HBD      HEC 201   2.714   5.243   5.306
  812   2HBD  HEC 201          2HBD      HEC 201   4.009   5.440   6.487
  813    HHA  HEC 202           HHA      HEC 202   1.572   7.713  -9.526
  814    HHB  HEC 202           HHB      HEC 202   2.864   4.169  -4.865
  815    HHC  HEC 202           HHC      HEC 202   4.331   9.010  -1.216
  816    HHD  HEC 202           HHD      HEC 202   2.512  12.965  -5.893
  817   1HMA  HEC 202          1HMA      HEC 202   1.128   3.197  -5.953
  818   2HMA  HEC 202          2HMA      HEC 202   2.151   2.880  -7.354
  819   3HMA  HEC 202          3HMA      HEC 202   0.447   3.276  -7.577
  820   1HAA  HEC 202          1HAA      HEC 202   1.134   5.354 -10.063
  821   2HAA  HEC 202          2HAA      HEC 202   0.028   4.461  -9.056
  822   1HBA  HEC 202          1HBA      HEC 202  -1.279   6.498  -8.666
  823   2HBA  HEC 202          2HBA      HEC 202  -0.182   7.402  -9.707
  824   1HMB  HEC 202          1HMB      HEC 202   4.365   3.425  -3.361
  825   2HMB  HEC 202          2HMB      HEC 202   4.854   3.843  -1.719
  826   3HMB  HEC 202          3HMB      HEC 202   3.154   3.543  -2.085
  827    HAB  HEC 202           HAB      HEC 202   3.962   7.025   0.074
  828   1HBB  HEC 202          1HBB      HEC 202   6.299   5.600   0.367
  829   2HBB  HEC 202          2HBB      HEC 202   6.217   7.343   0.120
  830   3HBB  HEC 202          3HBB      HEC 202   6.479   6.268  -1.254
  831   1HMC  HEC 202          1HMC      HEC 202   4.432  12.872  -1.000
  832   2HMC  HEC 202          2HMC      HEC 202   4.057  11.272  -0.360
  833   3HMC  HEC 202          3HMC      HEC 202   5.608  11.565  -1.148
  834    HAC  HEC 202           HAC      HEC 202   2.567  14.064  -4.093
  835   1HBC  HEC 202          1HBC      HEC 202   4.984  14.544  -3.959
  836   2HBC  HEC 202          2HBC      HEC 202   4.985  14.143  -2.242
  837   3HBC  HEC 202          3HBC      HEC 202   4.114  15.566  -2.815
  838   1HMD  HEC 202          1HMD      HEC 202   2.719  13.564  -8.446
  839   2HMD  HEC 202          2HMD      HEC 202   0.970  13.429  -8.258
  840   3HMD  HEC 202          3HMD      HEC 202   1.730  12.982  -9.786
  841   1HAD  HEC 202          1HAD      HEC 202   1.867   9.255 -10.743
  842   2HAD  HEC 202          2HAD      HEC 202   1.020  10.785 -10.904
  843   1HBD  HEC 202          1HBD      HEC 202   3.894  11.066 -10.352
  844   2HBD  HEC 202          2HBD      HEC 202   3.531  10.265 -11.881
  845    HHA  HEC 203           HHA      HEC 203   7.215  -6.910   4.593
  846    HHB  HEC 203           HHB      HEC 203   2.894  -2.074   4.872
  847    HHC  HEC 203           HHC      HEC 203   4.783  -0.066  -0.566
  848    HHD  HEC 203           HHD      HEC 203   9.136  -4.591  -0.923
  849   1HMA  HEC 203          1HMA      HEC 203   3.670  -3.247   7.523
  850   2HMA  HEC 203          2HMA      HEC 203   3.311  -4.972   7.599
  851   3HMA  HEC 203          3HMA      HEC 203   2.355  -3.917   6.559
  852   1HAA  HEC 203          1HAA      HEC 203   4.998  -6.106   7.713
  853   2HAA  HEC 203          2HAA      HEC 203   4.699  -7.312   6.469
  854   1HBA  HEC 203          1HBA      HEC 203   6.900  -7.862   6.298
  855   2HBA  HEC 203          2HBA      HEC 203   7.431  -6.189   6.471
  856   1HMB  HEC 203          1HMB      HEC 203   2.691   0.699   4.784
  857   2HMB  HEC 203          2HMB      HEC 203   1.607   0.929   3.412
  858   3HMB  HEC 203          3HMB      HEC 203   1.537  -0.561   4.351
  859    HAB  HEC 203           HAB      HEC 203   2.895   0.810   0.027
  860   1HBB  HEC 203          1HBB      HEC 203   3.247   3.215   1.577
  861   2HBB  HEC 203          2HBB      HEC 203   4.042   2.761   0.070
  862   3HBB  HEC 203          3HBB      HEC 203   4.747   2.285   1.616
  863   1HMC  HEC 203          1HMC      HEC 203   7.388   0.180  -2.752
  864   2HMC  HEC 203          2HMC      HEC 203   6.310  -0.904  -3.630
  865   3HMC  HEC 203          3HMC      HEC 203   5.668   0.139  -2.361
  866    HAC  HEC 203           HAC      HEC 203   9.376  -3.495  -2.570
  867   1HBC  HEC 203          1HBC      HEC 203   9.271  -0.899  -2.916
  868   2HBC  HEC 203          2HBC      HEC 203   8.253  -1.301  -4.297
  869   3HBC  HEC 203          3HBC      HEC 203   9.907  -1.906  -4.216
  870   1HMD  HEC 203          1HMD      HEC 203  11.073  -6.904   1.128
  871   2HMD  HEC 203          2HMD      HEC 203  10.479  -6.120  -0.337
  872   3HMD  HEC 203          3HMD      HEC 203  10.008  -7.781   0.028
  873   1HAD  HEC 203          1HAD      HEC 203  10.144  -7.818   3.410
  874   2HAD  HEC 203          2HAD      HEC 203   8.525  -8.211   3.975
  875   1HBD  HEC 203          1HBD      HEC 203   8.226  -9.837   2.406
  876   2HBD  HEC 203          2HBD      HEC 203   9.093  -8.935   1.162
  877    HHA  HEC 204           HHA      HEC 204  -6.721   2.230   3.780
  878    HHB  HEC 204           HHB      HEC 204  -9.889  -2.043   0.534
  879    HHC  HEC 204           HHC      HEC 204  -4.680  -5.888   0.897
  880    HHD  HEC 204           HHD      HEC 204  -1.382  -0.921   2.622
  881   1HMA  HEC 204          1HMA      HEC 204 -10.867   1.097   0.672
  882   2HMA  HEC 204          2HMA      HEC 204 -11.583   0.557   2.192
  883   3HMA  HEC 204          3HMA      HEC 204 -11.207  -0.615   0.929
  884   1HAA  HEC 204          1HAA      HEC 204 -10.038   2.080   4.152
  885   2HAA  HEC 204          2HAA      HEC 204  -8.507   2.859   3.760
  886   1HBA  HEC 204          1HBA      HEC 204  -9.325   3.376   1.506
  887   2HBA  HEC 204          2HBA      HEC 204 -10.837   2.546   1.853
  888   1HMB  HEC 204          1HMB      HEC 204  -9.486  -4.667  -1.877
  889   2HMB  HEC 204          2HMB      HEC 204 -10.351  -3.789  -0.617
  890   3HMB  HEC 204          3HMB      HEC 204 -10.029  -5.512  -0.427
  891    HAB  HEC 204           HAB      HEC 204  -6.320  -6.929   0.097
  892   1HBB  HEC 204          1HBB      HEC 204  -5.407  -6.308  -1.974
  893   2HBB  HEC 204          2HBB      HEC 204  -6.958  -5.738  -2.595
  894   3HBB  HEC 204          3HBB      HEC 204  -6.661  -7.468  -2.414
  895   1HMC  HEC 204          1HMC      HEC 204  -2.913  -6.614   1.376
  896   2HMC  HEC 204          2HMC      HEC 204  -1.480  -6.054   0.514
  897   3HMC  HEC 204          3HMC      HEC 204  -1.465  -6.158   2.275
  898    HAC  HEC 204           HAC      HEC 204  -0.303  -2.427   2.867
  899   1HBC  HEC 204          1HBC      HEC 204   0.296  -2.652   0.402
  900   2HBC  HEC 204          2HBC      HEC 204   0.533  -4.376   0.693
  901   3HBC  HEC 204          3HBC      HEC 204   1.549  -3.194   1.519
  902   1HMD  HEC 204          1HMD      HEC 204  -1.456   2.703   3.267
  903   2HMD  HEC 204          2HMD      HEC 204  -1.317   1.588   4.627
  904   3HMD  HEC 204          3HMD      HEC 204  -0.825   1.075   3.013
  905   1HAD  HEC 204          1HAD      HEC 204  -3.612   3.879   3.633
  906   2HAD  HEC 204          2HAD      HEC 204  -5.275   3.504   4.069
  907   1HBD  HEC 204          1HBD      HEC 204  -4.086   2.233   6.081
  908   2HBD  HEC 204          2HBD      HEC 204  -2.808   3.400   5.743
  Start of MODEL    5
    1   1H    ALA   1          1H        ALA   1  20.450  14.470   0.595
    2   2H    ALA   1          2H        ALA   1  19.525  15.219   1.807
    3   3H    ALA   1          3H        ALA   1  18.763  14.301   0.597
    4    HA   ALA   1           HA       ALA   1  19.714  12.272   1.434
    5   1HB   ALA   1          1HB       ALA   1  21.477  12.311   2.960
    6   2HB   ALA   1          2HB       ALA   1  20.971  13.852   3.655
    7   3HB   ALA   1          3HB       ALA   1  21.775  13.813   2.085
    8    HA   PRO   2           HA       PRO   2  16.064  13.280   3.985
    9   1HB   PRO   2          1HB       PRO   2  14.695  11.010   3.307
   10   2HB   PRO   2          2HB       PRO   2  14.679  12.477   2.317
   11   1HG   PRO   2          1HG       PRO   2  16.232   9.969   1.955
   12   2HG   PRO   2          2HG       PRO   2  15.473  11.010   0.742
   13   1HD   PRO   2          1HD       PRO   2  18.149  11.021   1.283
   14   2HD   PRO   2          2HD       PRO   2  17.267  12.425   0.645
   15    H    LYS   3           H        LYS   3  15.586  12.447   6.050
   16    HA   LYS   3           HA       LYS   3  17.280  10.147   6.931
   17   1HB   LYS   3          1HB       LYS   3  15.784  12.179   8.586
   18   2HB   LYS   3          2HB       LYS   3  17.093  11.122   9.105
   19   1HG   LYS   3          1HG       LYS   3  18.677  12.283   7.676
   20   2HG   LYS   3          2HG       LYS   3  17.387  13.263   6.981
   21   1HD   LYS   3          1HD       LYS   3  16.919  14.135   9.308
   22   2HD   LYS   3          2HD       LYS   3  18.389  13.315   9.838
   23   1HE   LYS   3          1HE       LYS   3  19.709  14.945   8.969
   24   2HE   LYS   3          2HE       LYS   3  18.827  14.928   7.429
   25   1HZ   LYS   3          1HZ       LYS   3  16.956  15.964   8.908
   26   2HZ   LYS   3          2HZ       LYS   3  18.174  16.948   8.249
   27   3HZ   LYS   3          3HZ       LYS   3  18.262  16.455   9.872
   28    H    ALA   4           H        ALA   4  15.789   8.568   6.126
   29    HA   ALA   4           HA       ALA   4  13.077   8.246   6.389
   30   1HB   ALA   4          1HB       ALA   4  15.144   6.658   5.738
   31   2HB   ALA   4          2HB       ALA   4  13.540   6.005   6.072
   32   3HB   ALA   4          3HB       ALA   4  14.780   5.980   7.326
   33    HA   PRO   5           HA       PRO   5  12.349   8.475  10.729
   34   1HB   PRO   5          1HB       PRO   5   9.704   7.762  10.670
   35   2HB   PRO   5          2HB       PRO   5  10.300   9.364  10.207
   36   1HG   PRO   5          1HG       PRO   5   9.313   7.171   8.509
   37   2HG   PRO   5          2HG       PRO   5   9.377   8.908   8.199
   38   1HD   PRO   5          1HD       PRO   5  11.143   6.946   7.194
   39   2HD   PRO   5          2HD       PRO   5  11.314   8.706   7.067
   40    H    ALA   6           H        ALA   6  11.682   7.032  12.516
   41    HA   ALA   6           HA       ALA   6  12.810   4.461  12.409
   42   1HB   ALA   6          1HB       ALA   6  10.721   5.741  14.189
   43   2HB   ALA   6          2HB       ALA   6  12.458   5.639  14.477
   44   3HB   ALA   6          3HB       ALA   6  11.465   4.183  14.552
   45    H    ASP   7           H        ASP   7  11.666   2.391  12.675
   46    HA   ASP   7           HA       ASP   7   9.649   1.961  10.636
   47   1HB   ASP   7          1HB       ASP   7  10.551   0.075  12.823
   48   2HB   ASP   7          2HB       ASP   7  10.012  -0.330  11.196
   49    H    GLY   8           H        GLY   8   7.563   0.906  11.156
   50   1HA   GLY   8          1HA       GLY   8   5.731   0.423  12.647
   51   2HA   GLY   8          2HA       GLY   8   6.521   1.398  13.885
   52    H    LEU   9           H        LEU   9   6.486   2.820  10.767
   53    HA   LEU   9           HA       LEU   9   4.990   5.109  11.599
   54   1HB   LEU   9          1HB       LEU   9   6.507   4.280   9.411
   55   2HB   LEU   9          2HB       LEU   9   4.892   4.515   8.738
   56    HG   LEU   9           HG       LEU   9   5.853   6.601  10.620
   57   1HD1  LEU   9          1HD1      LEU   9   7.884   6.446   9.427
   58   2HD1  LEU   9          2HD1      LEU   9   6.992   7.686   8.546
   59   3HD1  LEU   9          3HD1      LEU   9   7.068   6.039   7.916
   60   1HD2  LEU   9          1HD2      LEU   9   3.765   7.100   9.688
   61   2HD2  LEU   9          2HD2      LEU   9   4.182   6.394   8.128
   62   3HD2  LEU   9          3HD2      LEU   9   4.854   7.959   8.593
   63    H    LYS  10           H        LYS  10   2.821   5.219  11.949
   64    HA   LYS  10           HA       LYS  10   1.103   3.087  10.778
   65   1HB   LYS  10          1HB       LYS  10   1.192   4.708  13.211
   66   2HB   LYS  10          2HB       LYS  10  -0.421   4.625  12.499
   67   1HG   LYS  10          1HG       LYS  10   0.149   2.056  12.262
   68   2HG   LYS  10          2HG       LYS  10   1.292   2.405  13.561
   69   1HD   LYS  10          1HD       LYS  10  -1.696   2.916  13.607
   70   2HD   LYS  10          2HD       LYS  10  -0.824   1.703  14.544
   71   1HE   LYS  10          1HE       LYS  10   0.561   3.876  15.324
   72   2HE   LYS  10          2HE       LYS  10  -0.997   4.651  14.967
   73   1HZ   LYS  10          1HZ       LYS  10  -1.863   2.483  16.177
   74   2HZ   LYS  10          2HZ       LYS  10  -1.457   3.888  17.043
   75   3HZ   LYS  10          3HZ       LYS  10  -0.356   2.597  16.947
   76    H    MET  11           H        MET  11   0.197   3.622   8.875
   77    HA   MET  11           HA       MET  11  -0.383   6.435   8.175
   78   1HB   MET  11          1HB       MET  11  -1.214   5.147   6.049
   79   2HB   MET  11          2HB       MET  11   0.515   5.190   6.378
   80   1HG   MET  11          1HG       MET  11  -0.924   2.969   7.676
   81   2HG   MET  11          2HG       MET  11  -0.919   2.908   5.916
   82   1HE   MET  11          1HE       MET  11   1.628   3.982   4.792
   83   2HE   MET  11          2HE       MET  11   0.851   2.435   4.471
   84   3HE   MET  11          3HE       MET  11   2.581   2.492   4.797
   85    H    ASP  12           H        ASP  12  -2.197   7.120   9.299
   86    HA   ASP  12           HA       ASP  12  -4.573   5.293   9.339
   87   1HB   ASP  12          1HB       ASP  12  -5.246   7.037  11.144
   88   2HB   ASP  12          2HB       ASP  12  -3.955   5.903  11.521
   89    H    LYS  13           H        LYS  13  -3.558   7.351   7.222
   90    HA   LYS  13           HA       LYS  13  -5.225   9.578   6.985
   91   1HB   LYS  13          1HB       LYS  13  -4.049   7.580   5.064
   92   2HB   LYS  13          2HB       LYS  13  -4.990   8.945   4.468
   93   1HG   LYS  13          1HG       LYS  13  -2.586   9.166   6.302
   94   2HG   LYS  13          2HG       LYS  13  -2.551   9.450   4.562
   95   1HD   LYS  13          1HD       LYS  13  -4.443  11.157   4.998
   96   2HD   LYS  13          2HD       LYS  13  -3.967  11.047   6.693
   97   1HE   LYS  13          1HE       LYS  13  -1.605  11.352   5.056
   98   2HE   LYS  13          2HE       LYS  13  -2.759  12.653   4.703
   99   1HZ   LYS  13          1HZ       LYS  13  -1.829  11.795   7.391
  100   2HZ   LYS  13          2HZ       LYS  13  -3.057  12.936   7.117
  101   3HZ   LYS  13          3HZ       LYS  13  -1.465  13.262   6.622
  102    H    THR  14           H        THR  14  -6.002   6.184   6.534
  103    HA   THR  14           HA       THR  14  -8.814   6.933   5.793
  104    HB   THR  14           HB       THR  14  -8.783   4.524   4.901
  105    HG1  THR  14           1HG      THR  14  -7.010   3.708   5.889
  106   1HG2  THR  14          1HG2      THR  14  -7.439   5.210   2.883
  107   2HG2  THR  14          2HG2      THR  14  -6.962   6.659   3.769
  108   3HG2  THR  14          3HG2      THR  14  -8.659   6.385   3.375
  109    H    LYS  15           H        LYS  15 -10.342   4.980   6.483
  110    HA   LYS  15           HA       LYS  15 -10.415   4.880   9.347
  111   1HB   LYS  15          1HB       LYS  15 -11.858   3.775   7.008
  112   2HB   LYS  15          2HB       LYS  15 -12.015   2.832   8.490
  113   1HG   LYS  15          1HG       LYS  15 -13.541   4.313   9.224
  114   2HG   LYS  15          2HG       LYS  15 -12.281   5.547   9.244
  115   1HD   LYS  15          1HD       LYS  15 -12.785   5.630   6.641
  116   2HD   LYS  15          2HD       LYS  15 -14.343   4.977   7.149
  117   1HE   LYS  15          1HE       LYS  15 -14.928   6.903   8.303
  118   2HE   LYS  15          2HE       LYS  15 -13.241   7.329   8.651
  119   1HZ   LYS  15          1HZ       LYS  15 -13.683   8.760   6.934
  120   2HZ   LYS  15          2HZ       LYS  15 -14.779   7.705   6.177
  121   3HZ   LYS  15          3HZ       LYS  15 -13.106   7.426   6.059
  122    H    GLN  16           H        GLN  16  -8.876   2.871   6.943
  123    HA   GLN  16           HA       GLN  16  -8.275   0.775   8.987
  124   1HB   GLN  16          1HB       GLN  16  -8.472   0.959   6.010
  125   2HB   GLN  16          2HB       GLN  16  -7.339  -0.218   6.674
  126   1HG   GLN  16          1HG       GLN  16  -9.293  -0.958   8.195
  127   2HG   GLN  16          2HG       GLN  16 -10.324  -0.060   7.080
  128   1HE2  GLN  16          2HE2      GLN  16 -10.610  -0.911   4.921
  129   2HE2  GLN  16          1HE2      GLN  16 -10.056  -2.453   4.478
  130    HA   PRO  17           HA       PRO  17  -4.470   3.372   8.785
  131   1HB   PRO  17          1HB       PRO  17  -3.821   2.993  11.425
  132   2HB   PRO  17          2HB       PRO  17  -4.911   4.277  10.861
  133   1HG   PRO  17          1HG       PRO  17  -5.573   1.614  12.034
  134   2HG   PRO  17          2HG       PRO  17  -6.314   3.194  12.339
  135   1HD   PRO  17          1HD       PRO  17  -7.459   1.362  10.723
  136   2HD   PRO  17          2HD       PRO  17  -7.605   3.111  10.428
  137    H    VAL  18           H        VAL  18  -2.500   2.500   8.290
  138    HA   VAL  18           HA       VAL  18  -1.981  -0.349   9.058
  139    HB   VAL  18           HB       VAL  18  -1.489   1.303   6.576
  140   1HG1  VAL  18          1HG1      VAL  18   0.596   0.140   7.041
  141   2HG1  VAL  18          2HG1      VAL  18  -0.229  -0.674   5.711
  142   3HG1  VAL  18          3HG1      VAL  18  -0.270  -1.368   7.332
  143   1HG2  VAL  18          1HG2      VAL  18  -2.448  -1.138   5.815
  144   2HG2  VAL  18          2HG2      VAL  18  -3.477   0.251   6.165
  145   3HG2  VAL  18          3HG2      VAL  18  -3.197  -0.974   7.403
  146    H    VAL  19           H        VAL  19   0.350  -0.866   9.284
  147    HA   VAL  19           HA       VAL  19   1.922   1.476  10.292
  148    HB   VAL  19           HB       VAL  19   1.972  -1.491  10.931
  149   1HG1  VAL  19          1HG1      VAL  19   3.408  -0.399  12.905
  150   2HG1  VAL  19          2HG1      VAL  19   3.774   0.782  11.648
  151   3HG1  VAL  19          3HG1      VAL  19   4.161  -0.921  11.398
  152   1HG2  VAL  19          1HG2      VAL  19   1.378   0.630  12.943
  153   2HG2  VAL  19          2HG2      VAL  19   0.726  -1.004  12.807
  154   3HG2  VAL  19          3HG2      VAL  19   0.124   0.277  11.753
  155    H    PHE  20           H        PHE  20   3.592   2.049   8.914
  156    HA   PHE  20           HA       PHE  20   4.654  -0.021   7.042
  157   1HB   PHE  20          1HB       PHE  20   3.817   2.129   6.128
  158   2HB   PHE  20          2HB       PHE  20   4.985   2.999   7.121
  159    HD1  PHE  20           HD1      PHE  20   4.967   0.053   4.793
  160    HD2  PHE  20           HD2      PHE  20   6.966   3.634   6.063
  161    HE1  PHE  20           HE1      PHE  20   6.720  -0.311   3.077
  162    HE2  PHE  20           HE2      PHE  20   8.710   3.270   4.345
  163    HZ   PHE  20           HZ       PHE  20   8.591   1.299   2.853
  164    H    ASN  21           H        ASN  21   6.529  -1.002   7.666
  165    HA   ASN  21           HA       ASN  21   8.301   0.355   9.624
  166   1HB   ASN  21          1HB       ASN  21   7.397  -2.312   8.979
  167   2HB   ASN  21          2HB       ASN  21   9.152  -2.246   8.932
  168   1HD2  ASN  21          2HD2      ASN  21   6.569  -0.851  11.041
  169   2HD2  ASN  21          1HD2      ASN  21   7.344  -1.248  12.497
  170    H    HIS  22           H        HIS  22   9.509   1.805   8.292
  171    HA   HIS  22           HA       HIS  22  10.441   1.440   5.687
  172   1HB   HIS  22          1HB       HIS  22  11.455   2.824   8.150
  173   2HB   HIS  22          2HB       HIS  22  12.464   2.816   6.704
  174    HD1  HIS  22           HD1      HIS  22   9.636   4.540   8.230
  175    HD2  HIS  22           HD2      HIS  22  10.983   3.923   4.329
  176    HE1  HIS  22           HE1      HIS  22   8.553   6.330   6.807
  177    H    SER  23           H        SER  23  11.722   0.074   8.695
  178    HA   SER  23           HA       SER  23  14.229  -0.887   7.874
  179   1HB   SER  23          1HB       SER  23  13.878  -1.447  10.057
  180   2HB   SER  23          2HB       SER  23  12.134  -1.541   9.836
  181    HG   SER  23           HG       SER  23  14.116  -3.495   9.385
  182    H    THR  24           H        THR  24  11.011  -2.344   7.369
  183    HA   THR  24           HA       THR  24  12.016  -4.670   5.945
  184    HB   THR  24           HB       THR  24   9.308  -4.076   5.289
  185    HG1  THR  24           1HG      THR  24   8.500  -3.580   7.327
  186   1HG2  THR  24          1HG2      THR  24   9.605  -6.292   5.740
  187   2HG2  THR  24          2HG2      THR  24   9.150  -5.807   7.374
  188   3HG2  THR  24          3HG2      THR  24  10.853  -5.982   6.947
  189    H    HIS  25           H        HIS  25  11.825  -1.419   5.114
  190    HA   HIS  25           HA       HIS  25  11.650  -2.069   2.203
  191   1HB   HIS  25          1HB       HIS  25  10.825   0.395   3.763
  192   2HB   HIS  25          2HB       HIS  25  10.620   0.160   2.031
  193    HD1  HIS  25           HD1      HIS  25   9.336  -1.034   5.349
  194    HD2  HIS  25           HD2      HIS  25   8.563  -1.668   1.304
  195    HE1  HIS  25           HE1      HIS  25   7.192  -2.375   5.232
  196    H    LYS  26           H        LYS  26  13.628  -0.894   4.718
  197    HA   LYS  26           HA       LYS  26  15.146   1.180   3.609
  198   1HB   LYS  26          1HB       LYS  26  16.856   0.428   5.128
  199   2HB   LYS  26          2HB       LYS  26  15.312   0.011   5.874
  200   1HG   LYS  26          1HG       LYS  26  15.497  -2.286   5.050
  201   2HG   LYS  26          2HG       LYS  26  17.000  -1.886   4.218
  202   1HD   LYS  26          1HD       LYS  26  18.122  -1.442   6.312
  203   2HD   LYS  26          2HD       LYS  26  16.610  -1.602   7.208
  204   1HE   LYS  26          1HE       LYS  26  16.466  -3.991   6.421
  205   2HE   LYS  26          2HE       LYS  26  18.086  -3.802   5.722
  206   1HZ   LYS  26          1HZ       LYS  26  18.339  -4.617   7.940
  207   2HZ   LYS  26          2HZ       LYS  26  17.307  -3.421   8.564
  208   3HZ   LYS  26          3HZ       LYS  26  18.825  -2.993   7.933
  209    H    ALA  27           H        ALA  27  14.941  -2.160   2.640
  210    HA   ALA  27           HA       ALA  27  17.365  -2.013   0.944
  211   1HB   ALA  27          1HB       ALA  27  15.351  -4.076   1.799
  212   2HB   ALA  27          2HB       ALA  27  17.106  -4.106   1.966
  213   3HB   ALA  27          3HB       ALA  27  16.366  -4.396   0.391
  214    H    VAL  28           H        VAL  28  14.114  -1.135   0.717
  215    HA   VAL  28           HA       VAL  28  13.688  -1.842  -2.100
  216    HB   VAL  28           HB       VAL  28  12.255  -0.160  -0.033
  217   1HG1  VAL  28          1HG1      VAL  28  10.365  -0.125  -1.683
  218   2HG1  VAL  28          2HG1      VAL  28  11.480  -0.750  -2.898
  219   3HG1  VAL  28          3HG1      VAL  28  11.756   0.837  -2.179
  220   1HG2  VAL  28          1HG2      VAL  28  12.320  -2.725   0.076
  221   2HG2  VAL  28          2HG2      VAL  28  11.351  -2.698  -1.398
  222   3HG2  VAL  28          3HG2      VAL  28  10.722  -1.977   0.084
  223    H    LYS  29           H        LYS  29  12.971   0.172  -3.527
  224    HA   LYS  29           HA       LYS  29  15.290   1.998  -3.521
  225   1HB   LYS  29          1HB       LYS  29  13.431   0.873  -5.408
  226   2HB   LYS  29          2HB       LYS  29  13.447   2.631  -5.552
  227   1HG   LYS  29          1HG       LYS  29  15.273   2.246  -6.864
  228   2HG   LYS  29          2HG       LYS  29  16.099   2.163  -5.306
  229   1HD   LYS  29          1HD       LYS  29  16.419  -0.086  -5.454
  230   2HD   LYS  29          2HD       LYS  29  14.824  -0.361  -6.156
  231   1HE   LYS  29          1HE       LYS  29  15.594  -0.154  -8.316
  232   2HE   LYS  29          2HE       LYS  29  16.806   1.065  -7.873
  233   1HZ   LYS  29          1HZ       LYS  29  18.147  -0.753  -8.128
  234   2HZ   LYS  29          2HZ       LYS  29  16.946  -1.858  -7.656
  235   3HZ   LYS  29          3HZ       LYS  29  17.754  -0.928  -6.487
  236    H    CYS  30           H        CYS  30  15.020   3.591  -2.053
  237    HA   CYS  30           HA       CYS  30  12.710   4.761  -1.012
  238   1HB   CYS  30          1HB       CYS  30  15.457   5.807  -1.691
  239   2HB   CYS  30          2HB       CYS  30  14.257   6.875  -0.967
  240    H    GLY  31           H        GLY  31  14.038   5.042  -4.210
  241   1HA   GLY  31          1HA       GLY  31  12.386   7.380  -4.903
  242   2HA   GLY  31          2HA       GLY  31  13.490   6.532  -5.990
  243    H    ASP  32           H        ASP  32  12.040   3.966  -4.825
  244    HA   ASP  32           HA       ASP  32  10.136   3.792  -7.048
  245   1HB   ASP  32          1HB       ASP  32  11.712   2.050  -5.614
  246   2HB   ASP  32          2HB       ASP  32  10.115   1.720  -4.945
  247    H    CYS  33           H        CYS  33  10.025   4.148  -3.531
  248    HA   CYS  33           HA       CYS  33   7.062   4.101  -3.497
  249   1HB   CYS  33          1HB       CYS  33   9.342   4.203  -1.537
  250   2HB   CYS  33          2HB       CYS  33   7.754   4.745  -0.999
  251    H    HIS  34           H        HIS  34   9.689   6.361  -2.582
  252    HA   HIS  34           HA       HIS  34   7.826   8.665  -2.683
  253   1HB   HIS  34          1HB       HIS  34  10.734   8.230  -1.943
  254   2HB   HIS  34          2HB       HIS  34   9.989   9.825  -1.957
  255    HD1  HIS  34           HD1      HIS  34   7.521   9.755  -0.512
  256    HD2  HIS  34           HD2      HIS  34  10.556   7.102   0.548
  257    HE1  HIS  34           HE1      HIS  34   7.044   9.029   1.867
  258    H    HIS  35           H        HIS  35   8.519   7.165  -5.148
  259    HA   HIS  35           HA       HIS  35  10.410   7.949  -6.883
  260   1HB   HIS  35          1HB       HIS  35   8.580   8.062  -8.605
  261   2HB   HIS  35          2HB       HIS  35   8.452   6.682  -7.528
  262    HD1  HIS  35           HD1      HIS  35   7.030  10.086  -8.078
  263    HD2  HIS  35           HD2      HIS  35   6.130   6.641  -5.940
  264    HE1  HIS  35           HE1      HIS  35   4.717  10.438  -7.128
  265    HA   PRO  36           HA       PRO  36  10.694  12.285  -7.337
  266   1HB   PRO  36          1HB       PRO  36  11.031  12.561 -10.047
  267   2HB   PRO  36          2HB       PRO  36  12.300  11.950  -8.965
  268   1HG   PRO  36          1HG       PRO  36  10.415  10.436 -10.714
  269   2HG   PRO  36          2HG       PRO  36  12.143  10.171 -10.425
  270   1HD   PRO  36          1HD       PRO  36  10.238   8.683  -9.226
  271   2HD   PRO  36          2HD       PRO  36  11.779   9.072  -8.429
  272    H    VAL  37           H        VAL  37   8.958  13.641  -7.128
  273    HA   VAL  37           HA       VAL  37   6.619  13.260  -8.953
  274    HB   VAL  37           HB       VAL  37   7.043  14.177  -6.121
  275   1HG1  VAL  37          1HG1      VAL  37   4.808  14.960  -7.980
  276   2HG1  VAL  37          2HG1      VAL  37   5.652  15.946  -6.786
  277   3HG1  VAL  37          3HG1      VAL  37   4.486  14.731  -6.261
  278   1HG2  VAL  37          1HG2      VAL  37   6.517  11.790  -6.751
  279   2HG2  VAL  37          2HG2      VAL  37   4.966  12.357  -7.371
  280   3HG2  VAL  37          3HG2      VAL  37   5.344  12.522  -5.656
  281    H    ASN  38           H        ASN  38   9.197  14.903  -9.285
  282    HA   ASN  38           HA       ASN  38   8.128  17.101 -10.753
  283   1HB   ASN  38          1HB       ASN  38   7.566  17.612  -8.261
  284   2HB   ASN  38          2HB       ASN  38   9.272  17.945  -8.087
  285   1HD2  ASN  38          2HD2      ASN  38   7.064  19.930  -7.919
  286   2HD2  ASN  38          1HD2      ASN  38   7.376  21.075  -9.133
  287    H    GLY  39           H        GLY  39  10.720  17.517  -8.437
  288   1HA   GLY  39          1HA       GLY  39  12.729  17.036 -10.590
  289   2HA   GLY  39          2HA       GLY  39  12.863  18.413  -9.487
  290    H    LYS  40           H        LYS  40  11.469  16.075  -7.678
  291    HA   LYS  40           HA       LYS  40  13.857  14.472  -7.046
  292   1HB   LYS  40          1HB       LYS  40  13.949  15.447  -4.713
  293   2HB   LYS  40          2HB       LYS  40  14.429  16.574  -5.984
  294   1HG   LYS  40          1HG       LYS  40  12.034  17.410  -6.001
  295   2HG   LYS  40          2HG       LYS  40  11.767  16.448  -4.548
  296   1HD   LYS  40          1HD       LYS  40  13.761  17.660  -3.525
  297   2HD   LYS  40          2HD       LYS  40  13.688  18.757  -4.904
  298   1HE   LYS  40          1HE       LYS  40  11.446  18.244  -2.914
  299   2HE   LYS  40          2HE       LYS  40  12.404  19.731  -3.061
  300   1HZ   LYS  40          1HZ       LYS  40  11.696  19.824  -5.422
  301   2HZ   LYS  40          2HZ       LYS  40  10.411  20.013  -4.327
  302   3HZ   LYS  40          3HZ       LYS  40  10.639  18.531  -5.127
  303    H    GLU  41           H        GLU  41  13.321  12.715  -5.655
  304    HA   GLU  41           HA       GLU  41  10.616  11.780  -5.672
  305   1HB   GLU  41          1HB       GLU  41  13.224  11.080  -4.416
  306   2HB   GLU  41          2HB       GLU  41  11.780  10.307  -3.766
  307   1HG   GLU  41          1HG       GLU  41  11.423   9.081  -5.665
  308   2HG   GLU  41          2HG       GLU  41  12.000  10.367  -6.724
  309    H    ASP  42           H        ASP  42   8.961  12.621  -4.448
  310    HA   ASP  42           HA       ASP  42   9.349  14.361  -2.209
  311   1HB   ASP  42          1HB       ASP  42   7.023  12.653  -3.123
  312   2HB   ASP  42          2HB       ASP  42   6.902  13.892  -1.876
  313    H    TYR  43           H        TYR  43  10.487  13.550  -0.463
  314    HA   TYR  43           HA       TYR  43  10.059  10.772   0.444
  315   1HB   TYR  43          1HB       TYR  43  11.822  13.053   1.399
  316   2HB   TYR  43          2HB       TYR  43  11.900  11.402   2.015
  317    HD1  TYR  43           HD1      TYR  43  12.924  13.660  -0.606
  318    HD2  TYR  43           HD2      TYR  43  12.411   9.509   0.376
  319    HE1  TYR  43           HE1      TYR  43  14.410  13.028  -2.489
  320    HE2  TYR  43           HE2      TYR  43  13.894   8.879  -1.505
  321    HH   TYR  43           HH       TYR  43  15.327  11.365  -3.626
  322    H    GLN  44           H        GLN  44   7.649  11.845   0.827
  323    HA   GLN  44           HA       GLN  44   7.557  12.463   3.757
  324   1HB   GLN  44          1HB       GLN  44   5.684  14.063   3.127
  325   2HB   GLN  44          2HB       GLN  44   7.287  14.549   2.572
  326   1HG   GLN  44          1HG       GLN  44   6.817  13.575   0.354
  327   2HG   GLN  44          2HG       GLN  44   5.211  13.094   0.906
  328   1HE2  GLN  44          2HE2      GLN  44   6.895  16.171   1.650
  329   2HE2  GLN  44          1HE2      GLN  44   5.750  17.164   0.884
  330    H    LYS  45           H        LYS  45   5.230  12.127   4.584
  331    HA   LYS  45           HA       LYS  45   4.339   9.525   4.338
  332   1HB   LYS  45          1HB       LYS  45   3.096  12.156   4.990
  333   2HB   LYS  45          2HB       LYS  45   2.016  10.778   4.795
  334   1HG   LYS  45          1HG       LYS  45   3.768   9.572   6.357
  335   2HG   LYS  45          2HG       LYS  45   4.167  11.220   6.835
  336   1HD   LYS  45          1HD       LYS  45   1.278  10.468   6.729
  337   2HD   LYS  45          2HD       LYS  45   2.242   9.847   8.070
  338   1HE   LYS  45          1HE       LYS  45   1.604  11.888   8.981
  339   2HE   LYS  45          2HE       LYS  45   3.070  12.412   8.128
  340   1HZ   LYS  45          1HZ       LYS  45   1.765  12.962   6.207
  341   2HZ   LYS  45          2HZ       LYS  45   1.097  13.758   7.551
  342   3HZ   LYS  45          3HZ       LYS  45   0.351  12.364   6.929
  343    H    CYS  46           H        CYS  46   3.523   8.359   2.671
  344    HA   CYS  46           HA       CYS  46   3.203   9.074   0.046
  345   1HB   CYS  46          1HB       CYS  46   1.446   7.232   1.691
  346   2HB   CYS  46          2HB       CYS  46   1.612   7.170  -0.060
  347    H    ALA  47           H        ALA  47   0.695   9.400   2.552
  348    HA   ALA  47           HA       ALA  47  -1.069  10.817   0.622
  349   1HB   ALA  47          1HB       ALA  47  -1.330   9.114   2.925
  350   2HB   ALA  47          2HB       ALA  47  -2.577   9.631   1.789
  351   3HB   ALA  47          3HB       ALA  47  -2.204  10.620   3.199
  352    H    THR  48           H        THR  48   0.998  12.468   1.059
  353    HA   THR  48           HA       THR  48   1.140  14.103   3.323
  354    HB   THR  48           HB       THR  48   1.205  15.399   0.642
  355    HG1  THR  48           1HG      THR  48   3.288  14.146   0.416
  356   1HG2  THR  48          1HG2      THR  48   2.205  16.050   3.053
  357   2HG2  THR  48          2HG2      THR  48   2.979  16.538   1.545
  358   3HG2  THR  48          3HG2      THR  48   3.570  15.127   2.425
  359    H    ALA  49           H        ALA  49   0.391  16.662   2.776
  360    HA   ALA  49           HA       ALA  49  -2.476  16.634   3.256
  361   1HB   ALA  49          1HB       ALA  49  -0.263  18.645   3.005
  362   2HB   ALA  49          2HB       ALA  49  -1.325  18.325   4.375
  363   3HB   ALA  49          3HB       ALA  49  -1.932  19.216   2.979
  364    H    GLY  50           H        GLY  50  -0.418  17.217   0.466
  365   1HA   GLY  50          1HA       GLY  50  -2.887  17.550  -1.189
  366   2HA   GLY  50          2HA       GLY  50  -1.467  18.558  -1.469
  367    H    CYS  51           H        CYS  51  -1.856  15.087  -0.813
  368    HA   CYS  51           HA       CYS  51  -0.558  14.492  -3.436
  369   1HB   CYS  51          1HB       CYS  51   0.834  14.661  -1.147
  370   2HB   CYS  51          2HB       CYS  51   0.313  13.005  -0.994
  371    H    HIS  52           H        HIS  52  -0.481  11.741  -1.621
  372    HA   HIS  52           HA       HIS  52  -2.817  10.587  -2.952
  373   1HB   HIS  52          1HB       HIS  52  -0.758   9.635  -0.960
  374   2HB   HIS  52          2HB       HIS  52  -2.050   8.593  -1.517
  375    HD1  HIS  52           HD1      HIS  52  -2.187   8.995  -4.389
  376    HD2  HIS  52           HD2      HIS  52   1.480   9.012  -2.442
  377    HE1  HIS  52           HE1      HIS  52  -0.446   8.425  -6.149
  378    H    ASP  53           H        ASP  53  -3.798  12.655  -1.403
  379    HA   ASP  53           HA       ASP  53  -4.776  11.410   1.129
  380   1HB   ASP  53          1HB       ASP  53  -5.342  13.779   1.673
  381   2HB   ASP  53          2HB       ASP  53  -3.637  13.577   1.269
  382    H    ASN  54           H        ASN  54  -5.878  10.907  -1.717
  383    HA   ASN  54           HA       ASN  54  -8.520  12.196  -1.659
  384   1HB   ASN  54          1HB       ASN  54  -6.840  10.971  -3.538
  385   2HB   ASN  54          2HB       ASN  54  -8.209   9.870  -3.389
  386   1HD2  ASN  54          2HD2      ASN  54  -9.749  10.367  -4.944
  387   2HD2  ASN  54          1HD2      ASN  54 -10.183  11.935  -5.426
  388    H    MET  55           H        MET  55  -9.802  11.484   0.041
  389    HA   MET  55           HA       MET  55  -9.720   8.730   1.006
  390   1HB   MET  55          1HB       MET  55 -11.617  11.041   1.536
  391   2HB   MET  55          2HB       MET  55 -11.458   9.592   2.527
  392   1HG   MET  55          1HG       MET  55  -9.084  11.360   1.946
  393   2HG   MET  55          2HG       MET  55 -10.169  11.692   3.297
  394   1HE   MET  55          1HE       MET  55  -6.688  10.306   4.167
  395   2HE   MET  55          2HE       MET  55  -7.827  10.858   5.393
  396   3HE   MET  55          3HE       MET  55  -7.713  11.715   3.858
  397    H    ASP  56           H        ASP  56 -10.334   8.631  -1.720
  398    HA   ASP  56           HA       ASP  56 -13.269   8.007  -1.739
  399   1HB   ASP  56          1HB       ASP  56 -12.150   9.867  -3.213
  400   2HB   ASP  56          2HB       ASP  56 -11.569   8.507  -4.175
  401    H    LYS  57           H        LYS  57 -10.070   6.764  -2.058
  402    HA   LYS  57           HA       LYS  57  -9.255   4.626  -2.637
  403   1HB   LYS  57          1HB       LYS  57 -12.081   3.801  -1.976
  404   2HB   LYS  57          2HB       LYS  57 -10.604   2.883  -1.707
  405   1HG   LYS  57          1HG       LYS  57 -10.115   4.007   0.211
  406   2HG   LYS  57          2HG       LYS  57 -10.694   5.546  -0.418
  407   1HD   LYS  57          1HD       LYS  57 -12.758   3.458   0.036
  408   2HD   LYS  57          2HD       LYS  57 -12.028   4.158   1.479
  409   1HE   LYS  57          1HE       LYS  57 -12.535   6.447   0.552
  410   2HE   LYS  57          2HE       LYS  57 -13.432   5.655  -0.758
  411   1HZ   LYS  57          1HZ       LYS  57 -14.785   4.520   0.871
  412   2HZ   LYS  57          2HZ       LYS  57 -14.873   6.196   1.137
  413   3HZ   LYS  57          3HZ       LYS  57 -13.912   5.222   2.144
  414    H    LYS  58           H        LYS  58 -11.012   6.282  -4.657
  415    HA   LYS  58           HA       LYS  58 -11.171   4.084  -6.667
  416   1HB   LYS  58          1HB       LYS  58 -13.340   6.107  -6.018
  417   2HB   LYS  58          2HB       LYS  58 -13.416   4.915  -7.315
  418   1HG   LYS  58          1HG       LYS  58 -13.351   3.089  -5.727
  419   2HG   LYS  58          2HG       LYS  58 -13.057   4.204  -4.392
  420   1HD   LYS  58          1HD       LYS  58 -15.247   5.202  -4.658
  421   2HD   LYS  58          2HD       LYS  58 -15.539   4.272  -6.128
  422   1HE   LYS  58          1HE       LYS  58 -14.854   2.364  -4.161
  423   2HE   LYS  58          2HE       LYS  58 -15.995   3.479  -3.384
  424   1HZ   LYS  58          1HZ       LYS  58 -17.174   3.313  -5.691
  425   2HZ   LYS  58          2HZ       LYS  58 -17.439   2.123  -4.508
  426   3HZ   LYS  58          3HZ       LYS  58 -16.359   1.828  -5.786
  427    H    ASP  59           H        ASP  59  -9.878   6.992  -5.885
  428    HA   ASP  59           HA       ASP  59 -10.335   8.741  -8.057
  429   1HB   ASP  59          1HB       ASP  59  -8.971   8.953  -5.852
  430   2HB   ASP  59          2HB       ASP  59  -7.636   8.280  -6.787
  431    H    LYS  60           H        LYS  60  -8.710   5.682  -7.998
  432    HA   LYS  60           HA       LYS  60  -7.308   4.610  -9.594
  433   1HB   LYS  60          1HB       LYS  60  -9.741   5.814 -10.808
  434   2HB   LYS  60          2HB       LYS  60  -8.530   5.197 -11.934
  435   1HG   LYS  60          1HG       LYS  60 -10.263   3.495 -11.229
  436   2HG   LYS  60          2HG       LYS  60  -8.596   3.012 -10.920
  437   1HD   LYS  60          1HD       LYS  60  -8.898   3.977  -8.573
  438   2HD   LYS  60          2HD       LYS  60 -10.624   4.050  -8.933
  439   1HE   LYS  60          1HE       LYS  60  -9.028   1.497  -9.281
  440   2HE   LYS  60          2HE       LYS  60  -9.829   1.915  -7.752
  441   1HZ   LYS  60          1HZ       LYS  60 -11.016   1.343 -10.374
  442   2HZ   LYS  60          2HZ       LYS  60 -11.799   2.462  -9.364
  443   3HZ   LYS  60          3HZ       LYS  60 -11.538   0.870  -8.831
  444    H    SER  61           H        SER  61  -6.539   7.456  -8.904
  445    HA   SER  61           HA       SER  61  -5.046   8.056 -11.434
  446   1HB   SER  61          1HB       SER  61  -6.978   9.590  -9.967
  447   2HB   SER  61          2HB       SER  61  -5.419  10.401  -9.844
  448    HG   SER  61           HG       SER  61  -7.060  10.441 -11.869
  449    H    ALA  62           H        ALA  62  -3.250   9.861 -10.613
  450    HA   ALA  62           HA       ALA  62  -1.584   8.363  -8.698
  451   1HB   ALA  62          1HB       ALA  62  -0.045   9.194 -10.124
  452   2HB   ALA  62          2HB       ALA  62  -0.403  10.815  -9.527
  453   3HB   ALA  62          3HB       ALA  62  -1.282  10.171 -10.915
  454    H    LYS  63           H        LYS  63  -4.067   9.988  -7.872
  455    HA   LYS  63           HA       LYS  63  -2.682  11.636  -5.783
  456   1HB   LYS  63          1HB       LYS  63  -4.092  12.627  -7.887
  457   2HB   LYS  63          2HB       LYS  63  -5.392  12.422  -6.711
  458   1HG   LYS  63          1HG       LYS  63  -4.566  14.610  -6.310
  459   2HG   LYS  63          2HG       LYS  63  -3.836  13.621  -5.045
  460   1HD   LYS  63          1HD       LYS  63  -1.990  14.810  -5.845
  461   2HD   LYS  63          2HD       LYS  63  -1.891  13.316  -6.778
  462   1HE   LYS  63          1HE       LYS  63  -1.695  14.908  -8.482
  463   2HE   LYS  63          2HE       LYS  63  -3.455  14.673  -8.464
  464   1HZ   LYS  63          1HZ       LYS  63  -3.635  16.483  -6.861
  465   2HZ   LYS  63          2HZ       LYS  63  -2.912  17.023  -8.299
  466   3HZ   LYS  63          3HZ       LYS  63  -1.958  16.730  -6.924
  467    H    GLY  64           H        GLY  64  -4.586   8.977  -6.366
  468   1HA   GLY  64          1HA       GLY  64  -6.418   9.320  -4.098
  469   2HA   GLY  64          2HA       GLY  64  -6.309   7.899  -5.132
  470    H    TYR  65           H        TYR  65  -6.241   8.183  -2.155
  471    HA   TYR  65           HA       TYR  65  -3.525   7.502  -1.325
  472   1HB   TYR  65          1HB       TYR  65  -5.306   8.688   0.029
  473   2HB   TYR  65          2HB       TYR  65  -6.162   7.148   0.125
  474    HD1  TYR  65           HD1      TYR  65  -5.913   6.279   2.280
  475    HD2  TYR  65           HD2      TYR  65  -2.516   7.999   0.296
  476    HE1  TYR  65           HE1      TYR  65  -4.455   5.559   4.153
  477    HE2  TYR  65           HE2      TYR  65  -1.059   7.282   2.171
  478    HH   TYR  65           HH       TYR  65  -0.943   6.153   4.075
  479    H    TYR  66           H        TYR  66  -6.609   5.680  -1.415
  480    HA   TYR  66           HA       TYR  66  -5.379   3.150  -0.798
  481   1HB   TYR  66          1HB       TYR  66  -7.605   3.206  -0.247
  482   2HB   TYR  66          2HB       TYR  66  -8.006   4.295  -1.568
  483    HD1  TYR  66           HD1      TYR  66  -7.670   3.211  -3.994
  484    HD2  TYR  66           HD2      TYR  66  -8.373   1.027  -0.367
  485    HE1  TYR  66           HE1      TYR  66  -8.517   1.286  -5.319
  486    HE2  TYR  66           HE2      TYR  66  -9.211  -0.900  -1.685
  487    HH   TYR  66           HH       TYR  66  -8.629  -1.465  -4.688
  488    H    HIS  67           H        HIS  67  -5.949   4.903  -3.793
  489    HA   HIS  67           HA       HIS  67  -5.809   2.740  -5.661
  490   1HB   HIS  67          1HB       HIS  67  -6.510   4.886  -6.406
  491   2HB   HIS  67          2HB       HIS  67  -5.097   5.676  -5.703
  492    HD1  HIS  67           HD1      HIS  67  -5.920   3.148  -8.425
  493    HD2  HIS  67           HD2      HIS  67  -2.983   5.954  -7.487
  494    HE1  HIS  67           HE1      HIS  67  -4.291   3.153 -10.361
  495    H    ALA  68           H        ALA  68  -3.172   5.069  -5.057
  496    HA   ALA  68           HA       ALA  68  -1.077   3.630  -6.206
  497   1HB   ALA  68          1HB       ALA  68   0.075   4.904  -4.046
  498   2HB   ALA  68          2HB       ALA  68  -1.463   5.753  -4.203
  499   3HB   ALA  68          3HB       ALA  68  -0.348   5.688  -5.568
  500    H    MET  69           H        MET  69  -2.784   2.831  -3.283
  501    HA   MET  69           HA       MET  69  -0.565   1.191  -2.226
  502   1HB   MET  69          1HB       MET  69  -3.394   1.740  -1.311
  503   2HB   MET  69          2HB       MET  69  -2.192   0.855  -0.378
  504   1HG   MET  69          1HG       MET  69  -1.130   3.380  -1.345
  505   2HG   MET  69          2HG       MET  69  -2.575   3.622  -0.367
  506   1HE   MET  69          1HE       MET  69   1.472   3.391   0.811
  507   2HE   MET  69          2HE       MET  69   0.365   4.714   1.167
  508   3HE   MET  69          3HE       MET  69   0.494   4.102  -0.481
  509    H    HIS  70           H        HIS  70  -3.876   0.643  -3.494
  510    HA   HIS  70           HA       HIS  70  -3.357  -2.277  -3.410
  511   1HB   HIS  70          1HB       HIS  70  -5.835  -0.732  -4.208
  512   2HB   HIS  70          2HB       HIS  70  -5.751  -2.428  -3.729
  513    HD1  HIS  70           HD1      HIS  70  -6.007   0.992  -2.374
  514    HD2  HIS  70           HD2      HIS  70  -5.109  -2.801  -0.904
  515    HE1  HIS  70           HE1      HIS  70  -6.172   1.147   0.146
  516    H    ASP  71           H        ASP  71  -3.400   0.352  -5.654
  517    HA   ASP  71           HA       ASP  71  -4.004  -1.262  -8.016
  518   1HB   ASP  71          1HB       ASP  71  -3.002   1.540  -7.475
  519   2HB   ASP  71          2HB       ASP  71  -3.310   0.936  -9.096
  520    H    LYS  72           H        LYS  72  -2.518  -2.649  -8.864
  521    HA   LYS  72           HA       LYS  72   0.331  -2.452  -8.229
  522   1HB   LYS  72          1HB       LYS  72  -1.206  -4.220 -10.157
  523   2HB   LYS  72          2HB       LYS  72   0.419  -4.524  -9.544
  524   1HG   LYS  72          1HG       LYS  72  -0.499  -5.608  -7.800
  525   2HG   LYS  72          2HG       LYS  72  -1.191  -4.074  -7.270
  526   1HD   LYS  72          1HD       LYS  72  -3.055  -5.526  -7.494
  527   2HD   LYS  72          2HD       LYS  72  -3.079  -4.535  -8.954
  528   1HE   LYS  72          1HE       LYS  72  -2.261  -6.288 -10.307
  529   2HE   LYS  72          2HE       LYS  72  -1.635  -7.191  -8.914
  530   1HZ   LYS  72          1HZ       LYS  72  -3.905  -7.866  -9.929
  531   2HZ   LYS  72          2HZ       LYS  72  -4.500  -6.526  -9.068
  532   3HZ   LYS  72          3HZ       LYS  72  -3.739  -7.801  -8.242
  533    H    GLY  73           H        GLY  73  -1.605  -2.241 -11.225
  534   1HA   GLY  73          1HA       GLY  73   0.620  -1.475 -12.888
  535   2HA   GLY  73          2HA       GLY  73  -1.083  -1.280 -13.309
  536    H    THR  74           H        THR  74   1.134   0.108 -10.868
  537    HA   THR  74           HA       THR  74  -0.084   2.787 -11.408
  538    HB   THR  74           HB       THR  74   1.083   3.195  -9.129
  539    HG1  THR  74           1HG      THR  74   0.958   0.423  -8.861
  540   1HG2  THR  74          1HG2      THR  74  -1.284   2.985  -9.137
  541   2HG2  THR  74          2HG2      THR  74  -0.725   1.815  -7.939
  542   3HG2  THR  74          3HG2      THR  74  -1.205   1.271  -9.548
  543    H    LYS  75           H        LYS  75   1.402   4.635 -11.496
  544    HA   LYS  75           HA       LYS  75   3.520   4.616 -13.233
  545   1HB   LYS  75          1HB       LYS  75   2.378   6.495 -11.789
  546   2HB   LYS  75          2HB       LYS  75   3.690   6.183 -10.657
  547   1HG   LYS  75          1HG       LYS  75   4.129   8.031 -12.348
  548   2HG   LYS  75          2HG       LYS  75   5.351   6.764 -12.282
  549   1HD   LYS  75          1HD       LYS  75   3.183   6.141 -14.149
  550   2HD   LYS  75          2HD       LYS  75   4.042   7.622 -14.572
  551   1HE   LYS  75          1HE       LYS  75   5.823   5.417 -13.749
  552   2HE   LYS  75          2HE       LYS  75   4.917   5.104 -15.242
  553   1HZ   LYS  75          1HZ       LYS  75   6.242   7.700 -14.725
  554   2HZ   LYS  75          2HZ       LYS  75   5.679   7.082 -16.204
  555   3HZ   LYS  75          3HZ       LYS  75   7.062   6.418 -15.475
  556    H    PHE  76           H        PHE  76   3.706   3.907  -9.750
  557    HA   PHE  76           HA       PHE  76   6.423   2.704 -10.200
  558   1HB   PHE  76          1HB       PHE  76   5.329   4.104  -7.743
  559   2HB   PHE  76          2HB       PHE  76   6.968   3.505  -7.959
  560    HD1  PHE  76           HD1      PHE  76   8.446   4.560  -9.714
  561    HD2  PHE  76           HD2      PHE  76   4.603   6.160  -8.661
  562    HE1  PHE  76           HE1      PHE  76   9.036   6.706 -10.810
  563    HE2  PHE  76           HE2      PHE  76   5.192   8.303  -9.752
  564    HZ   PHE  76           HZ       PHE  76   7.404   8.570 -10.825
  565    H    LYS  77           H        LYS  77   6.896   1.102  -8.259
  566    HA   LYS  77           HA       LYS  77   4.721  -0.827  -8.213
  567   1HB   LYS  77          1HB       LYS  77   6.283  -2.088  -6.808
  568   2HB   LYS  77          2HB       LYS  77   7.115  -1.439  -8.220
  569   1HG   LYS  77          1HG       LYS  77   7.608   0.596  -6.633
  570   2HG   LYS  77          2HG       LYS  77   7.288  -0.576  -5.355
  571   1HD   LYS  77          1HD       LYS  77   9.397  -0.727  -7.522
  572   2HD   LYS  77          2HD       LYS  77   9.648  -0.684  -5.777
  573   1HE   LYS  77          1HE       LYS  77   9.467  -2.938  -5.648
  574   2HE   LYS  77          2HE       LYS  77   7.915  -2.905  -6.510
  575   1HZ   LYS  77          1HZ       LYS  77  10.023  -3.963  -7.619
  576   2HZ   LYS  77          2HZ       LYS  77  10.371  -2.347  -8.013
  577   3HZ   LYS  77          3HZ       LYS  77   8.922  -3.060  -8.540
  578    H    SER  78           H        SER  78   3.025  -0.496  -6.992
  579    HA   SER  78           HA       SER  78   2.934   1.325  -4.729
  580   1HB   SER  78          1HB       SER  78   0.545   0.153  -4.729
  581   2HB   SER  78          2HB       SER  78   0.994   1.302  -5.987
  582    HG   SER  78           HG       SER  78   0.282  -1.196  -6.294
  583    H    CYS  79           H        CYS  79   1.647   0.447  -2.717
  584    HA   CYS  79           HA       CYS  79   3.262  -1.354  -1.241
  585   1HB   CYS  79          1HB       CYS  79   0.313  -0.722  -0.912
  586   2HB   CYS  79          2HB       CYS  79   1.422  -1.222   0.361
  587    H    VAL  80           H        VAL  80  -0.081  -1.995  -2.333
  588    HA   VAL  80           HA       VAL  80   0.140  -4.863  -2.070
  589    HB   VAL  80           HB       VAL  80  -1.724  -2.930  -3.454
  590   1HG1  VAL  80          1HG1      VAL  80  -1.434  -5.761  -3.954
  591   2HG1  VAL  80          2HG1      VAL  80  -2.520  -4.602  -4.723
  592   3HG1  VAL  80          3HG1      VAL  80  -3.010  -5.422  -3.238
  593   1HG2  VAL  80          1HG2      VAL  80  -2.841  -4.702  -1.435
  594   2HG2  VAL  80          2HG2      VAL  80  -2.805  -2.940  -1.463
  595   3HG2  VAL  80          3HG2      VAL  80  -1.440  -3.838  -0.802
  596    H    GLY  81           H        GLY  81   0.746  -2.570  -4.683
  597   1HA   GLY  81          1HA       GLY  81   0.897  -4.497  -6.819
  598   2HA   GLY  81          2HA       GLY  81   1.599  -2.878  -6.851
  599    H    CYS  82           H        CYS  82   3.306  -3.102  -4.603
  600    HA   CYS  82           HA       CYS  82   5.524  -4.626  -5.781
  601   1HB   CYS  82          1HB       CYS  82   5.529  -2.343  -4.535
  602   2HB   CYS  82          2HB       CYS  82   5.417  -3.303  -3.062
  603    H    HIS  83           H        HIS  83   3.102  -5.011  -3.349
  604    HA   HIS  83           HA       HIS  83   4.394  -7.103  -1.814
  605   1HB   HIS  83          1HB       HIS  83   1.727  -5.777  -2.077
  606   2HB   HIS  83          2HB       HIS  83   1.796  -7.301  -1.211
  607    HD1  HIS  83           HD1      HIS  83   1.344  -5.994   1.054
  608    HD2  HIS  83           HD2      HIS  83   4.893  -4.963  -0.873
  609    HE1  HIS  83           HE1      HIS  83   2.736  -4.738   2.749
  610    H    LEU  84           H        LEU  84   1.657  -7.169  -4.168
  611    HA   LEU  84           HA       LEU  84   1.354  -9.953  -4.381
  612   1HB   LEU  84          1HB       LEU  84   0.486  -7.574  -5.600
  613   2HB   LEU  84          2HB       LEU  84   1.144  -8.545  -6.912
  614    HG   LEU  84           HG       LEU  84  -0.673  -9.799  -4.884
  615   1HD1  LEU  84          1HD1      LEU  84  -1.578  -8.343  -7.386
  616   2HD1  LEU  84          2HD1      LEU  84  -1.802  -7.745  -5.742
  617   3HD1  LEU  84          3HD1      LEU  84  -2.609  -9.225  -6.260
  618   1HD2  LEU  84          1HD2      LEU  84  -0.626 -11.550  -6.325
  619   2HD2  LEU  84          2HD2      LEU  84   0.731 -10.728  -7.094
  620   3HD2  LEU  84          3HD2      LEU  84  -0.902 -10.506  -7.720
  621    H    GLU  85           H        GLU  85   3.767  -7.802  -5.807
  622    HA   GLU  85           HA       GLU  85   4.906  -9.899  -7.528
  623   1HB   GLU  85          1HB       GLU  85   5.486  -7.022  -6.833
  624   2HB   GLU  85          2HB       GLU  85   6.648  -7.966  -7.767
  625   1HG   GLU  85          1HG       GLU  85   4.035  -8.419  -8.851
  626   2HG   GLU  85          2HG       GLU  85   4.287  -6.678  -8.707
  627    H    THR  86           H        THR  86   6.039  -8.001  -4.697
  628    HA   THR  86           HA       THR  86   8.483  -9.351  -4.258
  629    HB   THR  86           HB       THR  86   6.470  -7.886  -2.565
  630    HG1  THR  86           1HG      THR  86   7.828  -6.640  -3.773
  631   1HG2  THR  86          1HG2      THR  86   9.050  -9.075  -1.511
  632   2HG2  THR  86          2HG2      THR  86   7.443  -9.703  -1.146
  633   3HG2  THR  86          3HG2      THR  86   7.901  -8.087  -0.608
  634    H    ALA  87           H        ALA  87   5.234 -10.455  -3.862
  635    HA   ALA  87           HA       ALA  87   5.928 -12.615  -1.974
  636   1HB   ALA  87          1HB       ALA  87   3.516 -11.420  -3.255
  637   2HB   ALA  87          2HB       ALA  87   3.769 -11.903  -1.577
  638   3HB   ALA  87          3HB       ALA  87   3.401 -13.120  -2.799
  639    H    GLY  88           H        GLY  88   5.196 -12.190  -5.408
  640   1HA   GLY  88          1HA       GLY  88   5.477 -13.640  -7.230
  641   2HA   GLY  88          2HA       GLY  88   6.687 -14.462  -6.244
  642    H    ALA  89           H        ALA  89   6.114 -16.594  -6.578
  643    HA   ALA  89           HA       ALA  89   3.292 -17.439  -6.415
  644   1HB   ALA  89          1HB       ALA  89   5.302 -18.249  -7.922
  645   2HB   ALA  89          2HB       ALA  89   4.111 -19.414  -7.343
  646   3HB   ALA  89          3HB       ALA  89   5.667 -19.262  -6.527
  647    H    ASP  90           H        ASP  90   4.053 -16.323  -3.981
  648    HA   ASP  90           HA       ASP  90   4.433 -18.711  -2.219
  649   1HB   ASP  90          1HB       ASP  90   6.279 -17.113  -2.161
  650   2HB   ASP  90          2HB       ASP  90   5.161 -15.788  -1.857
  651    H    ALA  91           H        ALA  91   2.074 -18.944  -2.440
  652    HA   ALA  91           HA       ALA  91  -0.008 -17.244  -1.933
  653   1HB   ALA  91          1HB       ALA  91  -1.155 -19.178  -1.008
  654   2HB   ALA  91          2HB       ALA  91   0.380 -19.917  -0.550
  655   3HB   ALA  91          3HB       ALA  91  -0.043 -19.745  -2.254
  656    H    ALA  92           H        ALA  92   2.448 -18.185   0.384
  657    HA   ALA  92           HA       ALA  92   1.028 -17.192   2.736
  658   1HB   ALA  92          1HB       ALA  92   3.234 -18.795   2.172
  659   2HB   ALA  92          2HB       ALA  92   2.770 -18.230   3.776
  660   3HB   ALA  92          3HB       ALA  92   3.957 -17.330   2.832
  661    H    LYS  93           H        LYS  93   3.508 -16.021   0.510
  662    HA   LYS  93           HA       LYS  93   3.901 -13.472   1.848
  663   1HB   LYS  93          1HB       LYS  93   4.726 -14.936  -0.587
  664   2HB   LYS  93          2HB       LYS  93   4.789 -13.184  -0.716
  665   1HG   LYS  93          1HG       LYS  93   6.091 -13.159   1.446
  666   2HG   LYS  93          2HG       LYS  93   6.154 -14.920   1.354
  667   1HD   LYS  93          1HD       LYS  93   7.217 -14.700  -0.912
  668   2HD   LYS  93          2HD       LYS  93   7.289 -12.955  -0.657
  669   1HE   LYS  93          1HE       LYS  93   9.288 -13.308   0.366
  670   2HE   LYS  93          2HE       LYS  93   8.378 -14.066   1.688
  671   1HZ   LYS  93          1HZ       LYS  93  10.070 -15.541   0.608
  672   2HZ   LYS  93          2HZ       LYS  93   9.126 -15.493  -0.804
  673   3HZ   LYS  93          3HZ       LYS  93   8.493 -16.164   0.623
  674    H    LYS  94           H        LYS  94   1.669 -14.782  -0.494
  675    HA   LYS  94           HA       LYS  94   0.794 -12.211  -1.575
  676   1HB   LYS  94          1HB       LYS  94   0.305 -15.065  -1.900
  677   2HB   LYS  94          2HB       LYS  94  -1.202 -14.149  -1.947
  678   1HG   LYS  94          1HG       LYS  94   0.364 -12.555  -3.488
  679   2HG   LYS  94          2HG       LYS  94   1.082 -14.128  -3.839
  680   1HD   LYS  94          1HD       LYS  94  -1.562 -14.754  -3.986
  681   2HD   LYS  94          2HD       LYS  94  -1.597 -13.080  -4.540
  682   1HE   LYS  94          1HE       LYS  94  -0.497 -13.574  -6.486
  683   2HE   LYS  94          2HE       LYS  94   0.577 -14.743  -5.692
  684   1HZ   LYS  94          1HZ       LYS  94  -2.272 -15.135  -6.430
  685   2HZ   LYS  94          2HZ       LYS  94  -1.406 -16.202  -5.431
  686   3HZ   LYS  94          3HZ       LYS  94  -0.931 -15.971  -7.046
  687    H    LYS  95           H        LYS  95  -0.035 -14.219   1.172
  688    HA   LYS  95           HA       LYS  95  -2.546 -12.764   1.723
  689   1HB   LYS  95          1HB       LYS  95  -2.832 -14.437   3.377
  690   2HB   LYS  95          2HB       LYS  95  -1.959 -15.272   2.093
  691   1HG   LYS  95          1HG       LYS  95  -0.461 -15.838   3.690
  692   2HG   LYS  95          2HG       LYS  95   0.079 -14.161   3.602
  693   1HD   LYS  95          1HD       LYS  95  -1.805 -13.657   5.292
  694   2HD   LYS  95          2HD       LYS  95  -1.858 -15.401   5.556
  695   1HE   LYS  95          1HE       LYS  95   0.624 -15.330   6.038
  696   2HE   LYS  95          2HE       LYS  95   0.516 -13.558   5.990
  697   1HZ   LYS  95          1HZ       LYS  95  -0.663 -15.439   7.904
  698   2HZ   LYS  95          2HZ       LYS  95  -1.542 -14.035   7.529
  699   3HZ   LYS  95          3HZ       LYS  95   0.025 -13.913   8.177
  700    H    GLU  96           H        GLU  96   0.813 -12.603   2.527
  701    HA   GLU  96           HA       GLU  96   0.365 -10.931   4.939
  702   1HB   GLU  96          1HB       GLU  96   2.762 -11.230   5.188
  703   2HB   GLU  96          2HB       GLU  96   2.076 -12.778   4.732
  704   1HG   GLU  96          1HG       GLU  96   2.732 -12.432   2.429
  705   2HG   GLU  96          2HG       GLU  96   3.328 -10.816   2.815
  706    H    LEU  97           H        LEU  97   1.845 -10.745   1.733
  707    HA   LEU  97           HA       LEU  97   2.454  -7.896   1.921
  708   1HB   LEU  97          1HB       LEU  97   2.361  -9.816  -0.416
  709   2HB   LEU  97          2HB       LEU  97   3.190  -8.259  -0.385
  710    HG   LEU  97           HG       LEU  97   3.856 -10.758   1.166
  711   1HD1  LEU  97          1HD1      LEU  97   5.255  -8.935  -0.776
  712   2HD1  LEU  97          2HD1      LEU  97   4.985 -10.673  -0.901
  713   3HD1  LEU  97          3HD1      LEU  97   6.156 -10.045   0.258
  714   1HD2  LEU  97          1HD2      LEU  97   4.816  -7.923   1.674
  715   2HD2  LEU  97          2HD2      LEU  97   5.516  -9.369   2.403
  716   3HD2  LEU  97          3HD2      LEU  97   3.856  -8.907   2.778
  717    H    THR  98           H        THR  98   0.347  -9.666  -0.367
  718    HA   THR  98           HA       THR  98  -1.202  -7.190  -0.816
  719    HB   THR  98           HB       THR  98  -2.294  -8.676  -2.538
  720    HG1  THR  98           1HG      THR  98  -1.549 -10.722  -2.759
  721   1HG2  THR  98          1HG2      THR  98   0.137  -7.428  -2.570
  722   2HG2  THR  98          2HG2      THR  98  -0.596  -8.199  -3.975
  723   3HG2  THR  98          3HG2      THR  98   0.592  -9.074  -3.007
  724    H    GLY  99           H        GLY  99  -1.479 -10.113   1.025
  725   1HA   GLY  99          1HA       GLY  99  -4.224 -10.546   1.173
  726   2HA   GLY  99          2HA       GLY  99  -3.154 -10.715   2.567
  727    H    CYS 100           H        CYS 100  -5.894  -9.238   1.719
  728    HA   CYS 100           HA       CYS 100  -5.374  -6.547   2.731
  729   1HB   CYS 100          1HB       CYS 100  -8.130  -7.546   2.765
  730   2HB   CYS 100          2HB       CYS 100  -7.480  -6.137   1.973
  731    H    LYS 101           H        LYS 101  -7.556  -9.103   3.901
  732    HA   LYS 101           HA       LYS 101  -7.187  -8.030   6.647
  733   1HB   LYS 101          1HB       LYS 101  -9.109 -10.151   5.650
  734   2HB   LYS 101          2HB       LYS 101  -9.256  -9.170   7.109
  735   1HG   LYS 101          1HG       LYS 101  -9.317  -7.129   5.592
  736   2HG   LYS 101          2HG       LYS 101  -9.482  -8.245   4.236
  737   1HD   LYS 101          1HD       LYS 101 -11.399  -9.232   5.873
  738   2HD   LYS 101          2HD       LYS 101 -11.444  -7.534   6.348
  739   1HE   LYS 101          1HE       LYS 101 -11.348  -7.259   3.641
  740   2HE   LYS 101          2HE       LYS 101 -12.241  -8.787   3.780
  741   1HZ   LYS 101          1HZ       LYS 101 -12.857  -6.279   5.254
  742   2HZ   LYS 101          2HZ       LYS 101 -13.692  -7.750   5.415
  743   3HZ   LYS 101          3HZ       LYS 101 -13.745  -6.897   3.947
  744    H    GLY 102           H        GLY 102  -5.512  -9.003   7.737
  745   1HA   GLY 102          1HA       GLY 102  -4.864 -11.044   8.982
  746   2HA   GLY 102          2HA       GLY 102  -5.297 -11.979   7.550
  747    H    SER 103           H        SER 103  -3.880  -9.337   6.285
  748    HA   SER 103           HA       SER 103  -1.358 -10.745   5.777
  749   1HB   SER 103          1HB       SER 103  -1.015  -8.830   4.265
  750   2HB   SER 103          2HB       SER 103  -2.627  -9.496   4.059
  751    HG   SER 103           HG       SER 103  -2.113  -7.045   4.501
  752    H    LYS 104           H        LYS 104   0.214  -8.314   5.547
  753    HA   LYS 104           HA       LYS 104   0.941  -7.934   8.419
  754   1HB   LYS 104          1HB       LYS 104   2.311  -7.493   5.749
  755   2HB   LYS 104          2HB       LYS 104   3.047  -7.086   7.297
  756   1HG   LYS 104          1HG       LYS 104   1.987  -9.782   7.360
  757   2HG   LYS 104          2HG       LYS 104   3.111  -9.589   6.015
  758   1HD   LYS 104          1HD       LYS 104   4.890  -8.960   7.431
  759   2HD   LYS 104          2HD       LYS 104   3.805  -8.578   8.769
  760   1HE   LYS 104          1HE       LYS 104   3.577 -11.369   7.863
  761   2HE   LYS 104          2HE       LYS 104   5.178 -10.958   8.512
  762   1HZ   LYS 104          1HZ       LYS 104   3.464 -11.601  10.217
  763   2HZ   LYS 104          2HZ       LYS 104   2.648 -10.160   9.838
  764   3HZ   LYS 104          3HZ       LYS 104   4.222 -10.107  10.478
  765    H    CYS 105           H        CYS 105  -0.129  -6.385   5.521
  766    HA   CYS 105           HA       CYS 105   0.366  -3.645   6.360
  767   1HB   CYS 105          1HB       CYS 105  -0.095  -5.090   4.045
  768   2HB   CYS 105          2HB       CYS 105  -1.592  -4.216   4.263
  769    H    HIS 106           H        HIS 106  -2.281  -5.940   6.656
  770    HA   HIS 106           HA       HIS 106  -3.981  -3.766   7.846
  771   1HB   HIS 106          1HB       HIS 106  -4.484  -6.063   6.009
  772   2HB   HIS 106          2HB       HIS 106  -5.770  -5.634   7.138
  773    HD1  HIS 106           HD1      HIS 106  -5.176  -2.538   7.135
  774    HD2  HIS 106           HD2      HIS 106  -5.685  -4.888   3.709
  775    HE1  HIS 106           HE1      HIS 106  -5.757  -0.944   5.261
  776    H    SER 107           H        SER 107  -2.380  -4.709   9.709
  777    HA   SER 107           HA       SER 107  -2.977  -7.243  10.903
  778   1HB   SER 107          1HB       SER 107  -0.979  -5.904  11.382
  779   2HB   SER 107          2HB       SER 107  -1.977  -4.618  12.054
  780    HG   SER 107           HG       SER 107  -1.199  -5.916  13.717
  781    HHA  HEC 201           HHA      HEC 201   5.959   8.685   5.718
  782    HHB  HEC 201           HHB      HEC 201  12.083   9.791   4.856
  783    HHC  HEC 201           HHC      HEC 201  12.520   4.733   1.100
  784    HHD  HEC 201           HHD      HEC 201   6.398   3.670   1.834
  785   1HMA  HEC 201          1HMA      HEC 201  11.327  10.559   7.054
  786   2HMA  HEC 201          2HMA      HEC 201   9.827  10.760   7.963
  787   3HMA  HEC 201          3HMA      HEC 201  10.243  11.900   6.682
  788   1HAA  HEC 201          1HAA      HEC 201   6.440   9.895   7.195
  789   2HAA  HEC 201          2HAA      HEC 201   7.780  10.803   7.897
  790   1HBA  HEC 201          1HBA      HEC 201   6.778  11.633   5.211
  791   2HBA  HEC 201          2HBA      HEC 201   5.802  12.042   6.622
  792   1HMB  HEC 201          1HMB      HEC 201  14.033   9.575   4.484
  793   2HMB  HEC 201          2HMB      HEC 201  14.929   9.189   3.015
  794   3HMB  HEC 201          3HMB      HEC 201  15.118   8.185   4.451
  795    HAB  HEC 201           HAB      HEC 201  14.370   5.518   1.223
  796   1HBB  HEC 201          1HBB      HEC 201  15.571   6.281   3.859
  797   2HBB  HEC 201          2HBB      HEC 201  16.656   5.884   2.527
  798   3HBB  HEC 201          3HBB      HEC 201  15.479   4.697   3.088
  799   1HMC  HEC 201          1HMC      HEC 201  10.648   1.995  -0.636
  800   2HMC  HEC 201          2HMC      HEC 201  11.901   3.214  -0.412
  801   3HMC  HEC 201          3HMC      HEC 201  11.718   1.911   0.762
  802    HAC  HEC 201           HAC      HEC 201   7.032   2.304   0.653
  803   1HBC  HEC 201          1HBC      HEC 201   9.597   0.779   0.612
  804   2HBC  HEC 201          2HBC      HEC 201   8.269   0.202  -0.395
  805   3HBC  HEC 201          3HBC      HEC 201   8.052   0.355   1.348
  806   1HMD  HEC 201          1HMD      HEC 201   3.362   4.663   2.920
  807   2HMD  HEC 201          2HMD      HEC 201   3.785   4.090   4.535
  808   3HMD  HEC 201          3HMD      HEC 201   4.596   3.420   3.120
  809   1HAD  HEC 201          1HAD      HEC 201   4.237   7.983   5.624
  810   2HAD  HEC 201          2HAD      HEC 201   3.229   7.482   4.271
  811   1HBD  HEC 201          1HBD      HEC 201   2.678   5.417   5.319
  812   2HBD  HEC 201          2HBD      HEC 201   3.961   5.601   6.514
  813    HHA  HEC 202           HHA      HEC 202   1.498   7.664  -9.481
  814    HHB  HEC 202           HHB      HEC 202   2.746   4.141  -4.776
  815    HHC  HEC 202           HHC      HEC 202   4.467   9.001  -1.219
  816    HHD  HEC 202           HHD      HEC 202   2.838  12.916  -5.812
  817   1HMA  HEC 202          1HMA      HEC 202   0.253   3.302  -7.366
  818   2HMA  HEC 202          2HMA      HEC 202   0.988   3.251  -5.765
  819   3HMA  HEC 202          3HMA      HEC 202   1.943   2.830  -7.187
  820   1HAA  HEC 202          1HAA      HEC 202   0.954   5.246  -9.955
  821   2HAA  HEC 202          2HAA      HEC 202  -0.151   4.447  -8.875
  822   1HBA  HEC 202          1HBA      HEC 202  -1.408   6.504  -8.566
  823   2HBA  HEC 202          2HBA      HEC 202  -0.263   7.382  -9.576
  824   1HMB  HEC 202          1HMB      HEC 202   2.981   3.620  -1.892
  825   2HMB  HEC 202          2HMB      HEC 202   4.726   3.746  -1.673
  826   3HMB  HEC 202          3HMB      HEC 202   4.063   3.335  -3.255
  827    HAB  HEC 202           HAB      HEC 202   4.160   7.030   0.118
  828   1HBB  HEC 202          1HBB      HEC 202   6.548   6.287  -1.254
  829   2HBB  HEC 202          2HBB      HEC 202   6.321   5.154   0.078
  830   3HBB  HEC 202          3HBB      HEC 202   6.391   6.888   0.397
  831   1HMC  HEC 202          1HMC      HEC 202   3.978  12.009  -0.530
  832   2HMC  HEC 202          2HMC      HEC 202   5.436  11.081  -0.877
  833   3HMC  HEC 202          3HMC      HEC 202   5.320  12.763  -1.390
  834    HAC  HEC 202           HAC      HEC 202   2.323  13.822  -3.666
  835   1HBC  HEC 202          1HBC      HEC 202   4.991  14.605  -2.504
  836   2HBC  HEC 202          2HBC      HEC 202   3.734  13.912  -1.480
  837   3HBC  HEC 202          3HBC      HEC 202   3.437  15.421  -2.343
  838   1HMD  HEC 202          1HMD      HEC 202   2.103  12.951  -9.811
  839   2HMD  HEC 202          2HMD      HEC 202   2.935  13.499  -8.355
  840   3HMD  HEC 202          3HMD      HEC 202   1.174  13.397  -8.380
  841   1HAD  HEC 202          1HAD      HEC 202   1.855   9.220 -10.764
  842   2HAD  HEC 202          2HAD      HEC 202   1.157  10.824 -10.917
  843   1HBD  HEC 202          1HBD      HEC 202   3.704  11.540 -10.509
  844   2HBD  HEC 202          2HBD      HEC 202   3.985   9.945 -11.205
  845    HHA  HEC 203           HHA      HEC 203   7.135  -6.903   4.640
  846    HHB  HEC 203           HHB      HEC 203   2.770  -2.122   4.926
  847    HHC  HEC 203           HHC      HEC 203   4.715   0.015  -0.435
  848    HHD  HEC 203           HHD      HEC 203   9.024  -4.552  -0.889
  849   1HMA  HEC 203          1HMA      HEC 203   2.229  -3.941   6.553
  850   2HMA  HEC 203          2HMA      HEC 203   3.535  -3.459   7.636
  851   3HMA  HEC 203          3HMA      HEC 203   3.075  -5.158   7.510
  852   1HAA  HEC 203          1HAA      HEC 203   4.827  -6.214   7.702
  853   2HAA  HEC 203          2HAA      HEC 203   4.653  -7.395   6.411
  854   1HBA  HEC 203          1HBA      HEC 203   6.876  -7.853   6.367
  855   2HBA  HEC 203          2HBA      HEC 203   7.325  -6.158   6.562
  856   1HMB  HEC 203          1HMB      HEC 203   2.615   0.626   4.941
  857   2HMB  HEC 203          2HMB      HEC 203   1.581   0.995   3.561
  858   3HMB  HEC 203          3HMB      HEC 203   1.409  -0.543   4.405
  859    HAB  HEC 203           HAB      HEC 203   2.833   0.837   0.120
  860   1HBB  HEC 203          1HBB      HEC 203   4.597   2.365   1.639
  861   2HBB  HEC 203          2HBB      HEC 203   3.044   3.158   1.903
  862   3HBB  HEC 203          3HBB      HEC 203   3.661   2.954   0.265
  863   1HMC  HEC 203          1HMC      HEC 203   6.163  -0.744  -3.464
  864   2HMC  HEC 203          2HMC      HEC 203   5.742   0.355  -2.151
  865   3HMC  HEC 203          3HMC      HEC 203   7.417   0.221  -2.686
  866    HAC  HEC 203           HAC      HEC 203   9.215  -3.518  -2.516
  867   1HBC  HEC 203          1HBC      HEC 203   8.574  -1.325  -4.355
  868   2HBC  HEC 203          2HBC      HEC 203  10.130  -1.784  -3.669
  869   3HBC  HEC 203          3HBC      HEC 203   9.031  -0.751  -2.754
  870   1HMD  HEC 203          1HMD      HEC 203  11.070  -6.453   0.992
  871   2HMD  HEC 203          2HMD      HEC 203  10.157  -6.294  -0.509
  872   3HMD  HEC 203          3HMD      HEC 203  10.124  -7.813   0.386
  873   1HAD  HEC 203          1HAD      HEC 203  10.166  -7.930   3.116
  874   2HAD  HEC 203          2HAD      HEC 203   8.767  -7.938   4.184
  875   1HBD  HEC 203          1HBD      HEC 203   7.622  -9.109   2.081
  876   2HBD  HEC 203          2HBD      HEC 203   9.291  -9.562   1.735
  877    HHA  HEC 204           HHA      HEC 204  -6.718   2.200   3.902
  878    HHB  HEC 204           HHB      HEC 204  -9.973  -2.261   0.874
  879    HHC  HEC 204           HHC      HEC 204  -4.711  -5.926   0.930
  880    HHD  HEC 204           HHD      HEC 204  -1.394  -0.980   2.689
  881   1HMA  HEC 204          1HMA      HEC 204 -10.922   0.957   0.853
  882   2HMA  HEC 204          2HMA      HEC 204 -11.605   0.534   2.424
  883   3HMA  HEC 204          3HMA      HEC 204 -11.285  -0.727   1.233
  884   1HAA  HEC 204          1HAA      HEC 204 -10.145   2.149   4.107
  885   2HAA  HEC 204          2HAA      HEC 204  -8.530   2.822   3.887
  886   1HBA  HEC 204          1HBA      HEC 204  -9.090   3.144   1.444
  887   2HBA  HEC 204          2HBA      HEC 204 -10.742   2.676   1.829
  888   1HMB  HEC 204          1HMB      HEC 204 -10.373  -3.804  -0.465
  889   2HMB  HEC 204          2HMB      HEC 204 -10.179  -5.506  -0.043
  890   3HMB  HEC 204          3HMB      HEC 204  -9.563  -4.903  -1.581
  891    HAB  HEC 204           HAB      HEC 204  -6.334  -6.993   0.246
  892   1HBB  HEC 204          1HBB      HEC 204  -6.857  -7.557  -2.224
  893   2HBB  HEC 204          2HBB      HEC 204  -5.604  -6.360  -1.894
  894   3HBB  HEC 204          3HBB      HEC 204  -7.214  -5.838  -2.392
  895   1HMC  HEC 204          1HMC      HEC 204  -2.916  -6.647   1.454
  896   2HMC  HEC 204          2HMC      HEC 204  -1.535  -6.062   0.527
  897   3HMC  HEC 204          3HMC      HEC 204  -1.432  -6.181   2.284
  898    HAC  HEC 204           HAC      HEC 204  -0.327  -2.479   2.983
  899   1HBC  HEC 204          1HBC      HEC 204   1.517  -3.178   1.593
  900   2HBC  HEC 204          2HBC      HEC 204   0.242  -2.628   0.505
  901   3HBC  HEC 204          3HBC      HEC 204   0.509  -4.353   0.746
  902   1HMD  HEC 204          1HMD      HEC 204  -0.845   1.049   3.107
  903   2HMD  HEC 204          2HMD      HEC 204  -1.479   2.660   3.443
  904   3HMD  HEC 204          3HMD      HEC 204  -1.304   1.489   4.751
  905   1HAD  HEC 204          1HAD      HEC 204  -3.622   3.845   3.668
  906   2HAD  HEC 204          2HAD      HEC 204  -5.272   3.489   4.162
  907   1HBD  HEC 204          1HBD      HEC 204  -4.116   2.339   6.217
  908   2HBD  HEC 204          2HBD      HEC 204  -2.748   3.359   5.773
  Start of MODEL    6
    1   1H    ALA   1          1H        ALA   1  19.526  15.659   2.051
    2   2H    ALA   1          2H        ALA   1  21.019  14.942   1.674
    3   3H    ALA   1          3H        ALA   1  20.478  14.988   3.284
    4    HA   ALA   1           HA       ALA   1  19.140  13.485   1.089
    5   1HB   ALA   1          1HB       ALA   1  20.352  11.624   1.823
    6   2HB   ALA   1          2HB       ALA   1  20.637  12.319   3.419
    7   3HB   ALA   1          3HB       ALA   1  21.543  12.908   2.025
    8    HA   PRO   2           HA       PRO   2  15.800  13.409   3.956
    9   1HB   PRO   2          1HB       PRO   2  14.551  11.129   3.112
   10   2HB   PRO   2          2HB       PRO   2  14.491  12.651   2.209
   11   1HG   PRO   2          1HG       PRO   2  16.157  10.237   1.734
   12   2HG   PRO   2          2HG       PRO   2  15.382  11.320   0.568
   13   1HD   PRO   2          1HD       PRO   2  18.045  11.404   1.183
   14   2HD   PRO   2          2HD       PRO   2  17.121  12.805   0.597
   15    H    LYS   3           H        LYS   3  15.705  12.661   6.053
   16    HA   LYS   3           HA       LYS   3  17.310  10.266   6.764
   17   1HB   LYS   3          1HB       LYS   3  15.916  12.436   8.337
   18   2HB   LYS   3          2HB       LYS   3  16.811  11.109   9.072
   19   1HG   LYS   3          1HG       LYS   3  18.494  12.199   7.071
   20   2HG   LYS   3          2HG       LYS   3  17.837  13.565   7.973
   21   1HD   LYS   3          1HD       LYS   3  18.670  12.741  10.040
   22   2HD   LYS   3          2HD       LYS   3  18.983  11.142   9.365
   23   1HE   LYS   3          1HE       LYS   3  21.019  11.770   8.562
   24   2HE   LYS   3          2HE       LYS   3  20.386  13.308   7.941
   25   1HZ   LYS   3          1HZ       LYS   3  20.516  14.298  10.031
   26   2HZ   LYS   3          2HZ       LYS   3  21.963  13.414   9.930
   27   3HZ   LYS   3          3HZ       LYS   3  20.661  12.815  10.842
   28    H    ALA   4           H        ALA   4  15.833   8.707   5.902
   29    HA   ALA   4           HA       ALA   4  13.130   8.338   6.178
   30   1HB   ALA   4          1HB       ALA   4  13.626   6.137   5.715
   31   2HB   ALA   4          2HB       ALA   4  14.831   6.036   6.999
   32   3HB   ALA   4          3HB       ALA   4  15.240   6.805   5.466
   33    HA   PRO   5           HA       PRO   5  12.460   8.447  10.533
   34   1HB   PRO   5          1HB       PRO   5   9.823   7.705  10.492
   35   2HB   PRO   5          2HB       PRO   5  10.393   9.329  10.076
   36   1HG   PRO   5          1HG       PRO   5   9.451   7.157   8.309
   37   2HG   PRO   5          2HG       PRO   5   9.403   8.907   8.082
   38   1HD   PRO   5          1HD       PRO   5  11.226   7.151   6.894
   39   2HD   PRO   5          2HD       PRO   5  11.368   8.917   6.969
   40    H    ALA   6           H        ALA   6  11.851   6.937  12.280
   41    HA   ALA   6           HA       ALA   6  12.993   4.371  12.037
   42   1HB   ALA   6          1HB       ALA   6  12.818   5.100  14.216
   43   2HB   ALA   6          2HB       ALA   6  11.360   4.109  14.164
   44   3HB   ALA   6          3HB       ALA   6  11.248   5.855  13.943
   45    H    ASP   7           H        ASP   7  11.563   2.362  12.712
   46    HA   ASP   7           HA       ASP   7   9.608   1.953  10.554
   47   1HB   ASP   7          1HB       ASP   7  10.468   0.062  12.754
   48   2HB   ASP   7          2HB       ASP   7   9.900  -0.342  11.136
   49    H    GLY   8           H        GLY   8   7.488   0.969  11.112
   50   1HA   GLY   8          1HA       GLY   8   5.680   0.551  12.658
   51   2HA   GLY   8          2HA       GLY   8   6.501   1.566  13.844
   52    H    LEU   9           H        LEU   9   6.442   2.871  10.673
   53    HA   LEU   9           HA       LEU   9   4.993   5.206  11.430
   54   1HB   LEU   9          1HB       LEU   9   6.391   4.218   9.208
   55   2HB   LEU   9          2HB       LEU   9   4.758   4.519   8.610
   56    HG   LEU   9           HG       LEU   9   5.891   6.609  10.379
   57   1HD1  LEU   9          1HD1      LEU   9   7.024   7.556   8.219
   58   2HD1  LEU   9          2HD1      LEU   9   7.027   5.874   7.685
   59   3HD1  LEU   9          3HD1      LEU   9   7.886   6.335   9.155
   60   1HD2  LEU   9          1HD2      LEU   9   3.753   7.059   9.429
   61   2HD2  LEU   9          2HD2      LEU   9   4.256   6.483   7.839
   62   3HD2  LEU   9          3HD2      LEU   9   4.887   8.009   8.460
   63    H    LYS  10           H        LYS  10   2.843   5.358  11.856
   64    HA   LYS  10           HA       LYS  10   1.067   3.166  10.918
   65   1HB   LYS  10          1HB       LYS  10   1.212   5.059  13.159
   66   2HB   LYS  10          2HB       LYS  10  -0.417   4.822  12.522
   67   1HG   LYS  10          1HG       LYS  10   0.111   2.299  12.606
   68   2HG   LYS  10          2HG       LYS  10   1.469   2.749  13.641
   69   1HD   LYS  10          1HD       LYS  10  -0.689   4.182  14.686
   70   2HD   LYS  10          2HD       LYS  10  -1.369   2.604  14.287
   71   1HE   LYS  10          1HE       LYS  10   0.323   1.470  15.615
   72   2HE   LYS  10          2HE       LYS  10   1.176   2.999  15.902
   73   1HZ   LYS  10          1HZ       LYS  10  -0.891   3.871  16.887
   74   2HZ   LYS  10          2HZ       LYS  10  -0.264   2.555  17.758
   75   3HZ   LYS  10          3HZ       LYS  10  -1.600   2.339  16.731
   76    H    MET  11           H        MET  11   0.159   3.528   8.973
   77    HA   MET  11           HA       MET  11  -0.420   6.237   7.981
   78   1HB   MET  11          1HB       MET  11  -0.345   3.429   7.027
   79   2HB   MET  11          2HB       MET  11  -1.560   4.444   6.247
   80   1HG   MET  11          1HG       MET  11   0.292   6.158   5.893
   81   2HG   MET  11          2HG       MET  11   1.423   4.898   6.387
   82   1HE   MET  11          1HE       MET  11   0.581   5.910   2.421
   83   2HE   MET  11          2HE       MET  11   2.106   5.782   3.292
   84   3HE   MET  11          3HE       MET  11   0.792   6.742   3.967
   85    H    ASP  12           H        ASP  12  -2.182   7.169   9.040
   86    HA   ASP  12           HA       ASP  12  -4.585   5.418   9.462
   87   1HB   ASP  12          1HB       ASP  12  -5.059   7.349  11.154
   88   2HB   ASP  12          2HB       ASP  12  -3.816   6.167  11.547
   89    H    LYS  13           H        LYS  13  -3.593   7.417   7.192
   90    HA   LYS  13           HA       LYS  13  -5.319   9.602   6.938
   91   1HB   LYS  13          1HB       LYS  13  -4.066   7.610   5.076
   92   2HB   LYS  13          2HB       LYS  13  -5.135   8.847   4.420
   93   1HG   LYS  13          1HG       LYS  13  -2.664   9.325   6.113
   94   2HG   LYS  13          2HG       LYS  13  -2.821   9.654   4.385
   95   1HD   LYS  13          1HD       LYS  13  -4.961  11.032   5.318
   96   2HD   LYS  13          2HD       LYS  13  -3.875  11.176   6.701
   97   1HE   LYS  13          1HE       LYS  13  -2.074  11.826   4.914
   98   2HE   LYS  13          2HE       LYS  13  -3.479  12.169   3.885
   99   1HZ   LYS  13          1HZ       LYS  13  -3.589  13.100   6.648
  100   2HZ   LYS  13          2HZ       LYS  13  -4.197  13.822   5.236
  101   3HZ   LYS  13          3HZ       LYS  13  -2.543  13.937   5.607
  102    H    THR  14           H        THR  14  -6.037   6.183   6.644
  103    HA   THR  14           HA       THR  14  -8.866   6.840   5.876
  104    HB   THR  14           HB       THR  14  -8.813   4.433   5.064
  105    HG1  THR  14           1HG      THR  14  -7.023   3.844   6.395
  106   1HG2  THR  14          1HG2      THR  14  -6.730   6.302   3.902
  107   2HG2  THR  14          2HG2      THR  14  -8.457   6.359   3.550
  108   3HG2  THR  14          3HG2      THR  14  -7.502   4.960   3.059
  109    H    LYS  15           H        LYS  15 -10.362   4.917   6.681
  110    HA   LYS  15           HA       LYS  15 -10.362   4.926   9.563
  111   1HB   LYS  15          1HB       LYS  15 -11.905   3.777   7.299
  112   2HB   LYS  15          2HB       LYS  15 -12.056   2.919   8.832
  113   1HG   LYS  15          1HG       LYS  15 -13.560   4.479   9.454
  114   2HG   LYS  15          2HG       LYS  15 -12.226   5.634   9.514
  115   1HD   LYS  15          1HD       LYS  15 -12.738   6.545   7.457
  116   2HD   LYS  15          2HD       LYS  15 -13.426   5.041   6.844
  117   1HE   LYS  15          1HE       LYS  15 -15.493   5.403   7.904
  118   2HE   LYS  15          2HE       LYS  15 -14.796   6.534   9.081
  119   1HZ   LYS  15          1HZ       LYS  15 -15.039   6.981   6.152
  120   2HZ   LYS  15          2HZ       LYS  15 -14.279   8.041   7.241
  121   3HZ   LYS  15          3HZ       LYS  15 -15.949   7.755   7.355
  122    H    GLN  16           H        GLN  16  -8.987   2.832   7.141
  123    HA   GLN  16           HA       GLN  16  -8.334   0.752   9.185
  124   1HB   GLN  16          1HB       GLN  16  -8.184   0.831   6.150
  125   2HB   GLN  16          2HB       GLN  16  -7.781  -0.574   7.137
  126   1HG   GLN  16          1HG       GLN  16 -10.410   0.616   7.739
  127   2HG   GLN  16          2HG       GLN  16 -10.275  -0.068   6.119
  128   1HE2  GLN  16          2HE2      GLN  16  -8.747  -1.149   9.198
  129   2HE2  GLN  16          1HE2      GLN  16  -9.412  -2.710   9.153
  130    HA   PRO  17           HA       PRO  17  -4.520   3.304   8.789
  131   1HB   PRO  17          1HB       PRO  17  -3.740   2.925  11.391
  132   2HB   PRO  17          2HB       PRO  17  -4.855   4.210  10.882
  133   1HG   PRO  17          1HG       PRO  17  -5.462   1.547  12.084
  134   2HG   PRO  17          2HG       PRO  17  -6.181   3.128  12.431
  135   1HD   PRO  17          1HD       PRO  17  -7.415   1.307  10.873
  136   2HD   PRO  17          2HD       PRO  17  -7.566   3.057  10.587
  137    H    VAL  18           H        VAL  18  -2.578   2.424   8.180
  138    HA   VAL  18           HA       VAL  18  -1.985  -0.398   9.000
  139    HB   VAL  18           HB       VAL  18  -1.716   1.130   6.407
  140   1HG1  VAL  18          1HG1      VAL  18  -0.498  -1.568   7.049
  141   2HG1  VAL  18          2HG1      VAL  18   0.417  -0.065   6.945
  142   3HG1  VAL  18          3HG1      VAL  18  -0.397  -0.703   5.516
  143   1HG2  VAL  18          1HG2      VAL  18  -3.319  -1.120   7.478
  144   2HG2  VAL  18          2HG2      VAL  18  -2.694  -1.356   5.846
  145   3HG2  VAL  18          3HG2      VAL  18  -3.714   0.037   6.206
  146    H    VAL  19           H        VAL  19   0.102  -0.754   9.761
  147    HA   VAL  19           HA       VAL  19   1.793   1.622  10.231
  148    HB   VAL  19           HB       VAL  19   1.929  -1.285  11.082
  149   1HG1  VAL  19          1HG1      VAL  19   3.637   1.116  11.741
  150   2HG1  VAL  19          2HG1      VAL  19   4.156  -0.488  11.224
  151   3HG1  VAL  19          3HG1      VAL  19   3.508  -0.251  12.847
  152   1HG2  VAL  19          1HG2      VAL  19   1.428   0.925  13.003
  153   2HG2  VAL  19          2HG2      VAL  19   0.724  -0.691  12.938
  154   3HG2  VAL  19          3HG2      VAL  19   0.122   0.577  11.870
  155    H    PHE  20           H        PHE  20   3.505   2.095   8.877
  156    HA   PHE  20           HA       PHE  20   4.462  -0.047   7.020
  157   1HB   PHE  20          1HB       PHE  20   3.655   2.033   5.997
  158   2HB   PHE  20          2HB       PHE  20   4.747   2.981   7.002
  159    HD1  PHE  20           HD1      PHE  20   4.861   0.043   4.674
  160    HD2  PHE  20           HD2      PHE  20   6.816   3.597   6.078
  161    HE1  PHE  20           HE1      PHE  20   6.674  -0.296   3.019
  162    HE2  PHE  20           HE2      PHE  20   8.622   3.259   4.421
  163    HZ   PHE  20           HZ       PHE  20   8.555   1.313   2.890
  164    H    ASN  21           H        ASN  21   6.343  -1.036   7.666
  165    HA   ASN  21           HA       ASN  21   8.128   0.348   9.582
  166   1HB   ASN  21          1HB       ASN  21   7.243  -2.324   8.945
  167   2HB   ASN  21          2HB       ASN  21   8.997  -2.246   8.895
  168   1HD2  ASN  21          2HD2      ASN  21   6.414  -0.849  11.001
  169   2HD2  ASN  21          1HD2      ASN  21   7.193  -1.239  12.459
  170    H    HIS  22           H        HIS  22   9.364   1.795   8.296
  171    HA   HIS  22           HA       HIS  22  10.327   1.454   5.692
  172   1HB   HIS  22          1HB       HIS  22  11.270   2.827   8.184
  173   2HB   HIS  22          2HB       HIS  22  12.354   2.792   6.794
  174    HD1  HIS  22           HD1      HIS  22   9.515   4.600   8.167
  175    HD2  HIS  22           HD2      HIS  22  10.989   3.884   4.331
  176    HE1  HIS  22           HE1      HIS  22   8.527   6.388   6.675
  177    H    SER  23           H        SER  23  11.595   0.105   8.723
  178    HA   SER  23           HA       SER  23  14.093  -0.876   7.927
  179   1HB   SER  23          1HB       SER  23  13.397  -1.146  10.179
  180   2HB   SER  23          2HB       SER  23  11.885  -1.916   9.707
  181    HG   SER  23           HG       SER  23  14.413  -2.973  10.018
  182    H    THR  24           H        THR  24  10.884  -2.363   7.423
  183    HA   THR  24           HA       THR  24  11.892  -4.684   6.013
  184    HB   THR  24           HB       THR  24   9.213  -4.076   5.276
  185    HG1  THR  24           1HG      THR  24   8.387  -3.121   6.958
  186   1HG2  THR  24          1HG2      THR  24  10.723  -6.026   6.822
  187   2HG2  THR  24          2HG2      THR  24   9.271  -6.255   5.848
  188   3HG2  THR  24          3HG2      THR  24   9.133  -5.728   7.524
  189    H    HIS  25           H        HIS  25  11.671  -1.418   5.166
  190    HA   HIS  25           HA       HIS  25  11.619  -2.081   2.253
  191   1HB   HIS  25          1HB       HIS  25  10.742   0.396   3.769
  192   2HB   HIS  25          2HB       HIS  25  10.581   0.135   2.035
  193    HD1  HIS  25           HD1      HIS  25   9.235  -1.043   5.337
  194    HD2  HIS  25           HD2      HIS  25   8.530  -1.685   1.281
  195    HE1  HIS  25           HE1      HIS  25   7.090  -2.378   5.186
  196    H    LYS  26           H        LYS  26  13.547  -0.975   4.811
  197    HA   LYS  26           HA       LYS  26  15.095   1.125   3.757
  198   1HB   LYS  26          1HB       LYS  26  16.797   0.301   5.297
  199   2HB   LYS  26          2HB       LYS  26  15.215   0.044   6.033
  200   1HG   LYS  26          1HG       LYS  26  15.272  -2.302   5.044
  201   2HG   LYS  26          2HG       LYS  26  16.967  -2.004   4.658
  202   1HD   LYS  26          1HD       LYS  26  15.974  -1.497   7.448
  203   2HD   LYS  26          2HD       LYS  26  16.348  -3.146   6.941
  204   1HE   LYS  26          1HE       LYS  26  18.399  -1.131   6.218
  205   2HE   LYS  26          2HE       LYS  26  18.222  -1.448   7.956
  206   1HZ   LYS  26          1HZ       LYS  26  19.699  -3.016   6.550
  207   2HZ   LYS  26          2HZ       LYS  26  18.223  -3.683   6.036
  208   3HZ   LYS  26          3HZ       LYS  26  18.634  -3.688   7.684
  209    H    ALA  27           H        ALA  27  14.877  -2.197   2.760
  210    HA   ALA  27           HA       ALA  27  17.361  -2.053   1.138
  211   1HB   ALA  27          1HB       ALA  27  17.150  -4.147   2.135
  212   2HB   ALA  27          2HB       ALA  27  16.348  -4.457   0.595
  213   3HB   ALA  27          3HB       ALA  27  15.390  -4.125   2.038
  214    H    VAL  28           H        VAL  28  14.140  -1.165   0.842
  215    HA   VAL  28           HA       VAL  28  13.741  -1.939  -1.964
  216    HB   VAL  28           HB       VAL  28  12.283  -0.228   0.062
  217   1HG1  VAL  28          1HG1      VAL  28  10.410  -0.211  -1.598
  218   2HG1  VAL  28          2HG1      VAL  28  11.523  -0.870  -2.797
  219   3HG1  VAL  28          3HG1      VAL  28  11.809   0.730  -2.111
  220   1HG2  VAL  28          1HG2      VAL  28  12.123  -2.590   0.517
  221   2HG2  VAL  28          2HG2      VAL  28  11.791  -2.945  -1.178
  222   3HG2  VAL  28          3HG2      VAL  28  10.593  -2.093  -0.205
  223    H    LYS  29           H        LYS  29  13.019   0.064  -3.423
  224    HA   LYS  29           HA       LYS  29  15.345   1.884  -3.432
  225   1HB   LYS  29          1HB       LYS  29  13.494   0.735  -5.313
  226   2HB   LYS  29          2HB       LYS  29  13.512   2.493  -5.481
  227   1HG   LYS  29          1HG       LYS  29  15.312   1.978  -6.828
  228   2HG   LYS  29          2HG       LYS  29  16.136   2.129  -5.274
  229   1HD   LYS  29          1HD       LYS  29  15.466  -0.450  -5.092
  230   2HD   LYS  29          2HD       LYS  29  15.494  -0.327  -6.851
  231   1HE   LYS  29          1HE       LYS  29  17.805   0.978  -6.259
  232   2HE   LYS  29          2HE       LYS  29  17.745  -0.186  -4.921
  233   1HZ   LYS  29          1HZ       LYS  29  18.732  -1.334  -6.708
  234   2HZ   LYS  29          2HZ       LYS  29  17.603  -0.741  -7.830
  235   3HZ   LYS  29          3HZ       LYS  29  17.128  -1.882  -6.663
  236    H    CYS  30           H        CYS  30  15.078   3.504  -2.000
  237    HA   CYS  30           HA       CYS  30  12.772   4.686  -0.966
  238   1HB   CYS  30          1HB       CYS  30  15.519   5.711  -1.669
  239   2HB   CYS  30          2HB       CYS  30  14.323   6.808  -0.981
  240    H    GLY  31           H        GLY  31  14.099   4.942  -4.174
  241   1HA   GLY  31          1HA       GLY  31  12.400   7.245  -4.886
  242   2HA   GLY  31          2HA       GLY  31  13.535   6.424  -5.961
  243    H    ASP  32           H        ASP  32  12.098   3.842  -4.748
  244    HA   ASP  32           HA       ASP  32  10.257   3.579  -7.014
  245   1HB   ASP  32          1HB       ASP  32  11.785   1.916  -5.383
  246   2HB   ASP  32          2HB       ASP  32  10.134   1.550  -4.901
  247    H    CYS  33           H        CYS  33  10.078   4.110  -3.534
  248    HA   CYS  33           HA       CYS  33   7.108   4.067  -3.557
  249   1HB   CYS  33          1HB       CYS  33   9.310   4.358  -1.498
  250   2HB   CYS  33          2HB       CYS  33   7.625   4.663  -1.078
  251    H    HIS  34           H        HIS  34   9.718   6.322  -2.562
  252    HA   HIS  34           HA       HIS  34   7.916   8.651  -2.898
  253   1HB   HIS  34          1HB       HIS  34  10.810   8.287  -2.037
  254   2HB   HIS  34          2HB       HIS  34   9.981   9.835  -2.065
  255    HD1  HIS  34           HD1      HIS  34   7.576   9.752  -0.603
  256    HD2  HIS  34           HD2      HIS  34  10.581   7.047   0.407
  257    HE1  HIS  34           HE1      HIS  34   7.100   8.995   1.768
  258    H    HIS  35           H        HIS  35   8.328   7.289  -5.321
  259    HA   HIS  35           HA       HIS  35  10.428   7.707  -6.987
  260   1HB   HIS  35          1HB       HIS  35   8.611   8.291  -8.735
  261   2HB   HIS  35          2HB       HIS  35   8.456   6.772  -7.873
  262    HD1  HIS  35           HD1      HIS  35   7.100  10.232  -7.975
  263    HD2  HIS  35           HD2      HIS  35   6.153   6.584  -6.221
  264    HE1  HIS  35           HE1      HIS  35   4.795  10.509  -6.978
  265    HA   PRO  36           HA       PRO  36  11.532  11.882  -7.390
  266   1HB   PRO  36          1HB       PRO  36  11.864  12.174 -10.100
  267   2HB   PRO  36          2HB       PRO  36  13.004  11.293  -9.061
  268   1HG   PRO  36          1HG       PRO  36  10.813  10.229 -10.790
  269   2HG   PRO  36          2HG       PRO  36  12.467   9.629 -10.570
  270   1HD   PRO  36          1HD       PRO  36  10.369   8.480  -9.340
  271   2HD   PRO  36          2HD       PRO  36  11.967   8.589  -8.565
  272    H    VAL  37           H        VAL  37   9.850  13.208  -6.818
  273    HA   VAL  37           HA       VAL  37   7.813  13.885  -8.913
  274    HB   VAL  37           HB       VAL  37   7.746  13.749  -5.892
  275   1HG1  VAL  37          1HG1      VAL  37   6.542  15.732  -6.281
  276   2HG1  VAL  37          2HG1      VAL  37   5.283  14.497  -6.317
  277   3HG1  VAL  37          3HG1      VAL  37   5.914  15.158  -7.826
  278   1HG2  VAL  37          1HG2      VAL  37   6.400  12.318  -8.176
  279   2HG2  VAL  37          2HG2      VAL  37   5.636  12.373  -6.588
  280   3HG2  VAL  37          3HG2      VAL  37   7.226  11.635  -6.776
  281    H    ASN  38           H        ASN  38   7.159  16.185  -8.910
  282    HA   ASN  38           HA       ASN  38   7.773  18.480  -9.012
  283   1HB   ASN  38          1HB       ASN  38   7.236  17.787  -6.588
  284   2HB   ASN  38          2HB       ASN  38   8.960  17.846  -6.318
  285   1HD2  ASN  38          2HD2      ASN  38   6.338  19.734  -5.840
  286   2HD2  ASN  38          1HD2      ASN  38   7.021  21.272  -6.070
  287    H    GLY  39           H        GLY  39   9.928  16.308  -9.715
  288   1HA   GLY  39          1HA       GLY  39  12.062  16.727 -10.724
  289   2HA   GLY  39          2HA       GLY  39  12.174  18.230  -9.804
  290    H    LYS  40           H        LYS  40  11.106  16.289  -7.499
  291    HA   LYS  40           HA       LYS  40  13.681  14.897  -6.922
  292   1HB   LYS  40          1HB       LYS  40  14.031  16.131  -4.900
  293   2HB   LYS  40          2HB       LYS  40  13.673  17.336  -6.137
  294   1HG   LYS  40          1HG       LYS  40  11.356  17.471  -5.402
  295   2HG   LYS  40          2HG       LYS  40  11.614  16.167  -4.244
  296   1HD   LYS  40          1HD       LYS  40  12.966  18.882  -4.206
  297   2HD   LYS  40          2HD       LYS  40  11.716  18.326  -3.092
  298   1HE   LYS  40          1HE       LYS  40  13.218  16.517  -2.305
  299   2HE   LYS  40          2HE       LYS  40  14.482  17.102  -3.406
  300   1HZ   LYS  40          1HZ       LYS  40  13.212  18.587  -1.171
  301   2HZ   LYS  40          2HZ       LYS  40  14.189  19.327  -2.347
  302   3HZ   LYS  40          3HZ       LYS  40  14.843  18.145  -1.316
  303    H    GLU  41           H        GLU  41  13.338  13.034  -5.693
  304    HA   GLU  41           HA       GLU  41  10.753  11.916  -5.403
  305   1HB   GLU  41          1HB       GLU  41  13.413  11.435  -4.051
  306   2HB   GLU  41          2HB       GLU  41  12.005  10.431  -3.710
  307   1HG   GLU  41          1HG       GLU  41  11.912   9.598  -5.907
  308   2HG   GLU  41          2HG       GLU  41  12.873  10.930  -6.552
  309    H    ASP  42           H        ASP  42   9.150  12.843  -4.157
  310    HA   ASP  42           HA       ASP  42   9.650  14.524  -1.877
  311   1HB   ASP  42          1HB       ASP  42   7.240  12.952  -2.811
  312   2HB   ASP  42          2HB       ASP  42   7.196  14.151  -1.522
  313    H    TYR  43           H        TYR  43  10.907  13.487  -0.323
  314    HA   TYR  43           HA       TYR  43  10.349  10.749   0.546
  315   1HB   TYR  43          1HB       TYR  43  12.154  12.966   1.572
  316   2HB   TYR  43          2HB       TYR  43  12.190  11.304   2.160
  317    HD1  TYR  43           HD1      TYR  43  12.480   9.434   0.345
  318    HD2  TYR  43           HD2      TYR  43  13.468  13.570  -0.270
  319    HE1  TYR  43           HE1      TYR  43  13.963   8.801  -1.538
  320    HE2  TYR  43           HE2      TYR  43  14.951  12.935  -2.154
  321    HH   TYR  43           HH       TYR  43  15.711   9.589  -2.845
  322    H    GLN  44           H        GLN  44   7.977  12.017   0.902
  323    HA   GLN  44           HA       GLN  44   7.842  12.448   3.868
  324   1HB   GLN  44          1HB       GLN  44   6.007  14.140   3.214
  325   2HB   GLN  44          2HB       GLN  44   7.674  14.612   2.877
  326   1HG   GLN  44          1HG       GLN  44   7.397  13.749   0.545
  327   2HG   GLN  44          2HG       GLN  44   5.697  13.439   0.900
  328   1HE2  GLN  44          2HE2      GLN  44   5.768  15.971   2.705
  329   2HE2  GLN  44          1HE2      GLN  44   5.618  17.248   1.597
  330    H    LYS  45           H        LYS  45   5.373  12.333   4.519
  331    HA   LYS  45           HA       LYS  45   4.397   9.762   4.256
  332   1HB   LYS  45          1HB       LYS  45   2.136  10.886   4.690
  333   2HB   LYS  45          2HB       LYS  45   3.425  11.262   5.824
  334   1HG   LYS  45          1HG       LYS  45   3.892  13.360   4.657
  335   2HG   LYS  45          2HG       LYS  45   2.678  12.973   3.437
  336   1HD   LYS  45          1HD       LYS  45   0.953  13.579   4.787
  337   2HD   LYS  45          2HD       LYS  45   1.687  12.839   6.210
  338   1HE   LYS  45          1HE       LYS  45   3.375  14.833   6.090
  339   2HE   LYS  45          2HE       LYS  45   2.125  15.603   5.092
  340   1HZ   LYS  45          1HZ       LYS  45   1.656  16.105   7.368
  341   2HZ   LYS  45          2HZ       LYS  45   1.790  14.472   7.819
  342   3HZ   LYS  45          3HZ       LYS  45   0.499  14.983   6.839
  343    H    CYS  46           H        CYS  46   3.339   8.609   2.717
  344    HA   CYS  46           HA       CYS  46   3.301   9.301  -0.012
  345   1HB   CYS  46          1HB       CYS  46   1.570   7.431   1.632
  346   2HB   CYS  46          2HB       CYS  46   1.712   7.368  -0.122
  347    H    ALA  47           H        ALA  47   0.786   9.655   2.459
  348    HA   ALA  47           HA       ALA  47  -1.068  10.884   0.488
  349   1HB   ALA  47          1HB       ALA  47  -1.214   9.335   2.885
  350   2HB   ALA  47          2HB       ALA  47  -2.535   9.820   1.822
  351   3HB   ALA  47          3HB       ALA  47  -2.055  10.858   3.165
  352    H    THR  48           H        THR  48   1.288  12.432   1.139
  353    HA   THR  48           HA       THR  48   1.261  14.320   3.113
  354    HB   THR  48           HB       THR  48   1.493  15.317   0.308
  355    HG1  THR  48           1HG      THR  48   3.530  14.094   0.253
  356   1HG2  THR  48          1HG2      THR  48   3.789  15.341   2.150
  357   2HG2  THR  48          2HG2      THR  48   2.361  16.174   2.766
  358   3HG2  THR  48          3HG2      THR  48   3.071  16.661   1.227
  359    H    ALA  49           H        ALA  49   0.195  16.303   3.464
  360    HA   ALA  49           HA       ALA  49  -2.529  16.531   3.334
  361   1HB   ALA  49          1HB       ALA  49  -2.185  18.797   3.855
  362   2HB   ALA  49          2HB       ALA  49  -0.811  18.933   2.756
  363   3HB   ALA  49          3HB       ALA  49  -0.636  18.069   4.283
  364    H    GLY  50           H        GLY  50  -0.334  17.058   0.633
  365   1HA   GLY  50          1HA       GLY  50  -2.733  17.503  -1.096
  366   2HA   GLY  50          2HA       GLY  50  -1.288  18.486  -1.304
  367    H    CYS  51           H        CYS  51  -1.888  14.996  -0.870
  368    HA   CYS  51           HA       CYS  51  -0.557  14.477  -3.477
  369   1HB   CYS  51          1HB       CYS  51   0.899  14.607  -1.239
  370   2HB   CYS  51          2HB       CYS  51   0.380  12.952  -1.086
  371    H    HIS  52           H        HIS  52  -0.424  11.691  -1.691
  372    HA   HIS  52           HA       HIS  52  -2.767  10.535  -3.010
  373   1HB   HIS  52          1HB       HIS  52  -0.682   9.581  -1.044
  374   2HB   HIS  52          2HB       HIS  52  -1.984   8.538  -1.572
  375    HD1  HIS  52           HD1      HIS  52  -2.172   8.847  -4.429
  376    HD2  HIS  52           HD2      HIS  52   1.537   9.000  -2.571
  377    HE1  HIS  52           HE1      HIS  52  -0.458   8.287  -6.219
  378    H    ASP  53           H        ASP  53  -3.721  12.604  -1.439
  379    HA   ASP  53           HA       ASP  53  -4.666  11.365   1.105
  380   1HB   ASP  53          1HB       ASP  53  -5.035  13.631   1.798
  381   2HB   ASP  53          2HB       ASP  53  -3.487  13.620   0.953
  382    H    ASN  54           H        ASN  54  -5.818  10.807  -1.700
  383    HA   ASN  54           HA       ASN  54  -8.447  12.106  -1.651
  384   1HB   ASN  54          1HB       ASN  54  -6.879  10.966  -3.558
  385   2HB   ASN  54          2HB       ASN  54  -7.965   9.621  -3.211
  386   1HD2  ASN  54          2HD2      ASN  54  -9.639   9.653  -4.716
  387   2HD2  ASN  54          1HD2      ASN  54 -10.453  11.048  -5.238
  388    H    MET  55           H        MET  55  -9.697  11.516   0.115
  389    HA   MET  55           HA       MET  55  -9.602   8.834   1.265
  390   1HB   MET  55          1HB       MET  55 -10.808  11.476   1.770
  391   2HB   MET  55          2HB       MET  55 -11.808  10.122   2.297
  392   1HG   MET  55          1HG       MET  55 -10.444   9.700   4.040
  393   2HG   MET  55          2HG       MET  55  -9.024   9.683   2.993
  394   1HE   MET  55          1HE       MET  55  -7.097  12.444   4.154
  395   2HE   MET  55          2HE       MET  55  -7.461  11.878   2.526
  396   3HE   MET  55          3HE       MET  55  -7.305  10.716   3.840
  397    H    ASP  56           H        ASP  56 -10.798   9.699  -1.603
  398    HA   ASP  56           HA       ASP  56 -13.521   8.640  -1.444
  399   1HB   ASP  56          1HB       ASP  56 -12.339  10.374  -3.062
  400   2HB   ASP  56          2HB       ASP  56 -11.922   8.921  -3.970
  401    H    LYS  57           H        LYS  57 -10.373   7.288  -1.652
  402    HA   LYS  57           HA       LYS  57  -9.613   5.111  -2.221
  403   1HB   LYS  57          1HB       LYS  57 -12.401   4.435  -1.253
  404   2HB   LYS  57          2HB       LYS  57 -10.942   3.456  -1.088
  405   1HG   LYS  57          1HG       LYS  57 -10.332   4.543   0.787
  406   2HG   LYS  57          2HG       LYS  57 -10.561   6.115   0.026
  407   1HD   LYS  57          1HD       LYS  57 -12.073   5.740   1.993
  408   2HD   LYS  57          2HD       LYS  57 -12.943   6.057   0.493
  409   1HE   LYS  57          1HE       LYS  57 -13.452   3.718   0.195
  410   2HE   LYS  57          2HE       LYS  57 -12.368   3.259   1.523
  411   1HZ   LYS  57          1HZ       LYS  57 -14.992   4.543   1.632
  412   2HZ   LYS  57          2HZ       LYS  57 -13.837   5.037   2.776
  413   3HZ   LYS  57          3HZ       LYS  57 -14.302   3.406   2.685
  414    H    LYS  58           H        LYS  58 -11.326   6.642  -4.284
  415    HA   LYS  58           HA       LYS  58 -11.997   4.249  -5.959
  416   1HB   LYS  58          1HB       LYS  58 -13.525   6.860  -5.698
  417   2HB   LYS  58          2HB       LYS  58 -13.974   5.506  -6.735
  418   1HG   LYS  58          1HG       LYS  58 -13.528   4.555  -4.051
  419   2HG   LYS  58          2HG       LYS  58 -14.677   5.893  -4.022
  420   1HD   LYS  58          1HD       LYS  58 -15.932   4.743  -5.888
  421   2HD   LYS  58          2HD       LYS  58 -14.870   3.354  -5.661
  422   1HE   LYS  58          1HE       LYS  58 -16.155   2.644  -3.940
  423   2HE   LYS  58          2HE       LYS  58 -15.887   4.180  -3.093
  424   1HZ   LYS  58          1HZ       LYS  58 -17.701   5.162  -4.099
  425   2HZ   LYS  58          2HZ       LYS  58 -18.270   3.580  -3.855
  426   3HZ   LYS  58          3HZ       LYS  58 -17.726   4.063  -5.391
  427    H    ASP  59           H        ASP  59 -10.287   7.175  -5.647
  428    HA   ASP  59           HA       ASP  59 -10.280   8.047  -8.407
  429   1HB   ASP  59          1HB       ASP  59  -9.723   9.572  -6.636
  430   2HB   ASP  59          2HB       ASP  59  -8.493   8.480  -6.000
  431    H    LYS  60           H        LYS  60  -9.506   6.665  -9.975
  432    HA   LYS  60           HA       LYS  60  -7.336   4.757  -9.380
  433   1HB   LYS  60          1HB       LYS  60  -9.366   5.295 -11.472
  434   2HB   LYS  60          2HB       LYS  60  -7.861   4.578 -12.053
  435   1HG   LYS  60          1HG       LYS  60  -9.543   3.488  -9.776
  436   2HG   LYS  60          2HG       LYS  60  -9.522   2.845 -11.418
  437   1HD   LYS  60          1HD       LYS  60  -6.817   3.043 -10.619
  438   2HD   LYS  60          2HD       LYS  60  -7.681   2.330  -9.256
  439   1HE   LYS  60          1HE       LYS  60  -8.517   1.224 -11.852
  440   2HE   LYS  60          2HE       LYS  60  -6.813   0.913 -11.461
  441   1HZ   LYS  60          1HZ       LYS  60  -7.624   0.326  -9.168
  442   2HZ   LYS  60          2HZ       LYS  60  -8.034  -0.779 -10.391
  443   3HZ   LYS  60          3HZ       LYS  60  -9.196   0.312  -9.803
  444    H    SER  61           H        SER  61  -6.923   7.805  -9.486
  445    HA   SER  61           HA       SER  61  -5.026   8.007 -11.776
  446   1HB   SER  61          1HB       SER  61  -6.714   9.786 -10.160
  447   2HB   SER  61          2HB       SER  61  -5.098  10.429 -10.437
  448    HG   SER  61           HG       SER  61  -5.644   9.594 -12.726
  449    H    ALA  62           H        ALA  62  -3.300   9.929 -10.626
  450    HA   ALA  62           HA       ALA  62  -1.705   8.186  -8.812
  451   1HB   ALA  62          1HB       ALA  62  -1.179   9.777 -11.046
  452   2HB   ALA  62          2HB       ALA  62   0.030   9.071  -9.973
  453   3HB   ALA  62          3HB       ALA  62  -0.541  10.717  -9.698
  454    H    LYS  63           H        LYS  63  -4.091   9.794  -7.885
  455    HA   LYS  63           HA       LYS  63  -2.657  11.456  -5.837
  456   1HB   LYS  63          1HB       LYS  63  -4.082  12.475  -7.886
  457   2HB   LYS  63          2HB       LYS  63  -5.397  12.198  -6.743
  458   1HG   LYS  63          1HG       LYS  63  -3.105  13.376  -5.409
  459   2HG   LYS  63          2HG       LYS  63  -3.628  14.380  -6.762
  460   1HD   LYS  63          1HD       LYS  63  -5.896  14.453  -5.910
  461   2HD   LYS  63          2HD       LYS  63  -5.499  13.296  -4.640
  462   1HE   LYS  63          1HE       LYS  63  -5.060  15.110  -3.336
  463   2HE   LYS  63          2HE       LYS  63  -3.595  15.318  -4.317
  464   1HZ   LYS  63          1HZ       LYS  63  -6.184  16.259  -5.349
  465   2HZ   LYS  63          2HZ       LYS  63  -4.618  16.813  -5.711
  466   3HZ   LYS  63          3HZ       LYS  63  -5.345  17.218  -4.229
  467    H    GLY  64           H        GLY  64  -4.681   8.831  -6.393
  468   1HA   GLY  64          1HA       GLY  64  -6.413   9.206  -4.068
  469   2HA   GLY  64          2HA       GLY  64  -6.351   7.773  -5.085
  470    H    TYR  65           H        TYR  65  -6.158   8.239  -2.086
  471    HA   TYR  65           HA       TYR  65  -3.477   7.455  -1.286
  472   1HB   TYR  65          1HB       TYR  65  -5.255   8.689   0.059
  473   2HB   TYR  65          2HB       TYR  65  -6.093   7.146   0.208
  474    HD1  TYR  65           HD1      TYR  65  -5.784   6.233   2.328
  475    HD2  TYR  65           HD2      TYR  65  -2.468   8.124   0.358
  476    HE1  TYR  65           HE1      TYR  65  -4.294   5.572   4.199
  477    HE2  TYR  65           HE2      TYR  65  -0.981   7.466   2.230
  478    HH   TYR  65           HH       TYR  65  -1.163   6.865   4.596
  479    H    TYR  66           H        TYR  66  -6.580   5.716  -1.651
  480    HA   TYR  66           HA       TYR  66  -5.439   3.158  -0.863
  481   1HB   TYR  66          1HB       TYR  66  -7.690   3.338  -0.375
  482   2HB   TYR  66          2HB       TYR  66  -8.021   4.327  -1.794
  483    HD1  TYR  66           HD1      TYR  66  -7.711   3.123  -4.106
  484    HD2  TYR  66           HD2      TYR  66  -8.345   1.105  -0.373
  485    HE1  TYR  66           HE1      TYR  66  -8.512   1.113  -5.331
  486    HE2  TYR  66           HE2      TYR  66  -9.139  -0.905  -1.589
  487    HH   TYR  66           HH       TYR  66  -9.832  -0.848  -4.974
  488    H    HIS  67           H        HIS  67  -6.062   4.832  -3.922
  489    HA   HIS  67           HA       HIS  67  -5.844   2.648  -5.728
  490   1HB   HIS  67          1HB       HIS  67  -6.551   4.758  -6.541
  491   2HB   HIS  67          2HB       HIS  67  -5.171   5.590  -5.822
  492    HD1  HIS  67           HD1      HIS  67  -5.959   3.104  -8.581
  493    HD2  HIS  67           HD2      HIS  67  -2.942   5.766  -7.492
  494    HE1  HIS  67           HE1      HIS  67  -4.268   3.077 -10.462
  495    H    ALA  68           H        ALA  68  -3.226   5.019  -5.255
  496    HA   ALA  68           HA       ALA  68  -1.107   3.607  -6.329
  497   1HB   ALA  68          1HB       ALA  68  -0.100   4.883  -4.030
  498   2HB   ALA  68          2HB       ALA  68  -1.560   5.776  -4.456
  499   3HB   ALA  68          3HB       ALA  68  -0.267   5.586  -5.639
  500    H    MET  69           H        MET  69  -2.767   2.841  -3.339
  501    HA   MET  69           HA       MET  69  -0.544   1.163  -2.361
  502   1HB   MET  69          1HB       MET  69  -3.331   1.762  -1.352
  503   2HB   MET  69          2HB       MET  69  -2.114   0.853  -0.459
  504   1HG   MET  69          1HG       MET  69  -1.051   3.365  -1.471
  505   2HG   MET  69          2HG       MET  69  -2.444   3.619  -0.424
  506   1HE   MET  69          1HE       MET  69   1.494   3.705   0.971
  507   2HE   MET  69          2HE       MET  69   0.168   4.862   0.916
  508   3HE   MET  69          3HE       MET  69   0.711   4.087  -0.569
  509    H    HIS  70           H        HIS  70  -3.906   0.653  -3.503
  510    HA   HIS  70           HA       HIS  70  -3.427  -2.271  -3.408
  511   1HB   HIS  70          1HB       HIS  70  -5.894  -0.687  -4.171
  512   2HB   HIS  70          2HB       HIS  70  -5.831  -2.386  -3.701
  513    HD1  HIS  70           HD1      HIS  70  -5.957   1.044  -2.326
  514    HD2  HIS  70           HD2      HIS  70  -5.215  -2.795  -0.890
  515    HE1  HIS  70           HE1      HIS  70  -6.108   1.183   0.196
  516    H    ASP  71           H        ASP  71  -3.502   0.334  -5.695
  517    HA   ASP  71           HA       ASP  71  -4.152  -1.319  -8.015
  518   1HB   ASP  71          1HB       ASP  71  -3.180   1.491  -7.498
  519   2HB   ASP  71          2HB       ASP  71  -3.381   0.872  -9.133
  520    H    LYS  72           H        LYS  72  -2.685  -2.760  -8.816
  521    HA   LYS  72           HA       LYS  72   0.178  -2.527  -8.256
  522   1HB   LYS  72          1HB       LYS  72   0.262  -4.689  -9.259
  523   2HB   LYS  72          2HB       LYS  72  -1.300  -4.630  -8.440
  524   1HG   LYS  72          1HG       LYS  72  -2.407  -4.033 -10.549
  525   2HG   LYS  72          2HG       LYS  72  -0.851  -4.036 -11.380
  526   1HD   LYS  72          1HD       LYS  72  -0.739  -6.316 -11.447
  527   2HD   LYS  72          2HD       LYS  72  -1.484  -6.497  -9.857
  528   1HE   LYS  72          1HE       LYS  72  -3.619  -6.568 -10.719
  529   2HE   LYS  72          2HE       LYS  72  -3.231  -5.445 -12.038
  530   1HZ   LYS  72          1HZ       LYS  72  -2.151  -7.096 -13.241
  531   2HZ   LYS  72          2HZ       LYS  72  -3.508  -7.911 -12.622
  532   3HZ   LYS  72          3HZ       LYS  72  -1.985  -8.119 -11.898
  533    H    GLY  73           H        GLY  73  -1.940  -2.163 -11.086
  534   1HA   GLY  73          1HA       GLY  73   0.242  -1.588 -12.917
  535   2HA   GLY  73          2HA       GLY  73  -1.473  -1.322 -13.243
  536    H    THR  74           H        THR  74   0.883  -0.028 -10.888
  537    HA   THR  74           HA       THR  74  -0.212   2.707 -11.409
  538    HB   THR  74           HB       THR  74   1.086   3.040  -9.168
  539    HG1  THR  74           1HG      THR  74   2.262   1.238  -9.009
  540   1HG2  THR  74          1HG2      THR  74  -0.813   1.884  -7.914
  541   2HG2  THR  74          2HG2      THR  74  -1.373   1.308  -9.484
  542   3HG2  THR  74          3HG2      THR  74  -1.308   3.039  -9.152
  543    H    LYS  75           H        LYS  75   1.357   4.477 -11.624
  544    HA   LYS  75           HA       LYS  75   3.437   4.235 -13.402
  545   1HB   LYS  75          1HB       LYS  75   2.469   6.300 -12.131
  546   2HB   LYS  75          2HB       LYS  75   3.720   5.955 -10.932
  547   1HG   LYS  75          1HG       LYS  75   4.403   6.158 -13.859
  548   2HG   LYS  75          2HG       LYS  75   4.304   7.599 -12.849
  549   1HD   LYS  75          1HD       LYS  75   6.453   7.175 -12.302
  550   2HD   LYS  75          2HD       LYS  75   5.820   5.857 -11.315
  551   1HE   LYS  75          1HE       LYS  75   5.869   4.571 -13.666
  552   2HE   LYS  75          2HE       LYS  75   7.156   5.749 -13.987
  553   1HZ   LYS  75          1HZ       LYS  75   6.978   4.130 -11.506
  554   2HZ   LYS  75          2HZ       LYS  75   8.263   5.132 -11.988
  555   3HZ   LYS  75          3HZ       LYS  75   7.934   3.699 -12.838
  556    H    PHE  76           H        PHE  76   3.970   4.223  -9.855
  557    HA   PHE  76           HA       PHE  76   6.549   2.788 -10.287
  558   1HB   PHE  76          1HB       PHE  76   5.366   4.053  -7.800
  559   2HB   PHE  76          2HB       PHE  76   7.036   3.561  -8.038
  560    HD1  PHE  76           HD1      PHE  76   8.411   4.747  -9.831
  561    HD2  PHE  76           HD2      PHE  76   4.559   6.132  -8.535
  562    HE1  PHE  76           HE1      PHE  76   8.875   6.973 -10.821
  563    HE2  PHE  76           HE2      PHE  76   5.023   8.356  -9.521
  564    HZ   PHE  76           HZ       PHE  76   7.177   8.771 -10.662
  565    H    LYS  77           H        LYS  77   6.951   1.298  -8.134
  566    HA   LYS  77           HA       LYS  77   4.854  -0.752  -8.265
  567   1HB   LYS  77          1HB       LYS  77   6.412  -1.976  -6.803
  568   2HB   LYS  77          2HB       LYS  77   7.238  -1.339  -8.221
  569   1HG   LYS  77          1HG       LYS  77   7.939   0.638  -6.818
  570   2HG   LYS  77          2HG       LYS  77   7.272  -0.196  -5.415
  571   1HD   LYS  77          1HD       LYS  77   9.739  -0.571  -5.713
  572   2HD   LYS  77          2HD       LYS  77   8.795  -2.059  -5.729
  573   1HE   LYS  77          1HE       LYS  77   8.878  -2.169  -8.154
  574   2HE   LYS  77          2HE       LYS  77   9.664  -0.580  -8.237
  575   1HZ   LYS  77          1HZ       LYS  77  11.262  -1.761  -6.514
  576   2HZ   LYS  77          2HZ       LYS  77  11.512  -1.880  -8.191
  577   3HZ   LYS  77          3HZ       LYS  77  10.751  -3.146  -7.351
  578    H    SER  78           H        SER  78   3.108  -0.477  -7.095
  579    HA   SER  78           HA       SER  78   2.912   1.309  -4.809
  580   1HB   SER  78          1HB       SER  78   0.556   0.088  -4.878
  581   2HB   SER  78          2HB       SER  78   1.008   1.242  -6.128
  582    HG   SER  78           HG       SER  78   0.493  -0.460  -7.317
  583    H    CYS  79           H        CYS  79   1.606   0.381  -2.840
  584    HA   CYS  79           HA       CYS  79   3.243  -1.430  -1.374
  585   1HB   CYS  79          1HB       CYS  79   0.307  -0.768  -1.000
  586   2HB   CYS  79          2HB       CYS  79   1.438  -1.264   0.255
  587    H    VAL  80           H        VAL  80  -0.138  -2.038  -2.381
  588    HA   VAL  80           HA       VAL  80   0.066  -4.901  -2.133
  589    HB   VAL  80           HB       VAL  80  -1.802  -2.967  -3.510
  590   1HG1  VAL  80          1HG1      VAL  80  -1.523  -5.802  -3.997
  591   2HG1  VAL  80          2HG1      VAL  80  -2.617  -4.646  -4.760
  592   3HG1  VAL  80          3HG1      VAL  80  -3.091  -5.456  -3.265
  593   1HG2  VAL  80          1HG2      VAL  80  -1.704  -3.197  -0.970
  594   2HG2  VAL  80          2HG2      VAL  80  -2.280  -4.851  -1.181
  595   3HG2  VAL  80          3HG2      VAL  80  -3.287  -3.496  -1.685
  596    H    GLY  81           H        GLY  81   0.793  -2.626  -4.704
  597   1HA   GLY  81          1HA       GLY  81   0.883  -4.575  -6.849
  598   2HA   GLY  81          2HA       GLY  81   1.583  -2.954  -6.899
  599    H    CYS  82           H        CYS  82   3.318  -3.095  -4.708
  600    HA   CYS  82           HA       CYS  82   5.536  -4.635  -5.835
  601   1HB   CYS  82          1HB       CYS  82   5.481  -2.348  -4.559
  602   2HB   CYS  82          2HB       CYS  82   5.424  -3.342  -3.107
  603    H    HIS  83           H        HIS  83   3.099  -5.018  -3.417
  604    HA   HIS  83           HA       HIS  83   4.373  -7.112  -1.874
  605   1HB   HIS  83          1HB       HIS  83   1.716  -5.775  -2.157
  606   2HB   HIS  83          2HB       HIS  83   1.765  -7.303  -1.299
  607    HD1  HIS  83           HD1      HIS  83   1.293  -6.003   0.964
  608    HD2  HIS  83           HD2      HIS  83   4.874  -4.992  -0.914
  609    HE1  HIS  83           HE1      HIS  83   2.673  -4.762   2.682
  610    H    LEU  84           H        LEU  84   1.627  -7.188  -4.217
  611    HA   LEU  84           HA       LEU  84   1.341  -9.969  -4.444
  612   1HB   LEU  84          1HB       LEU  84   0.462  -7.591  -5.657
  613   2HB   LEU  84          2HB       LEU  84   1.130  -8.551  -6.971
  614    HG   LEU  84           HG       LEU  84  -0.677  -9.838  -4.958
  615   1HD1  LEU  84          1HD1      LEU  84  -1.863  -8.754  -7.472
  616   2HD1  LEU  84          2HD1      LEU  84  -1.575  -7.615  -6.156
  617   3HD1  LEU  84          3HD1      LEU  84  -2.613  -9.016  -5.898
  618   1HD2  LEU  84          1HD2      LEU  84  -1.087 -10.636  -7.674
  619   2HD2  LEU  84          2HD2      LEU  84  -0.379 -11.578  -6.361
  620   3HD2  LEU  84          3HD2      LEU  84   0.652 -10.576  -7.383
  621    H    GLU  85           H        GLU  85   3.750  -7.807  -5.857
  622    HA   GLU  85           HA       GLU  85   4.907  -9.908  -7.568
  623   1HB   GLU  85          1HB       GLU  85   5.694  -7.065  -6.846
  624   2HB   GLU  85          2HB       GLU  85   6.522  -8.043  -8.059
  625   1HG   GLU  85          1HG       GLU  85   3.616  -8.003  -8.424
  626   2HG   GLU  85          2HG       GLU  85   4.344  -6.401  -8.540
  627    H    THR  86           H        THR  86   5.995  -7.962  -4.754
  628    HA   THR  86           HA       THR  86   8.470  -9.252  -4.297
  629    HB   THR  86           HB       THR  86   6.412  -7.868  -2.575
  630    HG1  THR  86           1HG      THR  86   8.144  -6.346  -2.501
  631   1HG2  THR  86          1HG2      THR  86   9.126  -8.819  -1.622
  632   2HG2  THR  86          2HG2      THR  86   7.606  -9.612  -1.209
  633   3HG2  THR  86          3HG2      THR  86   7.910  -7.958  -0.677
  634    H    ALA  87           H        ALA  87   5.248 -10.430  -3.895
  635    HA   ALA  87           HA       ALA  87   5.986 -12.536  -1.965
  636   1HB   ALA  87          1HB       ALA  87   3.548 -11.451  -3.303
  637   2HB   ALA  87          2HB       ALA  87   3.810 -11.843  -1.604
  638   3HB   ALA  87          3HB       ALA  87   3.484 -13.130  -2.765
  639    H    GLY  88           H        GLY  88   5.318 -12.180  -5.415
  640   1HA   GLY  88          1HA       GLY  88   5.633 -13.658  -7.207
  641   2HA   GLY  88          2HA       GLY  88   6.856 -14.431  -6.197
  642    H    ALA  89           H        ALA  89   6.378 -16.583  -6.381
  643    HA   ALA  89           HA       ALA  89   3.571 -17.512  -6.294
  644   1HB   ALA  89          1HB       ALA  89   5.956 -19.309  -6.283
  645   2HB   ALA  89          2HB       ALA  89   5.700 -18.289  -7.698
  646   3HB   ALA  89          3HB       ALA  89   4.462 -19.444  -7.207
  647    H    ASP  90           H        ASP  90   4.269 -16.304  -3.872
  648    HA   ASP  90           HA       ASP  90   4.660 -18.640  -2.042
  649   1HB   ASP  90          1HB       ASP  90   6.476 -17.014  -1.990
  650   2HB   ASP  90          2HB       ASP  90   5.333 -15.696  -1.752
  651    H    ALA  91           H        ALA  91   2.306 -18.918  -2.308
  652    HA   ALA  91           HA       ALA  91   0.188 -17.240  -1.868
  653   1HB   ALA  91          1HB       ALA  91   0.671 -19.925  -0.531
  654   2HB   ALA  91          2HB       ALA  91   0.078 -19.693  -2.176
  655   3HB   ALA  91          3HB       ALA  91  -0.909 -19.189  -0.803
  656    H    ALA  92           H        ALA  92   2.623 -18.094   0.502
  657    HA   ALA  92           HA       ALA  92   1.146 -17.094   2.815
  658   1HB   ALA  92          1HB       ALA  92   3.351 -18.694   2.345
  659   2HB   ALA  92          2HB       ALA  92   2.915 -18.030   3.920
  660   3HB   ALA  92          3HB       ALA  92   4.092 -17.195   2.905
  661    H    LYS  93           H        LYS  93   3.626 -15.912   0.596
  662    HA   LYS  93           HA       LYS  93   3.977 -13.340   1.893
  663   1HB   LYS  93          1HB       LYS  93   4.810 -14.816  -0.533
  664   2HB   LYS  93          2HB       LYS  93   4.839 -13.065  -0.682
  665   1HG   LYS  93          1HG       LYS  93   6.145 -13.007   1.488
  666   2HG   LYS  93          2HG       LYS  93   6.269 -14.763   1.372
  667   1HD   LYS  93          1HD       LYS  93   7.095 -14.136  -1.104
  668   2HD   LYS  93          2HD       LYS  93   7.584 -12.656  -0.278
  669   1HE   LYS  93          1HE       LYS  93   9.247 -13.713   0.883
  670   2HE   LYS  93          2HE       LYS  93   8.259 -15.163   1.155
  671   1HZ   LYS  93          1HZ       LYS  93   9.396 -14.389  -1.478
  672   2HZ   LYS  93          2HZ       LYS  93   8.577 -15.830  -1.104
  673   3HZ   LYS  93          3HZ       LYS  93  10.109 -15.522  -0.437
  674    H    LYS  94           H        LYS  94   1.754 -14.717  -0.427
  675    HA   LYS  94           HA       LYS  94   0.824 -12.167  -1.515
  676   1HB   LYS  94          1HB       LYS  94   0.472 -15.000  -1.908
  677   2HB   LYS  94          2HB       LYS  94  -1.113 -14.230  -1.798
  678   1HG   LYS  94          1HG       LYS  94  -0.863 -13.207  -3.798
  679   2HG   LYS  94          2HG       LYS  94   0.770 -12.669  -3.401
  680   1HD   LYS  94          1HD       LYS  94   1.755 -14.632  -4.209
  681   2HD   LYS  94          2HD       LYS  94   0.265 -15.562  -4.050
  682   1HE   LYS  94          1HE       LYS  94  -0.253 -13.388  -5.842
  683   2HE   LYS  94          2HE       LYS  94   1.228 -14.210  -6.374
  684   1HZ   LYS  94          1HZ       LYS  94  -1.087 -15.177  -7.025
  685   2HZ   LYS  94          2HZ       LYS  94  -1.056 -15.813  -5.449
  686   3HZ   LYS  94          3HZ       LYS  94   0.165 -16.221  -6.559
  687    H    LYS  95           H        LYS  95   0.010 -14.217   1.214
  688    HA   LYS  95           HA       LYS  95  -2.516 -12.809   1.783
  689   1HB   LYS  95          1HB       LYS  95  -2.763 -14.485   3.419
  690   2HB   LYS  95          2HB       LYS  95  -1.793 -15.298   2.191
  691   1HG   LYS  95          1HG       LYS  95  -0.398 -15.769   3.924
  692   2HG   LYS  95          2HG       LYS  95   0.155 -14.110   3.699
  693   1HD   LYS  95          1HD       LYS  95  -0.481 -13.732   5.831
  694   2HD   LYS  95          2HD       LYS  95  -2.145 -13.847   5.255
  695   1HE   LYS  95          1HE       LYS  95  -0.518 -16.268   6.101
  696   2HE   LYS  95          2HE       LYS  95  -1.628 -15.404   7.184
  697   1HZ   LYS  95          1HZ       LYS  95  -2.758 -17.219   6.029
  698   2HZ   LYS  95          2HZ       LYS  95  -2.343 -16.537   4.529
  699   3HZ   LYS  95          3HZ       LYS  95  -3.399 -15.715   5.577
  700    H    GLU  96           H        GLU  96   0.847 -12.589   2.603
  701    HA   GLU  96           HA       GLU  96   0.372 -10.856   4.962
  702   1HB   GLU  96          1HB       GLU  96   2.762 -11.127   5.231
  703   2HB   GLU  96          2HB       GLU  96   2.116 -12.691   4.773
  704   1HG   GLU  96          1HG       GLU  96   2.782 -12.323   2.471
  705   2HG   GLU  96          2HG       GLU  96   3.345 -10.699   2.869
  706    H    LEU  97           H        LEU  97   1.843 -10.729   1.751
  707    HA   LEU  97           HA       LEU  97   2.429  -7.872   1.863
  708   1HB   LEU  97          1HB       LEU  97   2.343  -9.879  -0.400
  709   2HB   LEU  97          2HB       LEU  97   3.122  -8.296  -0.460
  710    HG   LEU  97           HG       LEU  97   3.887 -10.684   1.221
  711   1HD1  LEU  97          1HD1      LEU  97   6.155  -9.723   0.174
  712   2HD1  LEU  97          2HD1      LEU  97   5.021  -9.116  -1.032
  713   3HD1  LEU  97          3HD1      LEU  97   5.115 -10.845  -0.703
  714   1HD2  LEU  97          1HD2      LEU  97   3.906  -8.758   2.719
  715   2HD2  LEU  97          2HD2      LEU  97   4.753  -7.790   1.513
  716   3HD2  LEU  97          3HD2      LEU  97   5.569  -9.152   2.281
  717    H    THR  98           H        THR  98   0.347  -9.688  -0.410
  718    HA   THR  98           HA       THR  98  -1.235  -7.240  -0.874
  719    HB   THR  98           HB       THR  98  -2.300  -8.748  -2.590
  720    HG1  THR  98           1HG      THR  98  -2.034 -10.731  -1.699
  721   1HG2  THR  98          1HG2      THR  98   0.128  -7.483  -2.614
  722   2HG2  THR  98          2HG2      THR  98  -0.602  -8.254  -4.021
  723   3HG2  THR  98          3HG2      THR  98   0.587  -9.128  -3.053
  724    H    GLY  99           H        GLY  99  -1.474 -10.137   1.006
  725   1HA   GLY  99          1HA       GLY  99  -4.223 -10.594   1.140
  726   2HA   GLY  99          2HA       GLY  99  -3.152 -10.760   2.534
  727    H    CYS 100           H        CYS 100  -5.896  -9.283   1.675
  728    HA   CYS 100           HA       CYS 100  -5.383  -6.595   2.702
  729   1HB   CYS 100          1HB       CYS 100  -8.138  -7.606   2.713
  730   2HB   CYS 100          2HB       CYS 100  -7.490  -6.181   1.946
  731    H    LYS 101           H        LYS 101  -7.561  -9.164   3.853
  732    HA   LYS 101           HA       LYS 101  -7.215  -8.096   6.604
  733   1HB   LYS 101          1HB       LYS 101  -9.127 -10.150   5.441
  734   2HB   LYS 101          2HB       LYS 101  -9.237  -9.433   7.049
  735   1HG   LYS 101          1HG       LYS 101  -9.092  -7.568   4.724
  736   2HG   LYS 101          2HG       LYS 101 -10.605  -8.440   4.973
  737   1HD   LYS 101          1HD       LYS 101 -10.596  -7.657   7.358
  738   2HD   LYS 101          2HD       LYS 101  -9.183  -6.669   6.981
  739   1HE   LYS 101          1HE       LYS 101 -10.404  -5.256   5.532
  740   2HE   LYS 101          2HE       LYS 101 -11.719  -6.436   5.351
  741   1HZ   LYS 101          1HZ       LYS 101 -12.549  -4.974   6.933
  742   2HZ   LYS 101          2HZ       LYS 101 -11.044  -4.767   7.692
  743   3HZ   LYS 101          3HZ       LYS 101 -11.906  -6.219   7.888
  744    H    GLY 102           H        GLY 102  -5.528  -9.051   7.695
  745   1HA   GLY 102          1HA       GLY 102  -4.854 -11.077   8.944
  746   2HA   GLY 102          2HA       GLY 102  -5.294 -12.026   7.525
  747    H    SER 103           H        SER 103  -3.867  -9.333   6.302
  748    HA   SER 103           HA       SER 103  -1.358 -10.763   5.757
  749   1HB   SER 103          1HB       SER 103  -1.023  -8.838   4.245
  750   2HB   SER 103          2HB       SER 103  -2.622  -9.532   4.032
  751    HG   SER 103           HG       SER 103  -2.360  -7.127   4.325
  752    H    LYS 104           H        LYS 104   0.204  -8.319   5.509
  753    HA   LYS 104           HA       LYS 104   0.959  -7.939   8.373
  754   1HB   LYS 104          1HB       LYS 104   2.306  -7.415   5.704
  755   2HB   LYS 104          2HB       LYS 104   3.057  -7.124   7.272
  756   1HG   LYS 104          1HG       LYS 104   1.897  -9.823   6.928
  757   2HG   LYS 104          2HG       LYS 104   3.289  -9.471   5.903
  758   1HD   LYS 104          1HD       LYS 104   4.337  -8.535   8.123
  759   2HD   LYS 104          2HD       LYS 104   3.121  -9.549   8.901
  760   1HE   LYS 104          1HE       LYS 104   4.080 -11.526   8.133
  761   2HE   LYS 104          2HE       LYS 104   4.808 -10.741   6.717
  762   1HZ   LYS 104          1HZ       LYS 104   6.000  -9.361   8.588
  763   2HZ   LYS 104          2HZ       LYS 104   6.626 -10.851   8.066
  764   3HZ   LYS 104          3HZ       LYS 104   5.721 -10.762   9.501
  765    H    CYS 105           H        CYS 105  -0.144  -6.398   5.485
  766    HA   CYS 105           HA       CYS 105   0.321  -3.652   6.326
  767   1HB   CYS 105          1HB       CYS 105  -0.156  -5.119   4.013
  768   2HB   CYS 105          2HB       CYS 105  -1.639  -4.222   4.237
  769    H    HIS 106           H        HIS 106  -2.296  -5.987   6.615
  770    HA   HIS 106           HA       HIS 106  -4.015  -3.845   7.834
  771   1HB   HIS 106          1HB       HIS 106  -4.504  -6.136   5.984
  772   2HB   HIS 106          2HB       HIS 106  -5.789  -5.723   7.119
  773    HD1  HIS 106           HD1      HIS 106  -5.243  -2.629   7.142
  774    HD2  HIS 106           HD2      HIS 106  -5.697  -4.948   3.687
  775    HE1  HIS 106           HE1      HIS 106  -5.832  -1.024   5.282
  776    H    SER 107           H        SER 107  -2.746  -4.487   9.858
  777    HA   SER 107           HA       SER 107  -3.533  -7.133  10.981
  778   1HB   SER 107          1HB       SER 107  -1.156  -6.137  10.931
  779   2HB   SER 107          2HB       SER 107  -1.720  -5.029  12.177
  780    HG   SER 107           HG       SER 107  -0.824  -6.860  13.133
  781    HHA  HEC 201           HHA      HEC 201   6.019   8.658   5.627
  782    HHB  HEC 201           HHB      HEC 201  12.075   9.817   4.761
  783    HHC  HEC 201           HHC      HEC 201  12.594   4.632   1.140
  784    HHD  HEC 201           HHD      HEC 201   6.454   3.597   1.790
  785   1HMA  HEC 201          1HMA      HEC 201  10.105  11.983   6.455
  786   2HMA  HEC 201          2HMA      HEC 201  11.322  10.752   6.795
  787   3HMA  HEC 201          3HMA      HEC 201   9.865  10.853   7.789
  788   1HAA  HEC 201          1HAA      HEC 201   6.634   9.602   7.368
  789   2HAA  HEC 201          2HAA      HEC 201   7.878  10.757   7.835
  790   1HBA  HEC 201          1HBA      HEC 201   6.778  11.585   5.328
  791   2HBA  HEC 201          2HBA      HEC 201   5.448  11.266   6.441
  792   1HMB  HEC 201          1HMB      HEC 201  14.027   9.649   4.323
  793   2HMB  HEC 201          2HMB      HEC 201  14.822   9.318   2.783
  794   3HMB  HEC 201          3HMB      HEC 201  15.198   8.336   4.199
  795    HAB  HEC 201           HAB      HEC 201  14.477   5.408   1.325
  796   1HBB  HEC 201          1HBB      HEC 201  16.242   4.851   2.717
  797   2HBB  HEC 201          2HBB      HEC 201  15.028   5.255   3.931
  798   3HBB  HEC 201          3HBB      HEC 201  16.264   6.435   3.493
  799   1HMC  HEC 201          1HMC      HEC 201  11.573   1.688   0.668
  800   2HMC  HEC 201          2HMC      HEC 201  12.148   3.128  -0.172
  801   3HMC  HEC 201          3HMC      HEC 201  10.813   2.190  -0.842
  802    HAC  HEC 201           HAC      HEC 201   7.127   2.210   0.597
  803   1HBC  HEC 201          1HBC      HEC 201   8.374   0.142  -0.435
  804   2HBC  HEC 201          2HBC      HEC 201   8.298   0.328   1.317
  805   3HBC  HEC 201          3HBC      HEC 201   9.761   0.782   0.445
  806   1HMD  HEC 201          1HMD      HEC 201   4.627   3.373   3.101
  807   2HMD  HEC 201          2HMD      HEC 201   3.706   4.175   4.372
  808   3HMD  HEC 201          3HMD      HEC 201   3.447   4.616   2.683
  809   1HAD  HEC 201          1HAD      HEC 201   4.261   8.044   5.388
  810   2HAD  HEC 201          2HAD      HEC 201   3.277   7.501   4.035
  811   1HBD  HEC 201          1HBD      HEC 201   2.587   5.558   5.155
  812   2HBD  HEC 201          2HBD      HEC 201   3.916   5.642   6.309
  813    HHA  HEC 202           HHA      HEC 202   1.593   7.522  -9.578
  814    HHB  HEC 202           HHB      HEC 202   2.844   4.096  -4.829
  815    HHC  HEC 202           HHC      HEC 202   4.565   9.033  -1.353
  816    HHD  HEC 202           HHD      HEC 202   2.818  12.855  -5.962
  817   1HMA  HEC 202          1HMA      HEC 202   0.317   3.222  -7.354
  818   2HMA  HEC 202          2HMA      HEC 202   1.178   3.147  -5.818
  819   3HMA  HEC 202          3HMA      HEC 202   2.015   2.748  -7.319
  820   1HAA  HEC 202          1HAA      HEC 202   1.051   5.111 -10.034
  821   2HAA  HEC 202          2HAA      HEC 202  -0.059   4.335  -8.940
  822   1HBA  HEC 202          1HBA      HEC 202  -1.285   6.422  -8.647
  823   2HBA  HEC 202          2HBA      HEC 202  -0.160   7.249  -9.720
  824   1HMB  HEC 202          1HMB      HEC 202   4.869   3.754  -1.781
  825   2HMB  HEC 202          2HMB      HEC 202   4.125   3.314  -3.319
  826   3HMB  HEC 202          3HMB      HEC 202   3.115   3.610  -1.905
  827    HAB  HEC 202           HAB      HEC 202   4.130   6.979   0.030
  828   1HBB  HEC 202          1HBB      HEC 202   6.381   7.126   0.198
  829   2HBB  HEC 202          2HBB      HEC 202   6.592   6.313  -1.355
  830   3HBB  HEC 202          3HBB      HEC 202   6.432   5.365   0.123
  831   1HMC  HEC 202          1HMC      HEC 202   5.335  11.026  -0.947
  832   2HMC  HEC 202          2HMC      HEC 202   5.427  12.681  -1.551
  833   3HMC  HEC 202          3HMC      HEC 202   3.978  12.127  -0.712
  834    HAC  HEC 202           HAC      HEC 202   2.317  13.790  -3.820
  835   1HBC  HEC 202          1HBC      HEC 202   3.443  15.404  -2.527
  836   2HBC  HEC 202          2HBC      HEC 202   4.995  14.588  -2.696
  837   3HBC  HEC 202          3HBC      HEC 202   3.751  13.907  -1.650
  838   1HMD  HEC 202          1HMD      HEC 202   2.908  13.408  -8.500
  839   2HMD  HEC 202          2HMD      HEC 202   1.153  13.265  -8.589
  840   3HMD  HEC 202          3HMD      HEC 202   2.144  12.818  -9.978
  841   1HAD  HEC 202          1HAD      HEC 202   1.963   9.045 -10.851
  842   2HAD  HEC 202          2HAD      HEC 202   1.234  10.623 -11.078
  843   1HBD  HEC 202          1HBD      HEC 202   3.897  11.201 -10.502
  844   2HBD  HEC 202          2HBD      HEC 202   3.982   9.768 -11.528
  845    HHA  HEC 203           HHA      HEC 203   7.065  -6.935   4.598
  846    HHB  HEC 203           HHB      HEC 203   2.668  -2.192   4.835
  847    HHC  HEC 203           HHC      HEC 203   4.648  -0.017  -0.482
  848    HHD  HEC 203           HHD      HEC 203   8.989  -4.548  -0.920
  849   1HMA  HEC 203          1HMA      HEC 203   3.025  -5.200   7.460
  850   2HMA  HEC 203          2HMA      HEC 203   2.160  -4.008   6.489
  851   3HMA  HEC 203          3HMA      HEC 203   3.449  -3.492   7.576
  852   1HAA  HEC 203          1HAA      HEC 203   4.810  -6.205   7.675
  853   2HAA  HEC 203          2HAA      HEC 203   4.665  -7.410   6.403
  854   1HBA  HEC 203          1HBA      HEC 203   6.892  -7.826   6.382
  855   2HBA  HEC 203          2HBA      HEC 203   7.305  -6.115   6.511
  856   1HMB  HEC 203          1HMB      HEC 203   2.416   1.027   4.470
  857   2HMB  HEC 203          2HMB      HEC 203   1.736  -0.570   4.781
  858   3HMB  HEC 203          3HMB      HEC 203   1.118   0.408   3.450
  859    HAB  HEC 203           HAB      HEC 203   2.862   0.825   0.044
  860   1HBB  HEC 203          1HBB      HEC 203   3.457   3.019   0.370
  861   2HBB  HEC 203          2HBB      HEC 203   4.457   2.352   1.663
  862   3HBB  HEC 203          3HBB      HEC 203   2.869   3.019   2.032
  863   1HMC  HEC 203          1HMC      HEC 203   7.318   0.079  -2.882
  864   2HMC  HEC 203          2HMC      HEC 203   5.919  -0.812  -3.481
  865   3HMC  HEC 203          3HMC      HEC 203   5.726   0.361  -2.177
  866    HAC  HEC 203           HAC      HEC 203   9.245  -3.406  -2.538
  867   1HBC  HEC 203          1HBC      HEC 203   9.785  -1.727  -4.112
  868   2HBC  HEC 203          2HBC      HEC 203   9.192  -0.810  -2.727
  869   3HBC  HEC 203          3HBC      HEC 203   8.145  -1.083  -4.117
  870   1HMD  HEC 203          1HMD      HEC 203  10.066  -7.723   0.198
  871   2HMD  HEC 203          2HMD      HEC 203  11.056  -6.565   1.087
  872   3HMD  HEC 203          3HMD      HEC 203  10.280  -6.087  -0.423
  873   1HAD  HEC 203          1HAD      HEC 203  10.188  -7.884   3.079
  874   2HAD  HEC 203          2HAD      HEC 203   8.833  -7.853   4.202
  875   1HBD  HEC 203          1HBD      HEC 203   7.842  -9.055   1.852
  876   2HBD  HEC 203          2HBD      HEC 203   9.429  -9.774   2.126
  877    HHA  HEC 204           HHA      HEC 204  -6.793   2.065   4.097
  878    HHB  HEC 204           HHB      HEC 204  -9.974  -2.122   0.767
  879    HHC  HEC 204           HHC      HEC 204  -4.770  -5.947   0.912
  880    HHD  HEC 204           HHD      HEC 204  -1.433  -0.999   2.674
  881   1HMA  HEC 204          1HMA      HEC 204 -11.299  -0.716   1.207
  882   2HMA  HEC 204          2HMA      HEC 204 -10.912   0.978   0.893
  883   3HMA  HEC 204          3HMA      HEC 204 -11.639   0.507   2.431
  884   1HAA  HEC 204          1HAA      HEC 204 -10.162   1.987   4.326
  885   2HAA  HEC 204          2HAA      HEC 204  -8.583   2.716   4.037
  886   1HBA  HEC 204          1HBA      HEC 204  -9.218   3.280   1.751
  887   2HBA  HEC 204          2HBA      HEC 204 -10.760   2.457   1.950
  888   1HMB  HEC 204          1HMB      HEC 204  -9.619  -4.834  -1.617
  889   2HMB  HEC 204          2HMB      HEC 204 -10.443  -3.844  -0.415
  890   3HMB  HEC 204          3HMB      HEC 204 -10.177  -5.561  -0.110
  891    HAB  HEC 204           HAB      HEC 204  -6.387  -7.009   0.203
  892   1HBB  HEC 204          1HBB      HEC 204  -6.867  -7.535  -2.270
  893   2HBB  HEC 204          2HBB      HEC 204  -5.650  -6.307  -1.923
  894   3HBB  HEC 204          3HBB      HEC 204  -7.271  -5.825  -2.423
  895   1HMC  HEC 204          1HMC      HEC 204  -1.492  -6.227   2.202
  896   2HMC  HEC 204          2HMC      HEC 204  -2.961  -6.654   1.324
  897   3HMC  HEC 204          3HMC      HEC 204  -1.559  -6.040   0.448
  898    HAC  HEC 204           HAC      HEC 204  -0.357  -2.506   2.945
  899   1HBC  HEC 204          1HBC      HEC 204   0.198  -2.634   0.465
  900   2HBC  HEC 204          2HBC      HEC 204   0.455  -4.365   0.682
  901   3HBC  HEC 204          3HBC      HEC 204   1.476  -3.207   1.536
  902   1HMD  HEC 204          1HMD      HEC 204  -0.883   0.894   3.308
  903   2HMD  HEC 204          2HMD      HEC 204  -1.481   2.541   3.114
  904   3HMD  HEC 204          3HMD      HEC 204  -1.416   1.810   4.717
  905   1HAD  HEC 204          1HAD      HEC 204  -3.778   3.817   3.721
  906   2HAD  HEC 204          2HAD      HEC 204  -5.365   3.389   4.345
  907   1HBD  HEC 204          1HBD      HEC 204  -4.264   2.490   6.399
  908   2HBD  HEC 204          2HBD      HEC 204  -2.722   3.083   5.782
  Start of MODEL    7
    1   1H    ALA   1          1H        ALA   1  19.149  14.537   1.281
    2   2H    ALA   1          2H        ALA   1  20.565  15.274   1.862
    3   3H    ALA   1          3H        ALA   1  19.066  15.615   2.587
    4    HA   ALA   1           HA       ALA   1  20.048  12.835   2.539
    5   1HB   ALA   1          1HB       ALA   1  21.450  13.268   4.416
    6   2HB   ALA   1          2HB       ALA   1  20.759  14.873   4.657
    7   3HB   ALA   1          3HB       ALA   1  21.814  14.565   3.278
    8    HA   PRO   2           HA       PRO   2  15.973  13.503   4.566
    9   1HB   PRO   2          1HB       PRO   2  14.883  11.167   3.651
   10   2HB   PRO   2          2HB       PRO   2  14.859  12.671   2.719
   11   1HG   PRO   2          1HG       PRO   2  16.645  10.310   2.453
   12   2HG   PRO   2          2HG       PRO   2  15.946  11.343   1.196
   13   1HD   PRO   2          1HD       PRO   2  18.534  11.538   2.048
   14   2HD   PRO   2          2HD       PRO   2  17.616  12.899   1.364
   15    H    LYS   3           H        LYS   3  15.192  12.420   6.450
   16    HA   LYS   3           HA       LYS   3  17.004  10.262   7.462
   17   1HB   LYS   3          1HB       LYS   3  15.789  11.103   9.660
   18   2HB   LYS   3          2HB       LYS   3  17.179  11.962   9.003
   19   1HG   LYS   3          1HG       LYS   3  14.425  12.698   8.063
   20   2HG   LYS   3          2HG       LYS   3  14.984  13.290   9.626
   21   1HD   LYS   3          1HD       LYS   3  17.142  13.709   7.882
   22   2HD   LYS   3          2HD       LYS   3  15.712  14.193   6.967
   23   1HE   LYS   3          1HE       LYS   3  15.602  16.111   8.165
   24   2HE   LYS   3          2HE       LYS   3  15.447  15.170   9.662
   25   1HZ   LYS   3          1HZ       LYS   3  17.944  14.764   9.362
   26   2HZ   LYS   3          2HZ       LYS   3  17.453  16.285   9.938
   27   3HZ   LYS   3          3HZ       LYS   3  17.907  16.096   8.312
   28    H    ALA   4           H        ALA   4  15.752   8.596   6.441
   29    HA   ALA   4           HA       ALA   4  13.031   8.091   6.456
   30   1HB   ALA   4          1HB       ALA   4  14.892   5.921   7.370
   31   2HB   ALA   4          2HB       ALA   4  15.193   6.676   5.805
   32   3HB   ALA   4          3HB       ALA   4  13.654   5.869   6.113
   33    HA   PRO   5           HA       PRO   5  12.118   8.190  10.764
   34   1HB   PRO   5          1HB       PRO   5   9.479   7.481  10.565
   35   2HB   PRO   5          2HB       PRO   5  10.099   9.101  10.211
   36   1HG   PRO   5          1HG       PRO   5   9.201   6.990   8.361
   37   2HG   PRO   5          2HG       PRO   5   9.244   8.742   8.148
   38   1HD   PRO   5          1HD       PRO   5  11.069   6.889   7.084
   39   2HD   PRO   5          2HD       PRO   5  11.248   8.653   7.117
   40    H    ALA   6           H        ALA   6  11.526   6.718  12.472
   41    HA   ALA   6           HA       ALA   6  12.592   4.127  12.286
   42   1HB   ALA   6          1HB       ALA   6  10.449   4.478  14.261
   43   2HB   ALA   6          2HB       ALA   6  11.574   5.835  14.212
   44   3HB   ALA   6          3HB       ALA   6  12.172   4.205  14.516
   45    H    ASP   7           H        ASP   7  11.566   2.081  12.253
   46    HA   ASP   7           HA       ASP   7   9.453   1.716  10.365
   47   1HB   ASP   7          1HB       ASP   7  10.310  -0.211  12.532
   48   2HB   ASP   7          2HB       ASP   7   9.765  -0.586  10.901
   49    H    GLY   8           H        GLY   8   7.337   0.765  10.879
   50   1HA   GLY   8          1HA       GLY   8   5.485   0.326  12.343
   51   2HA   GLY   8          2HA       GLY   8   6.341   1.172  13.631
   52    H    LEU   9           H        LEU   9   6.216   2.704  10.513
   53    HA   LEU   9           HA       LEU   9   4.918   5.052  11.563
   54   1HB   LEU   9          1HB       LEU   9   6.333   4.331   9.297
   55   2HB   LEU   9          2HB       LEU   9   4.704   4.596   8.669
   56    HG   LEU   9           HG       LEU   9   5.692   6.597  10.625
   57   1HD1  LEU   9          1HD1      LEU   9   7.701   6.653   9.466
   58   2HD1  LEU   9          2HD1      LEU   9   6.742   7.740   8.461
   59   3HD1  LEU   9          3HD1      LEU   9   6.975   6.061   7.972
   60   1HD2  LEU   9          1HD2      LEU   9   3.540   6.991   9.679
   61   2HD2  LEU   9          2HD2      LEU   9   4.100   6.593   8.053
   62   3HD2  LEU   9          3HD2      LEU   9   4.628   8.091   8.822
   63    H    LYS  10           H        LYS  10   2.803   5.122  12.139
   64    HA   LYS  10           HA       LYS  10   0.901   3.187  10.960
   65   1HB   LYS  10          1HB       LYS  10   1.144   4.904  13.349
   66   2HB   LYS  10          2HB       LYS  10  -0.495   4.725  12.723
   67   1HG   LYS  10          1HG       LYS  10  -0.059   2.215  12.653
   68   2HG   LYS  10          2HG       LYS  10   1.392   2.535  13.602
   69   1HD   LYS  10          1HD       LYS  10   0.112   2.494  15.453
   70   2HD   LYS  10          2HD       LYS  10  -0.671   3.967  14.878
   71   1HE   LYS  10          1HE       LYS  10  -2.572   2.853  14.300
   72   2HE   LYS  10          2HE       LYS  10  -1.660   1.520  13.562
   73   1HZ   LYS  10          1HZ       LYS  10  -2.602   0.591  15.478
   74   2HZ   LYS  10          2HZ       LYS  10  -2.268   1.961  16.426
   75   3HZ   LYS  10          3HZ       LYS  10  -1.005   0.937  15.931
   76    H    MET  11           H        MET  11  -0.024   3.791   9.070
   77    HA   MET  11           HA       MET  11  -0.534   6.655   8.479
   78   1HB   MET  11          1HB       MET  11   0.081   4.270   7.034
   79   2HB   MET  11          2HB       MET  11  -1.514   4.807   6.505
   80   1HG   MET  11          1HG       MET  11   1.055   6.406   6.504
   81   2HG   MET  11          2HG       MET  11   0.101   5.913   5.106
   82   1HE   MET  11          1HE       MET  11   0.926   8.911   5.308
   83   2HE   MET  11          2HE       MET  11  -0.615   9.586   4.783
   84   3HE   MET  11          3HE       MET  11  -0.036   8.080   4.076
   85    H    ASP  12           H        ASP  12  -2.411   7.392   9.408
   86    HA   ASP  12           HA       ASP  12  -4.744   5.506   9.508
   87   1HB   ASP  12          1HB       ASP  12  -5.475   7.322  11.234
   88   2HB   ASP  12          2HB       ASP  12  -4.196   6.199  11.678
   89    H    LYS  13           H        LYS  13  -3.747   7.506   7.334
   90    HA   LYS  13           HA       LYS  13  -5.474   9.679   7.000
   91   1HB   LYS  13          1HB       LYS  13  -4.180   7.663   5.184
   92   2HB   LYS  13          2HB       LYS  13  -5.195   8.934   4.504
   93   1HG   LYS  13          1HG       LYS  13  -2.813   9.372   6.331
   94   2HG   LYS  13          2HG       LYS  13  -2.820   9.633   4.584
   95   1HD   LYS  13          1HD       LYS  13  -4.794  11.228   4.995
   96   2HD   LYS  13          2HD       LYS  13  -4.353  11.147   6.701
   97   1HE   LYS  13          1HE       LYS  13  -2.131  12.016   6.233
   98   2HE   LYS  13          2HE       LYS  13  -2.434  11.947   4.487
   99   1HZ   LYS  13          1HZ       LYS  13  -4.486  13.343   5.032
  100   2HZ   LYS  13          2HZ       LYS  13  -2.979  14.127   5.048
  101   3HZ   LYS  13          3HZ       LYS  13  -3.721  13.676   6.509
  102    H    THR  14           H        THR  14  -6.159   6.253   6.704
  103    HA   THR  14           HA       THR  14  -8.992   6.905   5.936
  104    HB   THR  14           HB       THR  14  -8.905   4.535   4.997
  105    HG1  THR  14           1HG      THR  14  -7.191   3.579   5.812
  106   1HG2  THR  14          1HG2      THR  14  -8.742   6.442   3.516
  107   2HG2  THR  14          2HG2      THR  14  -7.549   5.246   3.010
  108   3HG2  THR  14          3HG2      THR  14  -7.042   6.666   3.925
  109    H    LYS  15           H        LYS  15 -10.394   4.805   6.594
  110    HA   LYS  15           HA       LYS  15 -10.424   4.705   9.479
  111   1HB   LYS  15          1HB       LYS  15 -11.916   3.640   7.156
  112   2HB   LYS  15          2HB       LYS  15 -12.012   2.646   8.610
  113   1HG   LYS  15          1HG       LYS  15 -13.444   4.099   9.554
  114   2HG   LYS  15          2HG       LYS  15 -12.293   5.418   9.336
  115   1HD   LYS  15          1HD       LYS  15 -14.120   6.143   8.063
  116   2HD   LYS  15          2HD       LYS  15 -13.103   5.370   6.847
  117   1HE   LYS  15          1HE       LYS  15 -14.444   3.379   6.852
  118   2HE   LYS  15          2HE       LYS  15 -15.320   3.898   8.306
  119   1HZ   LYS  15          1HZ       LYS  15 -16.632   4.437   6.380
  120   2HZ   LYS  15          2HZ       LYS  15 -15.325   5.247   5.658
  121   3HZ   LYS  15          3HZ       LYS  15 -16.049   5.877   7.059
  122    H    GLN  16           H        GLN  16  -8.906   2.783   6.999
  123    HA   GLN  16           HA       GLN  16  -8.230   0.641   8.972
  124   1HB   GLN  16          1HB       GLN  16  -8.329   0.907   5.971
  125   2HB   GLN  16          2HB       GLN  16  -7.383  -0.385   6.709
  126   1HG   GLN  16          1HG       GLN  16  -9.274  -1.581   6.937
  127   2HG   GLN  16          2HG       GLN  16  -9.869  -0.357   8.059
  128   1HE2  GLN  16          2HE2      GLN  16 -10.269  -1.689   4.878
  129   2HE2  GLN  16          1HE2      GLN  16 -11.449  -0.594   4.339
  130    HA   PRO  17           HA       PRO  17  -4.486   3.323   8.788
  131   1HB   PRO  17          1HB       PRO  17  -3.776   2.864  11.396
  132   2HB   PRO  17          2HB       PRO  17  -4.913   4.135  10.903
  133   1HG   PRO  17          1HG       PRO  17  -5.478   1.410  11.982
  134   2HG   PRO  17          2HG       PRO  17  -6.252   2.958  12.366
  135   1HD   PRO  17          1HD       PRO  17  -7.385   1.163  10.702
  136   2HD   PRO  17          2HD       PRO  17  -7.580   2.918  10.478
  137    H    VAL  18           H        VAL  18  -2.670   2.401   7.957
  138    HA   VAL  18           HA       VAL  18  -1.970  -0.393   8.775
  139    HB   VAL  18           HB       VAL  18  -1.673   1.245   6.250
  140   1HG1  VAL  18          1HG1      VAL  18   0.458   0.038   6.781
  141   2HG1  VAL  18          2HG1      VAL  18  -0.322  -0.535   5.307
  142   3HG1  VAL  18          3HG1      VAL  18  -0.451  -1.473   6.796
  143   1HG2  VAL  18          1HG2      VAL  18  -3.312  -1.016   7.205
  144   2HG2  VAL  18          2HG2      VAL  18  -2.613  -1.255   5.603
  145   3HG2  VAL  18          3HG2      VAL  18  -3.639   0.145   5.918
  146    H    VAL  19           H        VAL  19   0.044  -0.708   9.661
  147    HA   VAL  19           HA       VAL  19   1.715   1.664  10.218
  148    HB   VAL  19           HB       VAL  19   1.887  -1.255  11.027
  149   1HG1  VAL  19          1HG1      VAL  19   3.978  -0.513  11.619
  150   2HG1  VAL  19          2HG1      VAL  19   3.097   0.109  13.014
  151   3HG1  VAL  19          3HG1      VAL  19   3.479   1.177  11.665
  152   1HG2  VAL  19          1HG2      VAL  19   0.319  -0.831  12.598
  153   2HG2  VAL  19          2HG2      VAL  19  -0.042   0.641  11.697
  154   3HG2  VAL  19          3HG2      VAL  19   1.086   0.690  13.052
  155    H    PHE  20           H        PHE  20   3.266   2.180   8.657
  156    HA   PHE  20           HA       PHE  20   4.348   0.055   6.903
  157   1HB   PHE  20          1HB       PHE  20   3.719   2.276   6.013
  158   2HB   PHE  20          2HB       PHE  20   4.887   3.039   7.092
  159    HD1  PHE  20           HD1      PHE  20   4.878   0.102   4.751
  160    HD2  PHE  20           HD2      PHE  20   6.886   3.661   6.056
  161    HE1  PHE  20           HE1      PHE  20   6.682  -0.302   3.098
  162    HE2  PHE  20           HE2      PHE  20   8.683   3.256   4.409
  163    HZ   PHE  20           HZ       PHE  20   8.587   1.276   2.928
  164    H    ASN  21           H        ASN  21   6.435  -0.771   7.078
  165    HA   ASN  21           HA       ASN  21   8.087   0.228   9.364
  166   1HB   ASN  21          1HB       ASN  21   7.026  -2.306   8.600
  167   2HB   ASN  21          2HB       ASN  21   8.774  -2.382   8.432
  168   1HD2  ASN  21          2HD2      ASN  21   6.478  -0.910  10.805
  169   2HD2  ASN  21          1HD2      ASN  21   7.304  -1.480  12.173
  170    H    HIS  22           H        HIS  22   9.367   1.727   8.140
  171    HA   HIS  22           HA       HIS  22  10.448   1.434   5.579
  172   1HB   HIS  22          1HB       HIS  22  11.309   2.738   8.140
  173   2HB   HIS  22          2HB       HIS  22  12.418   2.753   6.770
  174    HD1  HIS  22           HD1      HIS  22   9.592   4.543   8.158
  175    HD2  HIS  22           HD2      HIS  22  11.046   3.871   4.306
  176    HE1  HIS  22           HE1      HIS  22   8.589   6.343   6.691
  177    H    SER  23           H        SER  23  11.565  -0.009   8.625
  178    HA   SER  23           HA       SER  23  14.100  -0.968   7.921
  179   1HB   SER  23          1HB       SER  23  13.546  -1.506  10.086
  180   2HB   SER  23          2HB       SER  23  11.852  -1.775   9.686
  181    HG   SER  23           HG       SER  23  13.437  -3.632  10.213
  182    H    THR  24           H        THR  24  10.918  -2.409   7.182
  183    HA   THR  24           HA       THR  24  12.041  -4.676   5.736
  184    HB   THR  24           HB       THR  24   9.286  -3.831   5.145
  185    HG1  THR  24           1HG      THR  24   8.636  -4.181   7.331
  186   1HG2  THR  24          1HG2      THR  24   9.221  -6.067   4.934
  187   2HG2  THR  24          2HG2      THR  24   9.398  -6.197   6.684
  188   3HG2  THR  24          3HG2      THR  24  10.826  -6.216   5.650
  189    H    HIS  25           H        HIS  25  11.721  -1.393   5.018
  190    HA   HIS  25           HA       HIS  25  11.687  -1.930   2.080
  191   1HB   HIS  25          1HB       HIS  25  10.813   0.488   3.691
  192   2HB   HIS  25          2HB       HIS  25  10.618   0.268   1.954
  193    HD1  HIS  25           HD1      HIS  25   9.366  -1.025   5.255
  194    HD2  HIS  25           HD2      HIS  25   8.556  -1.532   1.197
  195    HE1  HIS  25           HE1      HIS  25   7.234  -2.383   5.114
  196    H    LYS  26           H        LYS  26  13.638  -0.981   4.663
  197    HA   LYS  26           HA       LYS  26  15.171   1.185   3.700
  198   1HB   LYS  26          1HB       LYS  26  16.792   0.413   5.281
  199   2HB   LYS  26          2HB       LYS  26  15.237  -0.112   5.925
  200   1HG   LYS  26          1HG       LYS  26  15.563  -2.351   5.056
  201   2HG   LYS  26          2HG       LYS  26  17.031  -1.854   4.213
  202   1HD   LYS  26          1HD       LYS  26  18.152  -1.401   6.324
  203   2HD   LYS  26          2HD       LYS  26  16.670  -1.737   7.220
  204   1HE   LYS  26          1HE       LYS  26  17.347  -3.947   5.440
  205   2HE   LYS  26          2HE       LYS  26  18.651  -3.607   6.596
  206   1HZ   LYS  26          1HZ       LYS  26  17.311  -3.981   8.378
  207   2HZ   LYS  26          2HZ       LYS  26  16.560  -5.037   7.281
  208   3HZ   LYS  26          3HZ       LYS  26  15.898  -3.500   7.575
  209    H    ALA  27           H        ALA  27  15.045  -2.150   2.662
  210    HA   ALA  27           HA       ALA  27  17.486  -1.888   0.996
  211   1HB   ALA  27          1HB       ALA  27  15.531  -4.088   1.699
  212   2HB   ALA  27          2HB       ALA  27  17.233  -3.965   2.146
  213   3HB   ALA  27          3HB       ALA  27  16.782  -4.314   0.477
  214    H    VAL  28           H        VAL  28  14.232  -1.117   0.753
  215    HA   VAL  28           HA       VAL  28  13.799  -1.894  -2.043
  216    HB   VAL  28           HB       VAL  28  12.356  -0.207   0.009
  217   1HG1  VAL  28          1HG1      VAL  28  10.458  -0.188  -1.614
  218   2HG1  VAL  28          2HG1      VAL  28  11.545  -0.847  -2.837
  219   3HG1  VAL  28          3HG1      VAL  28  11.842   0.754  -2.159
  220   1HG2  VAL  28          1HG2      VAL  28  10.850  -2.046   0.153
  221   2HG2  VAL  28          2HG2      VAL  28  12.459  -2.767   0.142
  222   3HG2  VAL  28          3HG2      VAL  28  11.480  -2.770  -1.326
  223    H    LYS  29           H        LYS  29  13.023   0.092  -3.497
  224    HA   LYS  29           HA       LYS  29  15.315   1.957  -3.533
  225   1HB   LYS  29          1HB       LYS  29  13.479   0.755  -5.402
  226   2HB   LYS  29          2HB       LYS  29  13.487   2.510  -5.593
  227   1HG   LYS  29          1HG       LYS  29  15.299   2.000  -6.921
  228   2HG   LYS  29          2HG       LYS  29  16.114   2.153  -5.362
  229   1HD   LYS  29          1HD       LYS  29  16.694  -0.025  -5.371
  230   2HD   LYS  29          2HD       LYS  29  15.035  -0.520  -5.707
  231   1HE   LYS  29          1HE       LYS  29  16.990   0.482  -7.809
  232   2HE   LYS  29          2HE       LYS  29  16.573  -1.222  -7.536
  233   1HZ   LYS  29          1HZ       LYS  29  14.920   0.946  -8.602
  234   2HZ   LYS  29          2HZ       LYS  29  14.154  -0.219  -7.631
  235   3HZ   LYS  29          3HZ       LYS  29  14.971  -0.691  -9.045
  236    H    CYS  30           H        CYS  30  15.005   3.580  -2.110
  237    HA   CYS  30           HA       CYS  30  12.668   4.720  -1.100
  238   1HB   CYS  30          1HB       CYS  30  15.372   5.855  -1.830
  239   2HB   CYS  30          2HB       CYS  30  14.142   6.868  -1.077
  240    H    GLY  31           H        GLY  31  14.011   4.974  -4.300
  241   1HA   GLY  31          1HA       GLY  31  12.279   7.233  -5.057
  242   2HA   GLY  31          2HA       GLY  31  13.416   6.398  -6.119
  243    H    ASP  32           H        ASP  32  12.052   3.813  -4.894
  244    HA   ASP  32           HA       ASP  32  10.160   3.512  -7.111
  245   1HB   ASP  32          1HB       ASP  32  11.764   1.898  -5.469
  246   2HB   ASP  32          2HB       ASP  32  10.116   1.458  -5.043
  247    H    CYS  33           H        CYS  33  10.079   4.091  -3.642
  248    HA   CYS  33           HA       CYS  33   7.105   3.967  -3.567
  249   1HB   CYS  33          1HB       CYS  33   9.356   4.309  -1.566
  250   2HB   CYS  33          2HB       CYS  33   7.676   4.574  -1.105
  251    H    HIS  34           H        HIS  34   9.675   6.260  -2.560
  252    HA   HIS  34           HA       HIS  34   7.846   8.565  -2.863
  253   1HB   HIS  34          1HB       HIS  34  10.757   8.205  -2.063
  254   2HB   HIS  34          2HB       HIS  34   9.949   9.764  -2.100
  255    HD1  HIS  34           HD1      HIS  34   7.573   9.738  -0.588
  256    HD2  HIS  34           HD2      HIS  34  10.557   6.999   0.399
  257    HE1  HIS  34           HE1      HIS  34   7.132   9.021   1.802
  258    H    HIS  35           H        HIS  35   8.254   7.194  -5.310
  259    HA   HIS  35           HA       HIS  35  10.265   7.646  -7.044
  260   1HB   HIS  35          1HB       HIS  35   8.423   8.285  -8.727
  261   2HB   HIS  35          2HB       HIS  35   8.221   6.774  -7.859
  262    HD1  HIS  35           HD1      HIS  35   7.053  10.312  -7.862
  263    HD2  HIS  35           HD2      HIS  35   5.941   6.668  -6.205
  264    HE1  HIS  35           HE1      HIS  35   4.787  10.685  -6.805
  265    HA   PRO  36           HA       PRO  36  11.436  11.831  -7.159
  266   1HB   PRO  36          1HB       PRO  36  12.192  12.080  -9.783
  267   2HB   PRO  36          2HB       PRO  36  13.153  11.214  -8.567
  268   1HG   PRO  36          1HG       PRO  36  11.273  10.129 -10.614
  269   2HG   PRO  36          2HG       PRO  36  12.860   9.525 -10.110
  270   1HD   PRO  36          1HD       PRO  36  10.560   8.418  -9.238
  271   2HD   PRO  36          2HD       PRO  36  12.021   8.494  -8.225
  272    H    VAL  37           H        VAL  37   9.563  13.044  -6.853
  273    HA   VAL  37           HA       VAL  37   7.740  13.531  -9.147
  274    HB   VAL  37           HB       VAL  37   7.765  14.072  -6.179
  275   1HG1  VAL  37          1HG1      VAL  37   6.294  15.524  -8.311
  276   2HG1  VAL  37          2HG1      VAL  37   6.736  16.054  -6.688
  277   3HG1  VAL  37          3HG1      VAL  37   5.334  15.010  -6.923
  278   1HG2  VAL  37          1HG2      VAL  37   6.954  11.894  -6.826
  279   2HG2  VAL  37          2HG2      VAL  37   5.947  12.588  -8.096
  280   3HG2  VAL  37          3HG2      VAL  37   5.545  12.867  -6.402
  281    H    ASN  38           H        ASN  38   7.425  15.722  -9.931
  282    HA   ASN  38           HA       ASN  38   8.290  17.831 -10.628
  283   1HB   ASN  38          1HB       ASN  38   7.481  17.963  -8.178
  284   2HB   ASN  38          2HB       ASN  38   9.175  17.950  -7.751
  285   1HD2  ASN  38          2HD2      ASN  38   9.539  19.436 -10.541
  286   2HD2  ASN  38          1HD2      ASN  38   9.239  21.052 -10.119
  287    H    GLY  39           H        GLY  39  10.218  15.399 -10.504
  288   1HA   GLY  39          1HA       GLY  39  12.468  15.294 -11.296
  289   2HA   GLY  39          2HA       GLY  39  12.680  16.988 -10.844
  290    H    LYS  40           H        LYS  40  11.164  15.855  -8.235
  291    HA   LYS  40           HA       LYS  40  13.659  14.766  -6.957
  292   1HB   LYS  40          1HB       LYS  40  11.784  16.755  -5.665
  293   2HB   LYS  40          2HB       LYS  40  13.430  16.341  -5.187
  294   1HG   LYS  40          1HG       LYS  40  13.829  17.181  -7.758
  295   2HG   LYS  40          2HG       LYS  40  12.491  18.219  -7.264
  296   1HD   LYS  40          1HD       LYS  40  14.819  17.853  -5.405
  297   2HD   LYS  40          2HD       LYS  40  14.974  18.958  -6.773
  298   1HE   LYS  40          1HE       LYS  40  13.025  20.231  -6.026
  299   2HE   LYS  40          2HE       LYS  40  12.747  19.078  -4.707
  300   1HZ   LYS  40          1HZ       LYS  40  14.738  19.653  -3.674
  301   2HZ   LYS  40          2HZ       LYS  40  14.120  21.153  -4.181
  302   3HZ   LYS  40          3HZ       LYS  40  15.364  20.402  -5.062
  303    H    GLU  41           H        GLU  41  13.267  13.079  -5.515
  304    HA   GLU  41           HA       GLU  41  10.651  11.828  -5.479
  305   1HB   GLU  41          1HB       GLU  41  13.281  11.416  -4.047
  306   2HB   GLU  41          2HB       GLU  41  11.880  10.401  -3.710
  307   1HG   GLU  41          1HG       GLU  41  11.861   9.493  -5.874
  308   2HG   GLU  41          2HG       GLU  41  12.788  10.832  -6.549
  309    H    ASP  42           H        ASP  42   8.992  12.735  -4.283
  310    HA   ASP  42           HA       ASP  42   9.410  14.485  -2.034
  311   1HB   ASP  42          1HB       ASP  42   7.054  12.844  -2.990
  312   2HB   ASP  42          2HB       ASP  42   6.955  14.059  -1.718
  313    H    TYR  43           H        TYR  43  10.628  13.535  -0.405
  314    HA   TYR  43           HA       TYR  43  10.123  10.799   0.512
  315   1HB   TYR  43          1HB       TYR  43  11.808  13.066   1.633
  316   2HB   TYR  43          2HB       TYR  43  11.930  11.370   2.100
  317    HD1  TYR  43           HD1      TYR  43  12.940  13.888  -0.272
  318    HD2  TYR  43           HD2      TYR  43  12.529   9.648   0.301
  319    HE1  TYR  43           HE1      TYR  43  14.489  13.481  -2.165
  320    HE2  TYR  43           HE2      TYR  43  14.078   9.243  -1.591
  321    HH   TYR  43           HH       TYR  43  15.645  11.949  -3.294
  322    H    GLN  44           H        GLN  44   7.698  11.795   0.827
  323    HA   GLN  44           HA       GLN  44   7.495  12.450   3.745
  324   1HB   GLN  44          1HB       GLN  44   5.545  13.951   2.971
  325   2HB   GLN  44          2HB       GLN  44   7.175  14.525   2.622
  326   1HG   GLN  44          1HG       GLN  44   6.954  13.393   0.350
  327   2HG   GLN  44          2HG       GLN  44   5.243  13.185   0.720
  328   1HE2  GLN  44          2HE2      GLN  44   7.650  15.875   0.989
  329   2HE2  GLN  44          1HE2      GLN  44   6.619  17.052   0.331
  330    H    LYS  45           H        LYS  45   5.170  12.059   4.518
  331    HA   LYS  45           HA       LYS  45   4.346   9.438   4.293
  332   1HB   LYS  45          1HB       LYS  45   3.050  12.048   4.894
  333   2HB   LYS  45          2HB       LYS  45   1.978  10.670   4.646
  334   1HG   LYS  45          1HG       LYS  45   2.985   9.434   6.415
  335   2HG   LYS  45          2HG       LYS  45   4.359  10.537   6.501
  336   1HD   LYS  45          1HD       LYS  45   2.005  12.098   6.845
  337   2HD   LYS  45          2HD       LYS  45   1.863  10.695   7.905
  338   1HE   LYS  45          1HE       LYS  45   4.072  11.171   8.879
  339   2HE   LYS  45          2HE       LYS  45   4.264  12.558   7.785
  340   1HZ   LYS  45          1HZ       LYS  45   1.899  13.135   8.726
  341   2HZ   LYS  45          2HZ       LYS  45   3.305  13.596   9.562
  342   3HZ   LYS  45          3HZ       LYS  45   2.434  12.221  10.051
  343    H    CYS  46           H        CYS  46   3.565   8.216   2.645
  344    HA   CYS  46           HA       CYS  46   3.289   8.868  -0.003
  345   1HB   CYS  46          1HB       CYS  46   1.557   7.043   1.679
  346   2HB   CYS  46          2HB       CYS  46   1.678   6.956  -0.075
  347    H    ALA  47           H        ALA  47   0.777   9.255   2.472
  348    HA   ALA  47           HA       ALA  47  -0.996  10.627   0.515
  349   1HB   ALA  47          1HB       ALA  47  -2.511   9.506   1.745
  350   2HB   ALA  47          2HB       ALA  47  -2.087  10.517   3.124
  351   3HB   ALA  47          3HB       ALA  47  -1.249   8.989   2.862
  352    H    THR  48           H        THR  48   1.083  12.267   0.850
  353    HA   THR  48           HA       THR  48   1.316  13.931   3.067
  354    HB   THR  48           HB       THR  48   1.346  15.268   0.439
  355    HG1  THR  48           1HG      THR  48   2.998  13.952  -0.338
  356   1HG2  THR  48          1HG2      THR  48   3.247  16.224   1.281
  357   2HG2  THR  48          2HG2      THR  48   3.797  14.721   2.023
  358   3HG2  THR  48          3HG2      THR  48   2.554  15.692   2.813
  359    H    ALA  49           H        ALA  49   0.599  16.470   2.618
  360    HA   ALA  49           HA       ALA  49  -2.283  16.471   3.082
  361   1HB   ALA  49          1HB       ALA  49  -1.901  18.801   3.551
  362   2HB   ALA  49          2HB       ALA  49  -0.391  18.788   2.643
  363   3HB   ALA  49          3HB       ALA  49  -0.508  17.916   4.171
  364    H    GLY  50           H        GLY  50  -2.184  15.443   0.639
  365   1HA   GLY  50          1HA       GLY  50  -3.840  16.551  -1.085
  366   2HA   GLY  50          2HA       GLY  50  -2.483  17.652  -1.335
  367    H    CYS  51           H        CYS  51  -0.992  14.896  -0.584
  368    HA   CYS  51           HA       CYS  51  -0.309  14.285  -3.356
  369   1HB   CYS  51          1HB       CYS  51   0.809  14.155  -0.797
  370   2HB   CYS  51          2HB       CYS  51   0.664  12.476  -1.283
  371    H    HIS  52           H        HIS  52  -0.885  11.779  -0.916
  372    HA   HIS  52           HA       HIS  52  -2.827  10.494  -2.798
  373   1HB   HIS  52          1HB       HIS  52  -0.783   9.471  -0.833
  374   2HB   HIS  52          2HB       HIS  52  -2.059   8.433  -1.424
  375    HD1  HIS  52           HD1      HIS  52  -2.231   8.903  -4.264
  376    HD2  HIS  52           HD2      HIS  52   1.459   9.007  -2.365
  377    HE1  HIS  52           HE1      HIS  52  -0.494   8.481  -6.068
  378    H    ASP  53           H        ASP  53  -3.720  12.509  -1.033
  379    HA   ASP  53           HA       ASP  53  -4.849  11.095   1.329
  380   1HB   ASP  53          1HB       ASP  53  -5.192  13.308   2.175
  381   2HB   ASP  53          2HB       ASP  53  -3.622  13.342   1.373
  382    H    ASN  54           H        ASN  54  -5.908  10.687  -1.514
  383    HA   ASN  54           HA       ASN  54  -8.493  12.077  -1.530
  384   1HB   ASN  54          1HB       ASN  54  -6.883  10.924  -3.405
  385   2HB   ASN  54          2HB       ASN  54  -8.050   9.629  -3.151
  386   1HD2  ASN  54          2HD2      ASN  54  -9.611   9.798  -4.766
  387   2HD2  ASN  54          1HD2      ASN  54 -10.345  11.247  -5.259
  388    H    MET  55           H        MET  55  -9.800  11.474   0.198
  389    HA   MET  55           HA       MET  55  -9.849   8.741   1.222
  390   1HB   MET  55          1HB       MET  55 -11.094  11.393   1.777
  391   2HB   MET  55          2HB       MET  55 -11.948   9.973   2.381
  392   1HG   MET  55          1HG       MET  55 -10.465   9.747   4.056
  393   2HG   MET  55          2HG       MET  55  -9.133   9.680   2.902
  394   1HE   MET  55          1HE       MET  55  -7.618  10.418   4.035
  395   2HE   MET  55          2HE       MET  55  -7.677  11.647   5.296
  396   3HE   MET  55          3HE       MET  55  -7.081  12.068   3.693
  397    H    ASP  56           H        ASP  56 -10.550   8.857  -1.582
  398    HA   ASP  56           HA       ASP  56 -13.476   8.216  -1.510
  399   1HB   ASP  56          1HB       ASP  56 -12.227  10.051  -3.013
  400   2HB   ASP  56          2HB       ASP  56 -11.940   8.647  -4.040
  401    H    LYS  57           H        LYS  57 -10.328   6.911  -1.832
  402    HA   LYS  57           HA       LYS  57  -9.541   4.790  -2.529
  403   1HB   LYS  57          1HB       LYS  57 -12.341   3.991  -1.717
  404   2HB   LYS  57          2HB       LYS  57 -10.865   3.043  -1.557
  405   1HG   LYS  57          1HG       LYS  57 -10.244   4.112   0.350
  406   2HG   LYS  57          2HG       LYS  57 -10.798   5.680  -0.227
  407   1HD   LYS  57          1HD       LYS  57 -13.135   4.157   0.061
  408   2HD   LYS  57          2HD       LYS  57 -12.170   3.778   1.487
  409   1HE   LYS  57          1HE       LYS  57 -11.950   6.150   2.030
  410   2HE   LYS  57          2HE       LYS  57 -12.792   6.597   0.533
  411   1HZ   LYS  57          1HZ       LYS  57 -14.667   5.183   1.301
  412   2HZ   LYS  57          2HZ       LYS  57 -14.398   6.545   2.281
  413   3HZ   LYS  57          3HZ       LYS  57 -13.882   5.011   2.794
  414    H    LYS  58           H        LYS  58 -11.203   6.491  -4.485
  415    HA   LYS  58           HA       LYS  58 -11.853   4.260  -6.383
  416   1HB   LYS  58          1HB       LYS  58 -13.288   6.908  -5.984
  417   2HB   LYS  58          2HB       LYS  58 -13.745   5.651  -7.134
  418   1HG   LYS  58          1HG       LYS  58 -13.455   4.467  -4.534
  419   2HG   LYS  58          2HG       LYS  58 -14.515   5.871  -4.408
  420   1HD   LYS  58          1HD       LYS  58 -15.711   4.939  -6.489
  421   2HD   LYS  58          2HD       LYS  58 -14.841   3.438  -6.166
  422   1HE   LYS  58          1HE       LYS  58 -15.770   3.670  -3.742
  423   2HE   LYS  58          2HE       LYS  58 -16.931   4.799  -4.467
  424   1HZ   LYS  58          1HZ       LYS  58 -17.485   2.291  -4.468
  425   2HZ   LYS  58          2HZ       LYS  58 -16.378   2.206  -5.754
  426   3HZ   LYS  58          3HZ       LYS  58 -17.758   3.189  -5.881
  427    H    ASP  59           H        ASP  59 -10.348   7.352  -5.810
  428    HA   ASP  59           HA       ASP  59 -10.058   8.262  -8.513
  429   1HB   ASP  59          1HB       ASP  59  -9.676   9.755  -6.692
  430   2HB   ASP  59          2HB       ASP  59  -8.536   8.647  -5.927
  431    H    LYS  60           H        LYS  60  -9.299   6.659  -9.940
  432    HA   LYS  60           HA       LYS  60  -7.054   4.915  -9.271
  433   1HB   LYS  60          1HB       LYS  60  -8.936   5.438 -11.514
  434   2HB   LYS  60          2HB       LYS  60  -7.391   4.710 -11.956
  435   1HG   LYS  60          1HG       LYS  60  -9.201   3.038 -11.408
  436   2HG   LYS  60          2HG       LYS  60  -7.741   2.871 -10.431
  437   1HD   LYS  60          1HD       LYS  60  -8.867   4.321  -8.682
  438   2HD   LYS  60          2HD       LYS  60 -10.351   4.174  -9.623
  439   1HE   LYS  60          1HE       LYS  60 -10.169   1.677  -9.445
  440   2HE   LYS  60          2HE       LYS  60  -8.776   1.901  -8.367
  441   1HZ   LYS  60          1HZ       LYS  60 -11.494   3.035  -7.959
  442   2HZ   LYS  60          2HZ       LYS  60 -10.154   3.306  -6.949
  443   3HZ   LYS  60          3HZ       LYS  60 -10.819   1.747  -7.085
  444    H    SER  61           H        SER  61  -7.045   8.132  -9.770
  445    HA   SER  61           HA       SER  61  -4.940   8.388 -11.786
  446   1HB   SER  61          1HB       SER  61  -6.867   9.996 -10.615
  447   2HB   SER  61          2HB       SER  61  -5.375  10.595  -9.896
  448    HG   SER  61           HG       SER  61  -6.062  11.497 -12.009
  449    H    ALA  62           H        ALA  62  -3.286  10.294 -10.464
  450    HA   ALA  62           HA       ALA  62  -1.695   8.468  -8.728
  451   1HB   ALA  62          1HB       ALA  62   0.001   9.350  -9.926
  452   2HB   ALA  62          2HB       ALA  62  -0.441  10.976  -9.404
  453   3HB   ALA  62          3HB       ALA  62  -1.180  10.281 -10.846
  454    H    LYS  63           H        LYS  63  -4.103  10.011  -7.757
  455    HA   LYS  63           HA       LYS  63  -2.705  11.564  -5.606
  456   1HB   LYS  63          1HB       LYS  63  -4.127  12.655  -7.660
  457   2HB   LYS  63          2HB       LYS  63  -5.408  12.419  -6.469
  458   1HG   LYS  63          1HG       LYS  63  -2.919  13.533  -5.352
  459   2HG   LYS  63          2HG       LYS  63  -3.718  14.583  -6.522
  460   1HD   LYS  63          1HD       LYS  63  -5.747  13.485  -4.858
  461   2HD   LYS  63          2HD       LYS  63  -4.460  14.066  -3.800
  462   1HE   LYS  63          1HE       LYS  63  -5.118  16.200  -4.158
  463   2HE   LYS  63          2HE       LYS  63  -4.885  15.991  -5.905
  464   1HZ   LYS  63          1HZ       LYS  63  -7.289  15.378  -4.291
  465   2HZ   LYS  63          2HZ       LYS  63  -7.045  14.688  -5.824
  466   3HZ   LYS  63          3HZ       LYS  63  -7.170  16.374  -5.658
  467    H    GLY  64           H        GLY  64  -4.638   8.943  -6.290
  468   1HA   GLY  64          1HA       GLY  64  -6.479   9.240  -4.028
  469   2HA   GLY  64          2HA       GLY  64  -6.376   7.847  -5.094
  470    H    TYR  65           H        TYR  65  -6.274   8.216  -2.070
  471    HA   TYR  65           HA       TYR  65  -3.612   7.407  -1.233
  472   1HB   TYR  65          1HB       TYR  65  -5.441   8.604   0.101
  473   2HB   TYR  65          2HB       TYR  65  -6.247   7.040   0.212
  474    HD1  TYR  65           HD1      TYR  65  -5.995   6.385   2.461
  475    HD2  TYR  65           HD2      TYR  65  -2.591   7.803   0.263
  476    HE1  TYR  65           HE1      TYR  65  -4.510   5.713   4.330
  477    HE2  TYR  65           HE2      TYR  65  -1.105   7.134   2.131
  478    HH   TYR  65           HH       TYR  65  -2.433   5.837   5.158
  479    H    TYR  66           H        TYR  66  -6.735   5.670  -1.495
  480    HA   TYR  66           HA       TYR  66  -5.525   3.095  -0.892
  481   1HB   TYR  66          1HB       TYR  66  -7.725   3.255  -0.210
  482   2HB   TYR  66          2HB       TYR  66  -8.175   4.282  -1.569
  483    HD1  TYR  66           HD1      TYR  66  -8.072   3.151  -3.931
  484    HD2  TYR  66           HD2      TYR  66  -8.361   1.015  -0.220
  485    HE1  TYR  66           HE1      TYR  66  -8.967   1.172  -5.142
  486    HE2  TYR  66           HE2      TYR  66  -9.246  -0.966  -1.424
  487    HH   TYR  66           HH       TYR  66  -9.461  -1.020  -4.964
  488    H    HIS  67           H        HIS  67  -5.583   5.000  -3.694
  489    HA   HIS  67           HA       HIS  67  -5.858   2.826  -5.647
  490   1HB   HIS  67          1HB       HIS  67  -6.519   4.979  -6.372
  491   2HB   HIS  67          2HB       HIS  67  -5.086   5.744  -5.680
  492    HD1  HIS  67           HD1      HIS  67  -5.910   3.171  -8.372
  493    HD2  HIS  67           HD2      HIS  67  -3.056   6.088  -7.529
  494    HE1  HIS  67           HE1      HIS  67  -4.318   3.202 -10.338
  495    H    ALA  68           H        ALA  68  -3.118   5.060  -5.109
  496    HA   ALA  68           HA       ALA  68  -1.134   3.511  -6.354
  497   1HB   ALA  68          1HB       ALA  68   0.368   4.833  -4.722
  498   2HB   ALA  68          2HB       ALA  68  -1.132   5.490  -4.067
  499   3HB   ALA  68          3HB       ALA  68  -0.708   5.774  -5.756
  500    H    MET  69           H        MET  69  -2.730   2.895  -3.328
  501    HA   MET  69           HA       MET  69  -0.536   1.225  -2.282
  502   1HB   MET  69          1HB       MET  69  -3.340   1.846  -1.332
  503   2HB   MET  69          2HB       MET  69  -2.129   0.976  -0.394
  504   1HG   MET  69          1HG       MET  69  -1.113   3.487  -1.494
  505   2HG   MET  69          2HG       MET  69  -2.479   3.724  -0.408
  506   1HE   MET  69          1HE       MET  69   0.615   4.163  -0.792
  507   2HE   MET  69          2HE       MET  69   1.654   3.543   0.489
  508   3HE   MET  69          3HE       MET  69   0.546   4.870   0.829
  509    H    HIS  70           H        HIS  70  -3.874   0.713  -3.485
  510    HA   HIS  70           HA       HIS  70  -3.408  -2.214  -3.350
  511   1HB   HIS  70          1HB       HIS  70  -5.862  -0.622  -4.139
  512   2HB   HIS  70          2HB       HIS  70  -5.812  -2.326  -3.685
  513    HD1  HIS  70           HD1      HIS  70  -6.044   1.062  -2.280
  514    HD2  HIS  70           HD2      HIS  70  -5.113  -2.740  -0.862
  515    HE1  HIS  70           HE1      HIS  70  -6.191   1.188   0.241
  516    H    ASP  71           H        ASP  71  -3.444   0.385  -5.635
  517    HA   ASP  71           HA       ASP  71  -4.014  -1.293  -7.971
  518   1HB   ASP  71          1HB       ASP  71  -3.020   1.548  -7.590
  519   2HB   ASP  71          2HB       ASP  71  -3.562   0.869  -9.120
  520    H    LYS  72           H        LYS  72  -2.464  -2.601  -8.844
  521    HA   LYS  72           HA       LYS  72   0.375  -2.242  -8.185
  522   1HB   LYS  72          1HB       LYS  72   0.589  -4.371  -9.369
  523   2HB   LYS  72          2HB       LYS  72  -0.818  -4.439  -8.307
  524   1HG   LYS  72          1HG       LYS  72  -2.202  -3.692 -10.323
  525   2HG   LYS  72          2HG       LYS  72  -0.774  -4.034 -11.302
  526   1HD   LYS  72          1HD       LYS  72  -2.359  -5.973  -9.604
  527   2HD   LYS  72          2HD       LYS  72  -2.102  -6.026 -11.348
  528   1HE   LYS  72          1HE       LYS  72   0.229  -6.571 -11.075
  529   2HE   LYS  72          2HE       LYS  72   0.159  -6.243  -9.333
  530   1HZ   LYS  72          1HZ       LYS  72  -1.696  -7.956  -9.299
  531   2HZ   LYS  72          2HZ       LYS  72  -0.117  -8.550  -9.507
  532   3HZ   LYS  72          3HZ       LYS  72  -1.163  -8.421 -10.841
  533    H    GLY  73           H        GLY  73  -1.632  -2.123 -11.134
  534   1HA   GLY  73          1HA       GLY  73   0.556  -1.408 -12.879
  535   2HA   GLY  73          2HA       GLY  73  -1.158  -1.220 -13.259
  536    H    THR  74           H        THR  74   1.156   0.211 -10.938
  537    HA   THR  74           HA       THR  74  -0.085   2.879 -11.495
  538    HB   THR  74           HB       THR  74   1.064   3.319  -9.212
  539    HG1  THR  74           1HG      THR  74   2.309   1.307  -9.496
  540   1HG2  THR  74          1HG2      THR  74  -1.236   1.412  -9.635
  541   2HG2  THR  74          2HG2      THR  74  -1.303   3.128  -9.236
  542   3HG2  THR  74          3HG2      THR  74  -0.769   1.961  -8.025
  543    H    LYS  75           H        LYS  75   1.439   4.734 -11.429
  544    HA   LYS  75           HA       LYS  75   3.524   4.795 -13.204
  545   1HB   LYS  75          1HB       LYS  75   2.465   6.621 -11.717
  546   2HB   LYS  75          2HB       LYS  75   3.659   6.162 -10.508
  547   1HG   LYS  75          1HG       LYS  75   4.322   8.091 -12.031
  548   2HG   LYS  75          2HG       LYS  75   5.474   6.764 -11.931
  549   1HD   LYS  75          1HD       LYS  75   4.731   5.859 -14.038
  550   2HD   LYS  75          2HD       LYS  75   3.376   6.988 -14.102
  551   1HE   LYS  75          1HE       LYS  75   5.946   8.356 -13.764
  552   2HE   LYS  75          2HE       LYS  75   5.859   7.417 -15.268
  553   1HZ   LYS  75          1HZ       LYS  75   3.625   9.130 -14.348
  554   2HZ   LYS  75          2HZ       LYS  75   3.876   8.473 -15.894
  555   3HZ   LYS  75          3HZ       LYS  75   4.865   9.736 -15.334
  556    H    PHE  76           H        PHE  76   3.813   3.955  -9.752
  557    HA   PHE  76           HA       PHE  76   6.468   2.680 -10.354
  558   1HB   PHE  76          1HB       PHE  76   5.531   4.123  -7.859
  559   2HB   PHE  76          2HB       PHE  76   7.135   3.451  -8.124
  560    HD1  PHE  76           HD1      PHE  76   8.493   4.355 -10.127
  561    HD2  PHE  76           HD2      PHE  76   4.957   6.260  -8.610
  562    HE1  PHE  76           HE1      PHE  76   9.121   6.453 -11.291
  563    HE2  PHE  76           HE2      PHE  76   5.585   8.355  -9.767
  564    HZ   PHE  76           HZ       PHE  76   7.660   8.446 -11.106
  565    H    LYS  77           H        LYS  77   6.996   1.154  -8.293
  566    HA   LYS  77           HA       LYS  77   4.871  -0.826  -8.251
  567   1HB   LYS  77          1HB       LYS  77   6.418  -1.994  -6.732
  568   2HB   LYS  77          2HB       LYS  77   7.251  -1.417  -8.172
  569   1HG   LYS  77          1HG       LYS  77   7.899   0.641  -6.827
  570   2HG   LYS  77          2HG       LYS  77   7.294  -0.204  -5.403
  571   1HD   LYS  77          1HD       LYS  77   9.764  -0.502  -5.752
  572   2HD   LYS  77          2HD       LYS  77   8.870  -2.020  -5.743
  573   1HE   LYS  77          1HE       LYS  77   9.164  -0.713  -8.400
  574   2HE   LYS  77          2HE       LYS  77  10.633  -1.418  -7.698
  575   1HZ   LYS  77          1HZ       LYS  77   8.622  -2.810  -8.925
  576   2HZ   LYS  77          2HZ       LYS  77   8.333  -3.058  -7.269
  577   3HZ   LYS  77          3HZ       LYS  77   9.838  -3.469  -7.943
  578    H    SER  78           H        SER  78   3.123  -0.492  -7.111
  579    HA   SER  78           HA       SER  78   2.925   1.357  -4.874
  580   1HB   SER  78          1HB       SER  78   0.562   0.084  -4.953
  581   2HB   SER  78          2HB       SER  78   1.007   1.303  -6.144
  582    HG   SER  78           HG       SER  78   0.493  -1.289  -6.508
  583    H    CYS  79           H        CYS  79   1.607   0.479  -2.883
  584    HA   CYS  79           HA       CYS  79   3.223  -1.300  -1.369
  585   1HB   CYS  79          1HB       CYS  79   0.281  -0.612  -1.081
  586   2HB   CYS  79          2HB       CYS  79   1.347  -1.161   0.209
  587    H    VAL  80           H        VAL  80  -0.136  -1.953  -2.392
  588    HA   VAL  80           HA       VAL  80   0.100  -4.815  -2.118
  589    HB   VAL  80           HB       VAL  80  -1.798  -2.906  -3.491
  590   1HG1  VAL  80          1HG1      VAL  80  -2.632  -4.596  -4.709
  591   2HG1  VAL  80          2HG1      VAL  80  -3.045  -5.421  -3.205
  592   3HG1  VAL  80          3HG1      VAL  80  -1.492  -5.730  -3.982
  593   1HG2  VAL  80          1HG2      VAL  80  -2.428  -2.761  -1.299
  594   2HG2  VAL  80          2HG2      VAL  80  -1.569  -4.236  -0.863
  595   3HG2  VAL  80          3HG2      VAL  80  -3.178  -4.332  -1.578
  596    H    GLY  81           H        GLY  81   0.797  -2.543  -4.695
  597   1HA   GLY  81          1HA       GLY  81   0.873  -4.477  -6.850
  598   2HA   GLY  81          2HA       GLY  81   1.586  -2.861  -6.890
  599    H    CYS  82           H        CYS  82   3.310  -3.066  -4.672
  600    HA   CYS  82           HA       CYS  82   5.507  -4.629  -5.838
  601   1HB   CYS  82          1HB       CYS  82   5.491  -2.319  -4.590
  602   2HB   CYS  82          2HB       CYS  82   5.471  -3.299  -3.127
  603    H    HIS  83           H        HIS  83   3.060  -4.995  -3.443
  604    HA   HIS  83           HA       HIS  83   4.358  -7.067  -1.867
  605   1HB   HIS  83          1HB       HIS  83   1.711  -5.705  -2.117
  606   2HB   HIS  83          2HB       HIS  83   1.754  -7.230  -1.252
  607    HD1  HIS  83           HD1      HIS  83   1.342  -5.936   1.019
  608    HD2  HIS  83           HD2      HIS  83   4.885  -4.930  -0.931
  609    HE1  HIS  83           HE1      HIS  83   2.755  -4.694   2.706
  610    H    LEU  84           H        LEU  84   1.537  -7.166  -4.123
  611    HA   LEU  84           HA       LEU  84   1.262  -9.948  -4.329
  612   1HB   LEU  84          1HB       LEU  84   0.322  -7.588  -5.521
  613   2HB   LEU  84          2HB       LEU  84   0.964  -8.538  -6.856
  614    HG   LEU  84           HG       LEU  84  -0.780  -9.834  -4.788
  615   1HD1  LEU  84          1HD1      LEU  84  -2.766  -9.190  -5.892
  616   2HD1  LEU  84          2HD1      LEU  84  -1.893  -8.617  -7.313
  617   3HD1  LEU  84          3HD1      LEU  84  -1.832  -7.696  -5.809
  618   1HD2  LEU  84          1HD2      LEU  84   0.230 -11.384  -6.280
  619   2HD2  LEU  84          2HD2      LEU  84  -0.025 -10.332  -7.672
  620   3HD2  LEU  84          3HD2      LEU  84  -1.395 -11.150  -6.922
  621    H    GLU  85           H        GLU  85   3.684  -7.812  -5.715
  622    HA   GLU  85           HA       GLU  85   4.758  -9.897  -7.512
  623   1HB   GLU  85          1HB       GLU  85   5.448  -7.033  -6.811
  624   2HB   GLU  85          2HB       GLU  85   6.443  -7.996  -7.903
  625   1HG   GLU  85          1HG       GLU  85   4.344  -8.443  -9.255
  626   2HG   GLU  85          2HG       GLU  85   3.535  -7.234  -8.258
  627    H    THR  86           H        THR  86   5.927  -8.002  -4.695
  628    HA   THR  86           HA       THR  86   8.406  -9.332  -4.336
  629    HB   THR  86           HB       THR  86   6.448  -7.851  -2.593
  630    HG1  THR  86           1HG      THR  86   8.244  -7.092  -4.158
  631   1HG2  THR  86          1HG2      THR  86   9.060  -9.031  -1.609
  632   2HG2  THR  86          2HG2      THR  86   7.465  -9.654  -1.187
  633   3HG2  THR  86          3HG2      THR  86   7.941  -8.033  -0.681
  634    H    ALA  87           H        ALA  87   5.182 -10.456  -3.827
  635    HA   ALA  87           HA       ALA  87   5.967 -12.582  -1.932
  636   1HB   ALA  87          1HB       ALA  87   3.497 -11.407  -3.110
  637   2HB   ALA  87          2HB       ALA  87   3.827 -11.881  -1.443
  638   3HB   ALA  87          3HB       ALA  87   3.406 -13.105  -2.642
  639    H    GLY  88           H        GLY  88   5.103 -12.207  -5.341
  640   1HA   GLY  88          1HA       GLY  88   5.300 -13.690  -7.147
  641   2HA   GLY  88          2HA       GLY  88   6.552 -14.495  -6.198
  642    H    ALA  89           H        ALA  89   5.960 -16.633  -6.484
  643    HA   ALA  89           HA       ALA  89   3.148 -17.468  -6.172
  644   1HB   ALA  89          1HB       ALA  89   3.934 -19.488  -7.064
  645   2HB   ALA  89          2HB       ALA  89   5.546 -19.264  -6.385
  646   3HB   ALA  89          3HB       ALA  89   5.037 -18.313  -7.778
  647    H    ASP  90           H        ASP  90   4.002 -16.316  -3.795
  648    HA   ASP  90           HA       ASP  90   4.468 -18.674  -2.013
  649   1HB   ASP  90          1HB       ASP  90   6.318 -17.084  -2.068
  650   2HB   ASP  90          2HB       ASP  90   5.219 -15.750  -1.734
  651    H    ALA  91           H        ALA  91   2.104 -18.910  -2.107
  652    HA   ALA  91           HA       ALA  91   0.047 -17.200  -1.537
  653   1HB   ALA  91          1HB       ALA  91  -1.039 -19.114  -0.481
  654   2HB   ALA  91          2HB       ALA  91   0.526 -19.848  -0.134
  655   3HB   ALA  91          3HB       ALA  91  -0.025 -19.694  -1.802
  656    H    ALA  92           H        ALA  92   2.611 -18.100   0.684
  657    HA   ALA  92           HA       ALA  92   1.311 -17.048   3.078
  658   1HB   ALA  92          1HB       ALA  92   3.494 -18.658   2.437
  659   2HB   ALA  92          2HB       ALA  92   3.106 -18.061   4.051
  660   3HB   ALA  92          3HB       ALA  92   4.242 -17.176   3.033
  661    H    LYS  93           H        LYS  93   3.674 -15.928   0.704
  662    HA   LYS  93           HA       LYS  93   4.101 -13.338   1.960
  663   1HB   LYS  93          1HB       LYS  93   4.874 -14.872  -0.451
  664   2HB   LYS  93          2HB       LYS  93   4.940 -13.125  -0.623
  665   1HG   LYS  93          1HG       LYS  93   6.318 -13.016   1.456
  666   2HG   LYS  93          2HG       LYS  93   6.305 -14.779   1.516
  667   1HD   LYS  93          1HD       LYS  93   8.046 -14.842   0.094
  668   2HD   LYS  93          2HD       LYS  93   7.079 -14.005  -1.121
  669   1HE   LYS  93          1HE       LYS  93   8.448 -12.215  -0.881
  670   2HE   LYS  93          2HE       LYS  93   7.848 -12.038   0.780
  671   1HZ   LYS  93          1HZ       LYS  93  10.309 -12.441   0.568
  672   2HZ   LYS  93          2HZ       LYS  93   9.932 -14.006   0.023
  673   3HZ   LYS  93          3HZ       LYS  93   9.482 -13.516   1.586
  674    H    LYS  94           H        LYS  94   1.837 -14.735  -0.308
  675    HA   LYS  94           HA       LYS  94   0.911 -12.191  -1.419
  676   1HB   LYS  94          1HB       LYS  94   0.480 -15.054  -1.715
  677   2HB   LYS  94          2HB       LYS  94  -1.052 -14.180  -1.731
  678   1HG   LYS  94          1HG       LYS  94   0.443 -12.557  -3.317
  679   2HG   LYS  94          2HG       LYS  94   1.177 -14.118  -3.684
  680   1HD   LYS  94          1HD       LYS  94  -1.465 -14.780  -3.749
  681   2HD   LYS  94          2HD       LYS  94  -1.531 -13.113  -4.323
  682   1HE   LYS  94          1HE       LYS  94   0.410 -13.786  -5.909
  683   2HE   LYS  94          2HE       LYS  94  -0.060 -15.457  -5.537
  684   1HZ   LYS  94          1HZ       LYS  94  -2.147 -15.169  -6.417
  685   2HZ   LYS  94          2HZ       LYS  94  -1.241 -14.179  -7.459
  686   3HZ   LYS  94          3HZ       LYS  94  -2.141 -13.488  -6.195
  687    H    LYS  95           H        LYS  95   0.190 -14.163   1.370
  688    HA   LYS  95           HA       LYS  95  -2.356 -12.781   1.949
  689   1HB   LYS  95          1HB       LYS  95  -2.465 -14.380   3.750
  690   2HB   LYS  95          2HB       LYS  95  -1.809 -15.236   2.356
  691   1HG   LYS  95          1HG       LYS  95   0.067 -15.719   3.493
  692   2HG   LYS  95          2HG       LYS  95   0.350 -14.008   3.800
  693   1HD   LYS  95          1HD       LYS  95  -1.345 -14.181   5.686
  694   2HD   LYS  95          2HD       LYS  95  -1.287 -15.930   5.465
  695   1HE   LYS  95          1HE       LYS  95   1.405 -15.193   5.558
  696   2HE   LYS  95          2HE       LYS  95   0.637 -14.190   6.805
  697   1HZ   LYS  95          1HZ       LYS  95  -0.615 -16.310   7.411
  698   2HZ   LYS  95          2HZ       LYS  95   1.018 -16.214   7.871
  699   3HZ   LYS  95          3HZ       LYS  95   0.567 -17.132   6.515
  700    H    GLU  96           H        GLU  96   1.011 -12.493   2.666
  701    HA   GLU  96           HA       GLU  96   0.574 -10.790   5.056
  702   1HB   GLU  96          1HB       GLU  96   2.989 -11.002   5.241
  703   2HB   GLU  96          2HB       GLU  96   2.336 -12.582   4.846
  704   1HG   GLU  96          1HG       GLU  96   2.913 -12.281   2.518
  705   2HG   GLU  96          2HG       GLU  96   3.463 -10.636   2.838
  706    H    LEU  97           H        LEU  97   1.949 -10.623   1.807
  707    HA   LEU  97           HA       LEU  97   2.490  -7.756   1.921
  708   1HB   LEU  97          1HB       LEU  97   2.381  -9.750  -0.353
  709   2HB   LEU  97          2HB       LEU  97   3.137  -8.158  -0.417
  710    HG   LEU  97           HG       LEU  97   3.977 -10.554   1.211
  711   1HD1  LEU  97          1HD1      LEU  97   6.189  -9.876   0.164
  712   2HD1  LEU  97          2HD1      LEU  97   5.271  -8.734  -0.818
  713   3HD1  LEU  97          3HD1      LEU  97   4.964 -10.464  -0.958
  714   1HD2  LEU  97          1HD2      LEU  97   4.168  -8.885   2.852
  715   2HD2  LEU  97          2HD2      LEU  97   4.503  -7.624   1.665
  716   3HD2  LEU  97          3HD2      LEU  97   5.745  -8.808   2.067
  717    H    THR  98           H        THR  98   0.365  -9.602  -0.289
  718    HA   THR  98           HA       THR  98  -1.249  -7.172  -0.736
  719    HB   THR  98           HB       THR  98  -2.359  -8.696  -2.391
  720    HG1  THR  98           1HG      THR  98  -1.925 -10.757  -2.357
  721   1HG2  THR  98          1HG2      THR  98  -0.687  -8.248  -3.859
  722   2HG2  THR  98          2HG2      THR  98   0.492  -9.174  -2.931
  723   3HG2  THR  98          3HG2      THR  98   0.122  -7.511  -2.477
  724    H    GLY  99           H        GLY  99  -1.315  -9.765   1.452
  725   1HA   GLY  99          1HA       GLY  99  -4.046 -10.427   1.638
  726   2HA   GLY  99          2HA       GLY  99  -2.948 -10.402   3.017
  727    H    CYS 100           H        CYS 100  -5.781  -9.149   2.015
  728    HA   CYS 100           HA       CYS 100  -5.425  -6.380   2.896
  729   1HB   CYS 100          1HB       CYS 100  -8.121  -7.530   2.765
  730   2HB   CYS 100          2HB       CYS 100  -7.499  -6.090   2.010
  731    H    LYS 101           H        LYS 101  -7.543  -8.997   4.076
  732    HA   LYS 101           HA       LYS 101  -7.524  -7.674   6.739
  733   1HB   LYS 101          1HB       LYS 101  -9.591  -8.378   5.361
  734   2HB   LYS 101          2HB       LYS 101  -9.189 -10.025   5.847
  735   1HG   LYS 101          1HG       LYS 101  -9.157  -9.172   8.251
  736   2HG   LYS 101          2HG       LYS 101  -9.887  -7.688   7.635
  737   1HD   LYS 101          1HD       LYS 101 -11.602  -9.328   6.507
  738   2HD   LYS 101          2HD       LYS 101 -11.042 -10.459   7.738
  739   1HE   LYS 101          1HE       LYS 101 -11.748  -9.026   9.520
  740   2HE   LYS 101          2HE       LYS 101 -11.986  -7.657   8.415
  741   1HZ   LYS 101          1HZ       LYS 101 -13.410 -10.235   8.086
  742   2HZ   LYS 101          2HZ       LYS 101 -13.762  -8.743   7.351
  743   3HZ   LYS 101          3HZ       LYS 101 -14.050  -8.965   9.011
  744    H    GLY 102           H        GLY 102  -5.393  -9.658   5.512
  745   1HA   GLY 102          1HA       GLY 102  -4.977 -11.080   8.050
  746   2HA   GLY 102          2HA       GLY 102  -5.285 -12.129   6.666
  747    H    SER 103           H        SER 103  -3.486  -9.065   6.599
  748    HA   SER 103           HA       SER 103  -1.062 -10.637   5.833
  749   1HB   SER 103          1HB       SER 103  -0.851  -9.241   4.042
  750   2HB   SER 103          2HB       SER 103  -2.577  -9.082   4.267
  751    HG   SER 103           HG       SER 103  -2.137  -7.042   4.520
  752    H    LYS 104           H        LYS 104   0.440  -8.135   5.637
  753    HA   LYS 104           HA       LYS 104   1.043  -7.726   8.533
  754   1HB   LYS 104          1HB       LYS 104   2.492  -7.147   5.929
  755   2HB   LYS 104          2HB       LYS 104   3.169  -6.863   7.532
  756   1HG   LYS 104          1HG       LYS 104   2.084  -9.583   7.086
  757   2HG   LYS 104          2HG       LYS 104   3.522  -9.180   6.147
  758   1HD   LYS 104          1HD       LYS 104   4.694  -8.510   8.207
  759   2HD   LYS 104          2HD       LYS 104   3.257  -8.895   9.155
  760   1HE   LYS 104          1HE       LYS 104   3.439 -11.261   8.083
  761   2HE   LYS 104          2HE       LYS 104   5.105 -10.785   7.696
  762   1HZ   LYS 104          1HZ       LYS 104   4.483 -11.808  10.033
  763   2HZ   LYS 104          2HZ       LYS 104   4.101 -10.190  10.378
  764   3HZ   LYS 104          3HZ       LYS 104   5.671 -10.608   9.878
  765    H    CYS 105           H        CYS 105  -0.009  -6.227   5.612
  766    HA   CYS 105           HA       CYS 105   0.376  -3.466   6.432
  767   1HB   CYS 105          1HB       CYS 105  -0.025  -4.966   4.132
  768   2HB   CYS 105          2HB       CYS 105  -1.536  -4.113   4.322
  769    H    HIS 106           H        HIS 106  -2.178  -5.856   6.728
  770    HA   HIS 106           HA       HIS 106  -3.961  -3.750   7.916
  771   1HB   HIS 106          1HB       HIS 106  -4.385  -6.012   6.011
  772   2HB   HIS 106          2HB       HIS 106  -5.697  -5.635   7.130
  773    HD1  HIS 106           HD1      HIS 106  -5.080  -2.509   7.181
  774    HD2  HIS 106           HD2      HIS 106  -5.679  -4.822   3.743
  775    HE1  HIS 106           HE1      HIS 106  -5.695  -0.895   5.336
  776    H    SER 107           H        SER 107  -2.327  -4.753   9.755
  777    HA   SER 107           HA       SER 107  -2.814  -7.307  10.881
  778   1HB   SER 107          1HB       SER 107  -2.367  -4.911  12.619
  779   2HB   SER 107          2HB       SER 107  -1.544  -6.468  12.633
  780    HG   SER 107           HG       SER 107  -0.261  -4.748  11.769
  781    HHA  HEC 201           HHA      HEC 201   5.942   8.611   5.561
  782    HHB  HEC 201           HHB      HEC 201  12.090   9.770   4.795
  783    HHC  HEC 201           HHC      HEC 201  12.558   4.646   1.037
  784    HHD  HEC 201           HHD      HEC 201   6.499   3.526   1.838
  785   1HMA  HEC 201          1HMA      HEC 201   9.771  10.582   7.969
  786   2HMA  HEC 201          2HMA      HEC 201  10.160  11.803   6.755
  787   3HMA  HEC 201          3HMA      HEC 201  11.287  10.484   7.069
  788   1HAA  HEC 201          1HAA      HEC 201   6.448   9.759   7.153
  789   2HAA  HEC 201          2HAA      HEC 201   7.764  10.724   7.822
  790   1HBA  HEC 201          1HBA      HEC 201   6.711  11.512   5.149
  791   2HBA  HEC 201          2HBA      HEC 201   5.694  11.849   6.552
  792   1HMB  HEC 201          1HMB      HEC 201  15.263   8.318   4.047
  793   2HMB  HEC 201          2HMB      HEC 201  14.738   9.441   2.794
  794   3HMB  HEC 201          3HMB      HEC 201  14.073   9.563   4.423
  795    HAB  HEC 201           HAB      HEC 201  14.417   5.527   1.121
  796   1HBB  HEC 201          1HBB      HEC 201  16.682   5.733   2.291
  797   2HBB  HEC 201          2HBB      HEC 201  15.431   4.868   3.184
  798   3HBB  HEC 201          3HBB      HEC 201  15.820   6.536   3.605
  799   1HMC  HEC 201          1HMC      HEC 201  11.189   1.540   0.233
  800   2HMC  HEC 201          2HMC      HEC 201  11.060   2.714  -1.077
  801   3HMC  HEC 201          3HMC      HEC 201  12.283   2.922   0.177
  802    HAC  HEC 201           HAC      HEC 201   7.128   2.182   0.628
  803   1HBC  HEC 201          1HBC      HEC 201   9.588   0.685  -0.295
  804   2HBC  HEC 201          2HBC      HEC 201   7.954   0.051  -0.104
  805   3HBC  HEC 201          3HBC      HEC 201   8.897   0.498   1.316
  806   1HMD  HEC 201          1HMD      HEC 201   3.996   3.798   4.347
  807   2HMD  HEC 201          2HMD      HEC 201   3.463   4.539   2.836
  808   3HMD  HEC 201          3HMD      HEC 201   4.764   3.349   2.829
  809   1HAD  HEC 201          1HAD      HEC 201   4.265   7.736   5.643
  810   2HAD  HEC 201          2HAD      HEC 201   3.254   7.273   4.279
  811   1HBD  HEC 201          1HBD      HEC 201   4.087   5.125   6.175
  812   2HBD  HEC 201          2HBD      HEC 201   2.857   6.266   6.717
  813    HHA  HEC 202           HHA      HEC 202   1.438   7.803  -9.437
  814    HHB  HEC 202           HHB      HEC 202   2.784   4.214  -4.828
  815    HHC  HEC 202           HHC      HEC 202   4.503   9.022  -1.210
  816    HHD  HEC 202           HHD      HEC 202   2.898  13.023  -5.794
  817   1HMA  HEC 202          1HMA      HEC 202   0.895   3.350  -5.791
  818   2HMA  HEC 202          2HMA      HEC 202   1.964   2.936  -7.132
  819   3HMA  HEC 202          3HMA      HEC 202   0.286   3.376  -7.444
  820   1HAA  HEC 202          1HAA      HEC 202   0.918   5.410  -9.950
  821   2HAA  HEC 202          2HAA      HEC 202  -0.169   4.560  -8.889
  822   1HBA  HEC 202          1HBA      HEC 202  -1.462   6.582  -8.516
  823   2HBA  HEC 202          2HBA      HEC 202  -0.334   7.513  -9.500
  824   1HMB  HEC 202          1HMB      HEC 202   4.784   3.833  -1.654
  825   2HMB  HEC 202          2HMB      HEC 202   3.091   3.597  -2.091
  826   3HMB  HEC 202          3HMB      HEC 202   4.349   3.432  -3.316
  827    HAB  HEC 202           HAB      HEC 202   4.275   7.062   0.089
  828   1HBB  HEC 202          1HBB      HEC 202   6.630   6.145  -1.392
  829   2HBB  HEC 202          2HBB      HEC 202   6.481   5.369   0.181
  830   3HBB  HEC 202          3HBB      HEC 202   6.547   7.126   0.070
  831   1HMC  HEC 202          1HMC      HEC 202   4.737  11.028  -0.508
  832   2HMC  HEC 202          2HMC      HEC 202   5.893  12.077  -1.329
  833   3HMC  HEC 202          3HMC      HEC 202   4.330  12.716  -0.818
  834    HAC  HEC 202           HAC      HEC 202   2.662  14.075  -3.613
  835   1HBC  HEC 202          1HBC      HEC 202   5.108  13.940  -2.003
  836   2HBC  HEC 202          2HBC      HEC 202   3.812  15.132  -1.944
  837   3HBC  HEC 202          3HBC      HEC 202   5.126  15.313  -3.104
  838   1HMD  HEC 202          1HMD      HEC 202   1.381  13.617  -8.060
  839   2HMD  HEC 202          2HMD      HEC 202   1.687  13.048  -9.701
  840   3HMD  HEC 202          3HMD      HEC 202   3.036  13.505  -8.661
  841   1HAD  HEC 202          1HAD      HEC 202   1.917   9.328 -10.700
  842   2HAD  HEC 202          2HAD      HEC 202   1.233  10.937 -10.896
  843   1HBD  HEC 202          1HBD      HEC 202   3.746  11.655 -10.342
  844   2HBD  HEC 202          2HBD      HEC 202   4.075  10.051 -10.997
  845    HHA  HEC 203           HHA      HEC 203   7.114  -6.857   4.565
  846    HHB  HEC 203           HHB      HEC 203   2.786  -2.057   4.830
  847    HHC  HEC 203           HHC      HEC 203   4.703   0.013  -0.571
  848    HHD  HEC 203           HHD      HEC 203   9.036  -4.510  -0.974
  849   1HMA  HEC 203          1HMA      HEC 203   2.295  -3.779   6.513
  850   2HMA  HEC 203          2HMA      HEC 203   3.621  -3.330   7.585
  851   3HMA  HEC 203          3HMA      HEC 203   3.117  -5.016   7.463
  852   1HAA  HEC 203          1HAA      HEC 203   4.943  -6.035   7.688
  853   2HAA  HEC 203          2HAA      HEC 203   4.743  -7.261   6.444
  854   1HBA  HEC 203          1HBA      HEC 203   6.984  -7.659   6.290
  855   2HBA  HEC 203          2HBA      HEC 203   7.403  -5.963   6.532
  856   1HMB  HEC 203          1HMB      HEC 203   1.170   0.297   3.511
  857   2HMB  HEC 203          2HMB      HEC 203   2.117  -0.245   4.896
  858   3HMB  HEC 203          3HMB      HEC 203   2.450   1.323   4.160
  859    HAB  HEC 203           HAB      HEC 203   2.841   0.845  -0.013
  860   1HBB  HEC 203          1HBB      HEC 203   3.861   2.866   0.008
  861   2HBB  HEC 203          2HBB      HEC 203   4.699   2.339   1.468
  862   3HBB  HEC 203          3HBB      HEC 203   3.191   3.244   1.594
  863   1HMC  HEC 203          1HMC      HEC 203   6.015  -0.820  -3.583
  864   2HMC  HEC 203          2HMC      HEC 203   5.741   0.345  -2.287
  865   3HMC  HEC 203          3HMC      HEC 203   7.365   0.111  -2.933
  866    HAC  HEC 203           HAC      HEC 203   9.240  -3.466  -2.616
  867   1HBC  HEC 203          1HBC      HEC 203   9.863  -1.767  -4.149
  868   2HBC  HEC 203          2HBC      HEC 203   9.329  -0.879  -2.723
  869   3HBC  HEC 203          3HBC      HEC 203   8.260  -1.034  -4.114
  870   1HMD  HEC 203          1HMD      HEC 203  10.451  -6.022  -0.316
  871   2HMD  HEC 203          2HMD      HEC 203   9.781  -7.648  -0.198
  872   3HMD  HEC 203          3HMD      HEC 203  10.901  -7.065   1.034
  873   1HAD  HEC 203          1HAD      HEC 203  10.101  -7.828   3.232
  874   2HAD  HEC 203          2HAD      HEC 203   8.541  -8.057   4.015
  875   1HBD  HEC 203          1HBD      HEC 203   7.914  -9.718   2.580
  876   2HBD  HEC 203          2HBD      HEC 203   8.703  -8.958   1.197
  877    HHA  HEC 204           HHA      HEC 204  -6.779   2.232   4.008
  878    HHB  HEC 204           HHB      HEC 204  -9.941  -2.221   0.869
  879    HHC  HEC 204           HHC      HEC 204  -4.661  -5.860   1.066
  880    HHD  HEC 204           HHD      HEC 204  -1.414  -0.862   2.823
  881   1HMA  HEC 204          1HMA      HEC 204 -10.943   0.970   0.919
  882   2HMA  HEC 204          2HMA      HEC 204 -11.628   0.528   2.484
  883   3HMA  HEC 204          3HMA      HEC 204 -11.292  -0.721   1.285
  884   1HAA  HEC 204          1HAA      HEC 204 -10.162   2.132   4.242
  885   2HAA  HEC 204          2HAA      HEC 204  -8.583   2.856   3.938
  886   1HBA  HEC 204          1HBA      HEC 204  -9.234   3.196   1.555
  887   2HBA  HEC 204          2HBA      HEC 204 -10.828   2.555   1.931
  888   1HMB  HEC 204          1HMB      HEC 204 -10.022  -5.573  -0.201
  889   2HMB  HEC 204          2HMB      HEC 204  -9.494  -4.666  -1.618
  890   3HMB  HEC 204          3HMB      HEC 204 -10.373  -3.849  -0.326
  891    HAB  HEC 204           HAB      HEC 204  -6.279  -6.938   0.334
  892   1HBB  HEC 204          1HBB      HEC 204  -5.463  -6.321  -1.775
  893   2HBB  HEC 204          2HBB      HEC 204  -7.042  -5.770  -2.333
  894   3HBB  HEC 204          3HBB      HEC 204  -6.720  -7.496  -2.162
  895   1HMC  HEC 204          1HMC      HEC 204  -1.566  -6.030   0.643
  896   2HMC  HEC 204          2HMC      HEC 204  -1.374  -6.074   2.395
  897   3HMC  HEC 204          3HMC      HEC 204  -2.899  -6.570   1.663
  898    HAC  HEC 204           HAC      HEC 204  -0.293  -2.331   2.983
  899   1HBC  HEC 204          1HBC      HEC 204   0.253  -2.608   0.523
  900   2HBC  HEC 204          2HBC      HEC 204   0.480  -4.329   0.829
  901   3HBC  HEC 204          3HBC      HEC 204   1.530  -3.148   1.612
  902   1HMD  HEC 204          1HMD      HEC 204  -1.631   2.637   4.347
  903   2HMD  HEC 204          2HMD      HEC 204  -1.095   0.965   4.521
  904   3HMD  HEC 204          3HMD      HEC 204  -1.029   1.752   2.946
  905   1HAD  HEC 204          1HAD      HEC 204  -3.718   3.921   3.846
  906   2HAD  HEC 204          2HAD      HEC 204  -5.352   3.512   4.354
  907   1HBD  HEC 204          1HBD      HEC 204  -4.060   2.293   6.328
  908   2HBD  HEC 204          2HBD      HEC 204  -2.820   3.476   5.923
  Start of MODEL    8
    1   1H    ALA   1          1H        ALA   1  18.501  14.958   1.185
    2   2H    ALA   1          2H        ALA   1  19.899  14.561   0.304
    3   3H    ALA   1          3H        ALA   1  20.028  15.392   1.780
    4    HA   ALA   1           HA       ALA   1  19.555  12.544   1.285
    5   1HB   ALA   1          1HB       ALA   1  21.049  12.512   3.298
    6   2HB   ALA   1          2HB       ALA   1  20.989  14.275   3.327
    7   3HB   ALA   1          3HB       ALA   1  21.730  13.440   1.961
    8    HA   PRO   2           HA       PRO   2  15.899  13.316   3.884
    9   1HB   PRO   2          1HB       PRO   2  14.574  11.068   3.066
   10   2HB   PRO   2          2HB       PRO   2  14.544  12.589   2.158
   11   1HG   PRO   2          1HG       PRO   2  16.139  10.127   1.672
   12   2HG   PRO   2          2HG       PRO   2  15.377  11.225   0.511
   13   1HD   PRO   2          1HD       PRO   2  18.048  11.244   1.086
   14   2HD   PRO   2          2HD       PRO   2  17.151  12.667   0.512
   15    H    LYS   3           H        LYS   3  15.799  12.578   5.984
   16    HA   LYS   3           HA       LYS   3  17.359  10.154   6.696
   17   1HB   LYS   3          1HB       LYS   3  15.912  12.162   8.430
   18   2HB   LYS   3          2HB       LYS   3  17.151  11.017   8.938
   19   1HG   LYS   3          1HG       LYS   3  18.638  12.191   7.145
   20   2HG   LYS   3          2HG       LYS   3  17.459  13.497   7.261
   21   1HD   LYS   3          1HD       LYS   3  18.892  12.308   9.652
   22   2HD   LYS   3          2HD       LYS   3  19.427  13.763   8.811
   23   1HE   LYS   3          1HE       LYS   3  17.905  15.022   9.921
   24   2HE   LYS   3          2HE       LYS   3  16.591  13.931   9.433
   25   1HZ   LYS   3          1HZ       LYS   3  17.486  12.347  11.142
   26   2HZ   LYS   3          2HZ       LYS   3  16.764  13.750  11.772
   27   3HZ   LYS   3          3HZ       LYS   3  18.457  13.612  11.717
   28    H    ALA   4           H        ALA   4  15.840   8.624   5.837
   29    HA   ALA   4           HA       ALA   4  13.132   8.308   6.146
   30   1HB   ALA   4          1HB       ALA   4  15.279   6.721   5.496
   31   2HB   ALA   4          2HB       ALA   4  13.611   6.152   5.570
   32   3HB   ALA   4          3HB       ALA   4  14.682   5.929   6.954
   33    HA   PRO   5           HA       PRO   5  12.510   8.386  10.507
   34   1HB   PRO   5          1HB       PRO   5   9.863   7.672  10.488
   35   2HB   PRO   5          2HB       PRO   5  10.447   9.292  10.076
   36   1HG   PRO   5          1HG       PRO   5   9.447   7.149   8.311
   37   2HG   PRO   5          2HG       PRO   5   9.446   8.900   8.084
   38   1HD   PRO   5          1HD       PRO   5  11.220   7.079   6.898
   39   2HD   PRO   5          2HD       PRO   5  11.385   8.844   6.932
   40    H    ALA   6           H        ALA   6  11.919   6.875  12.252
   41    HA   ALA   6           HA       ALA   6  13.021   4.293  11.973
   42   1HB   ALA   6          1HB       ALA   6  12.899   4.953  14.166
   43   2HB   ALA   6          2HB       ALA   6  11.374   4.067  14.120
   44   3HB   ALA   6          3HB       ALA   6  11.382   5.819  13.922
   45    H    ASP   7           H        ASP   7  11.508   2.331  12.746
   46    HA   ASP   7           HA       ASP   7   9.547   1.938  10.581
   47   1HB   ASP   7          1HB       ASP   7  10.362   0.048  12.797
   48   2HB   ASP   7          2HB       ASP   7   9.792  -0.353  11.181
   49    H    GLY   8           H        GLY   8   7.398   1.061  11.142
   50   1HA   GLY   8          1HA       GLY   8   5.604   0.677  12.728
   51   2HA   GLY   8          2HA       GLY   8   6.455   1.697  13.885
   52    H    LEU   9           H        LEU   9   6.427   2.997  10.730
   53    HA   LEU   9           HA       LEU   9   4.975   5.336  11.476
   54   1HB   LEU   9          1HB       LEU   9   6.418   4.369   9.281
   55   2HB   LEU   9          2HB       LEU   9   4.796   4.658   8.646
   56    HG   LEU   9           HG       LEU   9   5.933   6.737  10.446
   57   1HD1  LEU   9          1HD1      LEU   9   6.884   7.685   8.131
   58   2HD1  LEU   9          2HD1      LEU   9   7.048   5.964   7.780
   59   3HD1  LEU   9          3HD1      LEU   9   7.870   6.662   9.177
   60   1HD2  LEU   9          1HD2      LEU   9   4.859   7.759   8.026
   61   2HD2  LEU   9          2HD2      LEU   9   4.117   7.780   9.627
   62   3HD2  LEU   9          3HD2      LEU   9   3.803   6.435   8.531
   63    H    LYS  10           H        LYS  10   2.824   5.515  11.846
   64    HA   LYS  10           HA       LYS  10   1.039   3.328  10.921
   65   1HB   LYS  10          1HB       LYS  10   1.158   5.299  13.097
   66   2HB   LYS  10          2HB       LYS  10  -0.457   5.061  12.431
   67   1HG   LYS  10          1HG       LYS  10   0.061   2.530  12.613
   68   2HG   LYS  10          2HG       LYS  10   1.363   3.022  13.698
   69   1HD   LYS  10          1HD       LYS  10  -0.229   4.162  15.156
   70   2HD   LYS  10          2HD       LYS  10  -1.549   3.792  14.045
   71   1HE   LYS  10          1HE       LYS  10  -1.196   1.371  14.419
   72   2HE   LYS  10          2HE       LYS  10   0.125   1.743  15.545
   73   1HZ   LYS  10          1HZ       LYS  10  -1.692   3.333  16.541
   74   2HZ   LYS  10          2HZ       LYS  10  -1.616   1.698  16.999
   75   3HZ   LYS  10          3HZ       LYS  10  -2.754   2.208  15.844
   76    H    MET  11           H        MET  11   0.115   3.624   8.973
   77    HA   MET  11           HA       MET  11  -0.421   6.337   7.913
   78   1HB   MET  11          1HB       MET  11  -0.280   3.518   6.949
   79   2HB   MET  11          2HB       MET  11  -1.375   4.589   6.073
   80   1HG   MET  11          1HG       MET  11   0.517   6.232   5.864
   81   2HG   MET  11          2HG       MET  11   1.580   5.012   6.565
   82   1HE   MET  11          1HE       MET  11   1.319   2.395   5.587
   83   2HE   MET  11          2HE       MET  11   0.602   2.047   4.016
   84   3HE   MET  11          3HE       MET  11  -0.415   2.633   5.329
   85    H    ASP  12           H        ASP  12  -2.196   7.123   9.113
   86    HA   ASP  12           HA       ASP  12  -4.616   5.359   9.251
   87   1HB   ASP  12          1HB       ASP  12  -5.229   7.184  10.990
   88   2HB   ASP  12          2HB       ASP  12  -3.947   6.051  11.397
   89    H    LYS  13           H        LYS  13  -3.591   7.279   7.026
   90    HA   LYS  13           HA       LYS  13  -5.202   9.542   6.715
   91   1HB   LYS  13          1HB       LYS  13  -4.107   7.430   4.869
   92   2HB   LYS  13          2HB       LYS  13  -5.026   8.788   4.226
   93   1HG   LYS  13          1HG       LYS  13  -2.573   9.017   5.995
   94   2HG   LYS  13          2HG       LYS  13  -2.593   9.269   4.248
   95   1HD   LYS  13          1HD       LYS  13  -4.336  11.065   4.617
   96   2HD   LYS  13          2HD       LYS  13  -4.038  10.902   6.349
   97   1HE   LYS  13          1HE       LYS  13  -1.941  11.872   6.218
   98   2HE   LYS  13          2HE       LYS  13  -1.666  11.295   4.562
   99   1HZ   LYS  13          1HZ       LYS  13  -3.596  13.402   5.383
  100   2HZ   LYS  13          2HZ       LYS  13  -3.411  12.809   3.802
  101   3HZ   LYS  13          3HZ       LYS  13  -2.142  13.659   4.548
  102    H    THR  14           H        THR  14  -6.080   6.158   6.445
  103    HA   THR  14           HA       THR  14  -8.890   6.953   5.740
  104    HB   THR  14           HB       THR  14  -8.956   4.556   4.872
  105    HG1  THR  14           1HG      THR  14  -7.301   3.488   5.621
  106   1HG2  THR  14          1HG2      THR  14  -6.785   6.168   3.544
  107   2HG2  THR  14          2HG2      THR  14  -8.464   6.710   3.529
  108   3HG2  THR  14          3HG2      THR  14  -8.029   5.167   2.793
  109    H    LYS  15           H        LYS  15 -10.347   4.859   6.453
  110    HA   LYS  15           HA       LYS  15 -10.387   4.884   9.343
  111   1HB   LYS  15          1HB       LYS  15 -11.891   3.746   7.061
  112   2HB   LYS  15          2HB       LYS  15 -12.010   2.821   8.558
  113   1HG   LYS  15          1HG       LYS  15 -13.485   4.321   9.353
  114   2HG   LYS  15          2HG       LYS  15 -12.249   5.575   9.242
  115   1HD   LYS  15          1HD       LYS  15 -12.868   6.066   6.949
  116   2HD   LYS  15          2HD       LYS  15 -13.989   4.703   6.918
  117   1HE   LYS  15          1HE       LYS  15 -15.230   5.830   8.845
  118   2HE   LYS  15          2HE       LYS  15 -14.237   7.265   8.522
  119   1HZ   LYS  15          1HZ       LYS  15 -16.151   5.907   6.725
  120   2HZ   LYS  15          2HZ       LYS  15 -14.907   6.881   6.099
  121   3HZ   LYS  15          3HZ       LYS  15 -16.072   7.550   7.138
  122    H    GLN  16           H        GLN  16  -8.908   2.837   6.939
  123    HA   GLN  16           HA       GLN  16  -8.257   0.766   8.992
  124   1HB   GLN  16          1HB       GLN  16  -8.520   0.917   6.018
  125   2HB   GLN  16          2HB       GLN  16  -7.367  -0.249   6.668
  126   1HG   GLN  16          1HG       GLN  16  -9.247  -1.037   8.212
  127   2HG   GLN  16          2HG       GLN  16 -10.337  -0.081   7.208
  128   1HE2  GLN  16          2HE2      GLN  16 -10.446  -0.681   4.854
  129   2HE2  GLN  16          1HE2      GLN  16 -10.081  -2.271   4.386
  130    HA   PRO  17           HA       PRO  17  -4.479   3.384   8.683
  131   1HB   PRO  17          1HB       PRO  17  -3.757   3.022  11.305
  132   2HB   PRO  17          2HB       PRO  17  -4.880   4.289  10.767
  133   1HG   PRO  17          1HG       PRO  17  -5.476   1.620  11.962
  134   2HG   PRO  17          2HG       PRO  17  -6.228   3.192  12.285
  135   1HD   PRO  17          1HD       PRO  17  -7.391   1.342  10.702
  136   2HD   PRO  17          2HD       PRO  17  -7.567   3.089  10.409
  137    H    VAL  18           H        VAL  18  -2.530   2.507   8.089
  138    HA   VAL  18           HA       VAL  18  -1.932  -0.302   8.941
  139    HB   VAL  18           HB       VAL  18  -1.638   1.211   6.342
  140   1HG1  VAL  18          1HG1      VAL  18  -0.315  -0.623   5.471
  141   2HG1  VAL  18          2HG1      VAL  18  -0.441  -1.493   7.001
  142   3HG1  VAL  18          3HG1      VAL  18   0.484   0.006   6.912
  143   1HG2  VAL  18          1HG2      VAL  18  -3.287  -0.990   7.418
  144   2HG2  VAL  18          2HG2      VAL  18  -2.617  -1.297   5.815
  145   3HG2  VAL  18          3HG2      VAL  18  -3.625   0.123   6.093
  146    H    VAL  19           H        VAL  19   0.086  -0.591   9.860
  147    HA   VAL  19           HA       VAL  19   1.801   1.765  10.271
  148    HB   VAL  19           HB       VAL  19   1.752  -1.116  11.190
  149   1HG1  VAL  19          1HG1      VAL  19   4.080  -0.681  11.083
  150   2HG1  VAL  19          2HG1      VAL  19   3.643  -0.307  12.750
  151   3HG1  VAL  19          3HG1      VAL  19   3.874   0.997  11.585
  152   1HG2  VAL  19          1HG2      VAL  19   1.105  -0.212  13.276
  153   2HG2  VAL  19          2HG2      VAL  19   0.214   0.760  12.107
  154   3HG2  VAL  19          3HG2      VAL  19   1.678   1.401  12.853
  155    H    PHE  20           H        PHE  20   3.517   2.222   8.895
  156    HA   PHE  20           HA       PHE  20   4.448   0.055   7.061
  157   1HB   PHE  20          1HB       PHE  20   3.689   2.148   6.031
  158   2HB   PHE  20          2HB       PHE  20   4.807   3.074   7.029
  159    HD1  PHE  20           HD1      PHE  20   4.857   0.099   4.745
  160    HD2  PHE  20           HD2      PHE  20   6.871   3.648   6.078
  161    HE1  PHE  20           HE1      PHE  20   6.657  -0.296   3.087
  162    HE2  PHE  20           HE2      PHE  20   8.663   3.252   4.419
  163    HZ   PHE  20           HZ       PHE  20   8.562   1.281   2.925
  164    H    ASN  21           H        ASN  21   6.264  -0.996   7.765
  165    HA   ASN  21           HA       ASN  21   8.102   0.335   9.660
  166   1HB   ASN  21          1HB       ASN  21   7.151  -2.306   8.985
  167   2HB   ASN  21          2HB       ASN  21   8.907  -2.272   8.937
  168   1HD2  ASN  21          2HD2      ASN  21   8.642  -3.713  10.952
  169   2HD2  ASN  21          1HD2      ASN  21   8.446  -2.938  12.450
  170    H    HIS  22           H        HIS  22   9.334   1.783   8.343
  171    HA   HIS  22           HA       HIS  22  10.287   1.422   5.739
  172   1HB   HIS  22          1HB       HIS  22  11.243   2.807   8.216
  173   2HB   HIS  22          2HB       HIS  22  12.332   2.747   6.833
  174    HD1  HIS  22           HD1      HIS  22   9.553   4.634   8.186
  175    HD2  HIS  22           HD2      HIS  22  10.952   3.807   4.343
  176    HE1  HIS  22           HE1      HIS  22   8.583   6.413   6.675
  177    H    SER  23           H        SER  23  11.537   0.058   8.766
  178    HA   SER  23           HA       SER  23  14.039  -0.927   7.985
  179   1HB   SER  23          1HB       SER  23  11.910  -1.580   9.907
  180   2HB   SER  23          2HB       SER  23  12.923  -2.960   9.495
  181    HG   SER  23           HG       SER  23  14.152  -0.503  10.011
  182    H    THR  24           H        THR  24  10.827  -2.382   7.422
  183    HA   THR  24           HA       THR  24  11.846  -4.714   6.029
  184    HB   THR  24           HB       THR  24   9.147  -3.911   5.324
  185    HG1  THR  24           1HG      THR  24   8.823  -2.778   7.075
  186   1HG2  THR  24          1HG2      THR  24   8.970  -6.133   5.587
  187   2HG2  THR  24          2HG2      THR  24   9.234  -5.949   7.321
  188   3HG2  THR  24          3HG2      THR  24  10.607  -6.188   6.240
  189    H    HIS  25           H        HIS  25  11.597  -1.439   5.179
  190    HA   HIS  25           HA       HIS  25  11.599  -2.106   2.268
  191   1HB   HIS  25          1HB       HIS  25  10.716   0.387   3.752
  192   2HB   HIS  25          2HB       HIS  25  10.539   0.086   2.026
  193    HD1  HIS  25           HD1      HIS  25   9.239  -1.043   5.369
  194    HD2  HIS  25           HD2      HIS  25   8.462  -1.718   1.331
  195    HE1  HIS  25           HE1      HIS  25   7.085  -2.369   5.267
  196    H    LYS  26           H        LYS  26  13.521  -1.046   4.830
  197    HA   LYS  26           HA       LYS  26  15.063   1.083   3.819
  198   1HB   LYS  26          1HB       LYS  26  16.844   0.078   5.270
  199   2HB   LYS  26          2HB       LYS  26  15.273   0.137   6.072
  200   1HG   LYS  26          1HG       LYS  26  15.798  -2.057   6.518
  201   2HG   LYS  26          2HG       LYS  26  15.052  -2.283   4.936
  202   1HD   LYS  26          1HD       LYS  26  17.254  -2.191   3.858
  203   2HD   LYS  26          2HD       LYS  26  18.021  -1.899   5.419
  204   1HE   LYS  26          1HE       LYS  26  16.347  -4.233   5.638
  205   2HE   LYS  26          2HE       LYS  26  17.435  -4.420   4.247
  206   1HZ   LYS  26          1HZ       LYS  26  18.154  -3.770   7.048
  207   2HZ   LYS  26          2HZ       LYS  26  19.223  -3.508   5.755
  208   3HZ   LYS  26          3HZ       LYS  26  18.687  -5.080   6.113
  209    H    ALA  27           H        ALA  27  14.829  -2.197   2.719
  210    HA   ALA  27           HA       ALA  27  17.335  -2.002   1.125
  211   1HB   ALA  27          1HB       ALA  27  15.621  -4.369   0.832
  212   2HB   ALA  27          2HB       ALA  27  16.029  -4.023   2.513
  213   3HB   ALA  27          3HB       ALA  27  17.311  -4.268   1.325
  214    H    VAL  28           H        VAL  28  14.106  -1.159   0.821
  215    HA   VAL  28           HA       VAL  28  13.705  -1.950  -1.978
  216    HB   VAL  28           HB       VAL  28  12.256  -0.184   0.010
  217   1HG1  VAL  28          1HG1      VAL  28  10.379  -0.242  -1.653
  218   2HG1  VAL  28          2HG1      VAL  28  11.504  -0.927  -2.826
  219   3HG1  VAL  28          3HG1      VAL  28  11.771   0.697  -2.190
  220   1HG2  VAL  28          1HG2      VAL  28  10.621  -2.022   0.000
  221   2HG2  VAL  28          2HG2      VAL  28  12.221  -2.628   0.432
  222   3HG2  VAL  28          3HG2      VAL  28  11.589  -2.887  -1.194
  223    H    LYS  29           H        LYS  29  13.014   0.025  -3.475
  224    HA   LYS  29           HA       LYS  29  15.340   1.840  -3.497
  225   1HB   LYS  29          1HB       LYS  29  13.464   0.699  -5.365
  226   2HB   LYS  29          2HB       LYS  29  13.520   2.454  -5.548
  227   1HG   LYS  29          1HG       LYS  29  15.315   1.922  -6.878
  228   2HG   LYS  29          2HG       LYS  29  16.142   2.007  -5.321
  229   1HD   LYS  29          1HD       LYS  29  16.865  -0.066  -6.124
  230   2HD   LYS  29          2HD       LYS  29  15.475  -0.527  -5.140
  231   1HE   LYS  29          1HE       LYS  29  14.873  -1.637  -7.074
  232   2HE   LYS  29          2HE       LYS  29  14.229  -0.041  -7.511
  233   1HZ   LYS  29          1HZ       LYS  29  15.998   0.423  -8.839
  234   2HZ   LYS  29          2HZ       LYS  29  16.007  -1.267  -9.013
  235   3HZ   LYS  29          3HZ       LYS  29  17.082  -0.515  -7.934
  236    H    CYS  30           H        CYS  30  15.090   3.470  -2.078
  237    HA   CYS  30           HA       CYS  30  12.814   4.667  -1.018
  238   1HB   CYS  30          1HB       CYS  30  15.533   5.710  -1.807
  239   2HB   CYS  30          2HB       CYS  30  14.353   6.780  -1.055
  240    H    GLY  31           H        GLY  31  14.059   4.910  -4.265
  241   1HA   GLY  31          1HA       GLY  31  12.314   7.200  -4.927
  242   2HA   GLY  31          2HA       GLY  31  13.449   6.416  -6.028
  243    H    ASP  32           H        ASP  32  12.086   3.795  -4.813
  244    HA   ASP  32           HA       ASP  32  10.224   3.506  -7.055
  245   1HB   ASP  32          1HB       ASP  32  11.797   1.889  -5.372
  246   2HB   ASP  32          2HB       ASP  32  10.135   1.439  -5.014
  247    H    CYS  33           H        CYS  33  10.094   4.096  -3.593
  248    HA   CYS  33           HA       CYS  33   7.120   3.954  -3.562
  249   1HB   CYS  33          1HB       CYS  33   9.370   4.184  -1.563
  250   2HB   CYS  33          2HB       CYS  33   7.736   4.626  -1.079
  251    H    HIS  34           H        HIS  34   9.698   6.261  -2.592
  252    HA   HIS  34           HA       HIS  34   7.838   8.548  -2.888
  253   1HB   HIS  34          1HB       HIS  34  10.744   8.237  -2.054
  254   2HB   HIS  34          2HB       HIS  34   9.900   9.775  -2.089
  255    HD1  HIS  34           HD1      HIS  34   7.492   9.664  -0.619
  256    HD2  HIS  34           HD2      HIS  34  10.549   7.024   0.407
  257    HE1  HIS  34           HE1      HIS  34   7.037   8.925   1.761
  258    H    HIS  35           H        HIS  35   8.279   7.180  -5.314
  259    HA   HIS  35           HA       HIS  35  10.297   7.639  -7.041
  260   1HB   HIS  35          1HB       HIS  35   8.443   8.232  -8.731
  261   2HB   HIS  35          2HB       HIS  35   8.259   6.732  -7.842
  262    HD1  HIS  35           HD1      HIS  35   7.038  10.249  -7.918
  263    HD2  HIS  35           HD2      HIS  35   5.999   6.637  -6.145
  264    HE1  HIS  35           HE1      HIS  35   4.778  10.618  -6.847
  265    HA   PRO  36           HA       PRO  36  11.405  11.832  -7.321
  266   1HB   PRO  36          1HB       PRO  36  11.917  12.099 -10.003
  267   2HB   PRO  36          2HB       PRO  36  12.990  11.233  -8.884
  268   1HG   PRO  36          1HG       PRO  36  10.932  10.145 -10.752
  269   2HG   PRO  36          2HG       PRO  36  12.566   9.551 -10.405
  270   1HD   PRO  36          1HD       PRO  36  10.375   8.417  -9.323
  271   2HD   PRO  36          2HD       PRO  36  11.920   8.512  -8.448
  272    H    VAL  37           H        VAL  37   9.614  13.090  -6.859
  273    HA   VAL  37           HA       VAL  37   7.656  13.638  -9.053
  274    HB   VAL  37           HB       VAL  37   7.651  13.794  -6.041
  275   1HG1  VAL  37          1HG1      VAL  37   5.198  14.699  -6.579
  276   2HG1  VAL  37          2HG1      VAL  37   6.016  15.351  -8.000
  277   3HG1  VAL  37          3HG1      VAL  37   6.560  15.804  -6.385
  278   1HG2  VAL  37          1HG2      VAL  37   6.872  11.701  -6.702
  279   2HG2  VAL  37          2HG2      VAL  37   6.167  12.322  -8.195
  280   3HG2  VAL  37          3HG2      VAL  37   5.365  12.615  -6.653
  281    H    ASN  38           H        ASN  38   7.104  15.914  -9.427
  282    HA   ASN  38           HA       ASN  38   7.789  18.152  -9.853
  283   1HB   ASN  38          1HB       ASN  38   7.160  17.856  -7.370
  284   2HB   ASN  38          2HB       ASN  38   8.877  17.907  -7.055
  285   1HD2  ASN  38          2HD2      ASN  38   6.324  19.924  -6.923
  286   2HD2  ASN  38          1HD2      ASN  38   7.056  21.386  -7.379
  287    H    GLY  39           H        GLY  39   9.894  15.846 -10.149
  288   1HA   GLY  39          1HA       GLY  39  12.069  16.060 -11.141
  289   2HA   GLY  39          2HA       GLY  39  12.204  17.673 -10.432
  290    H    LYS  40           H        LYS  40  10.999  16.112  -7.920
  291    HA   LYS  40           HA       LYS  40  13.580  14.855  -7.050
  292   1HB   LYS  40          1HB       LYS  40  13.369  16.177  -4.935
  293   2HB   LYS  40          2HB       LYS  40  13.591  17.200  -6.355
  294   1HG   LYS  40          1HG       LYS  40  11.051  17.383  -6.465
  295   2HG   LYS  40          2HG       LYS  40  11.017  16.635  -4.868
  296   1HD   LYS  40          1HD       LYS  40  12.278  18.438  -3.904
  297   2HD   LYS  40          2HD       LYS  40  12.637  19.115  -5.492
  298   1HE   LYS  40          1HE       LYS  40   9.978  19.185  -5.686
  299   2HE   LYS  40          2HE       LYS  40  10.094  19.240  -3.915
  300   1HZ   LYS  40          1HZ       LYS  40  11.104  21.143  -5.902
  301   2HZ   LYS  40          2HZ       LYS  40  12.016  20.916  -4.487
  302   3HZ   LYS  40          3HZ       LYS  40  10.403  21.438  -4.387
  303    H    GLU  41           H        GLU  41  13.265  13.078  -5.681
  304    HA   GLU  41           HA       GLU  41  10.666  11.863  -5.523
  305   1HB   GLU  41          1HB       GLU  41  13.296  11.425  -4.085
  306   2HB   GLU  41          2HB       GLU  41  11.904  10.366  -3.869
  307   1HG   GLU  41          1HG       GLU  41  12.004   9.566  -6.059
  308   2HG   GLU  41          2HG       GLU  41  12.852  10.995  -6.650
  309    H    ASP  42           H        ASP  42   9.047  12.812  -4.300
  310    HA   ASP  42           HA       ASP  42   9.532  14.478  -2.004
  311   1HB   ASP  42          1HB       ASP  42   7.144  12.952  -3.051
  312   2HB   ASP  42          2HB       ASP  42   7.057  14.026  -1.656
  313    H    TYR  43           H        TYR  43  10.792  13.410  -0.479
  314    HA   TYR  43           HA       TYR  43  10.211  10.677   0.384
  315   1HB   TYR  43          1HB       TYR  43  12.048  12.875   1.394
  316   2HB   TYR  43          2HB       TYR  43  12.066  11.216   1.994
  317    HD1  TYR  43           HD1      TYR  43  13.251  13.456  -0.546
  318    HD2  TYR  43           HD2      TYR  43  12.419   9.322   0.275
  319    HE1  TYR  43           HE1      TYR  43  14.705  12.787  -2.439
  320    HE2  TYR  43           HE2      TYR  43  13.873   8.654  -1.618
  321    HH   TYR  43           HH       TYR  43  16.105  10.458  -2.946
  322    H    GLN  44           H        GLN  44   7.862  12.035   0.750
  323    HA   GLN  44           HA       GLN  44   7.760  12.469   3.720
  324   1HB   GLN  44          1HB       GLN  44   5.888  14.107   3.074
  325   2HB   GLN  44          2HB       GLN  44   7.530  14.601   2.662
  326   1HG   GLN  44          1HG       GLN  44   7.246  13.972   0.372
  327   2HG   GLN  44          2HG       GLN  44   5.740  13.123   0.723
  328   1HE2  GLN  44          2HE2      GLN  44   6.753  16.370   1.880
  329   2HE2  GLN  44          1HE2      GLN  44   5.463  17.200   1.153
  330    H    LYS  45           H        LYS  45   5.336  12.283   4.442
  331    HA   LYS  45           HA       LYS  45   4.396   9.705   4.265
  332   1HB   LYS  45          1HB       LYS  45   2.105  10.826   4.648
  333   2HB   LYS  45          2HB       LYS  45   3.388  11.210   5.790
  334   1HG   LYS  45          1HG       LYS  45   3.905  13.256   4.436
  335   2HG   LYS  45          2HG       LYS  45   2.501  12.894   3.432
  336   1HD   LYS  45          1HD       LYS  45   0.991  13.376   5.130
  337   2HD   LYS  45          2HD       LYS  45   2.154  13.016   6.406
  338   1HE   LYS  45          1HE       LYS  45   3.136  15.210   4.798
  339   2HE   LYS  45          2HE       LYS  45   1.506  15.573   5.397
  340   1HZ   LYS  45          1HZ       LYS  45   3.516  15.991   6.944
  341   2HZ   LYS  45          2HZ       LYS  45   3.490  14.307   7.170
  342   3HZ   LYS  45          3HZ       LYS  45   2.133  15.243   7.580
  343    H    CYS  46           H        CYS  46   3.329   8.472   2.778
  344    HA   CYS  46           HA       CYS  46   3.280   9.053   0.028
  345   1HB   CYS  46          1HB       CYS  46   1.576   7.249   1.761
  346   2HB   CYS  46          2HB       CYS  46   1.655   7.130   0.007
  347    H    ALA  47           H        ALA  47   0.774   9.551   2.480
  348    HA   ALA  47           HA       ALA  47  -0.967  10.860   0.429
  349   1HB   ALA  47          1HB       ALA  47  -1.307   9.318   2.933
  350   2HB   ALA  47          2HB       ALA  47  -2.308   9.337   1.482
  351   3HB   ALA  47          3HB       ALA  47  -2.462  10.624   2.677
  352    H    THR  48           H        THR  48   1.134  12.464   1.147
  353    HA   THR  48           HA       THR  48   1.051  14.065   3.409
  354    HB   THR  48           HB       THR  48   1.414  15.287   0.693
  355    HG1  THR  48           1HG      THR  48   3.435  13.702   1.776
  356   1HG2  THR  48          1HG2      THR  48   2.122  15.919   3.360
  357   2HG2  THR  48          2HG2      THR  48   2.592  16.777   1.893
  358   3HG2  THR  48          3HG2      THR  48   3.620  15.494   2.531
  359    H    ALA  49           H        ALA  49   0.433  16.633   2.914
  360    HA   ALA  49           HA       ALA  49  -2.442  16.746   3.177
  361   1HB   ALA  49          1HB       ALA  49  -1.676  19.312   2.806
  362   2HB   ALA  49          2HB       ALA  49  -0.103  18.586   3.131
  363   3HB   ALA  49          3HB       ALA  49  -1.400  18.450   4.318
  364    H    GLY  50           H        GLY  50  -0.478  16.509   0.436
  365   1HA   GLY  50          1HA       GLY  50  -2.753  17.253  -1.309
  366   2HA   GLY  50          2HA       GLY  50  -1.230  18.108  -1.584
  367    H    CYS  51           H        CYS  51  -0.996  14.939  -0.362
  368    HA   CYS  51           HA       CYS  51   0.123  13.974  -2.931
  369   1HB   CYS  51          1HB       CYS  51   0.561  13.820  -0.048
  370   2HB   CYS  51          2HB       CYS  51   0.703  12.267  -0.807
  371    H    HIS  52           H        HIS  52  -0.365  11.194  -1.417
  372    HA   HIS  52           HA       HIS  52  -2.826  10.560  -2.863
  373   1HB   HIS  52          1HB       HIS  52  -1.021   9.039  -0.967
  374   2HB   HIS  52          2HB       HIS  52  -2.366   8.308  -1.817
  375    HD1  HIS  52           HD1      HIS  52  -2.237   8.718  -4.512
  376    HD2  HIS  52           HD2      HIS  52   1.335   8.889  -2.405
  377    HE1  HIS  52           HE1      HIS  52  -0.392   8.387  -6.221
  378    H    ASP  53           H        ASP  53  -3.496  12.544  -1.055
  379    HA   ASP  53           HA       ASP  53  -4.522  11.264   1.410
  380   1HB   ASP  53          1HB       ASP  53  -5.019  13.602   2.013
  381   2HB   ASP  53          2HB       ASP  53  -3.362  13.453   1.427
  382    H    ASN  54           H        ASN  54  -5.709  10.909  -1.493
  383    HA   ASN  54           HA       ASN  54  -8.373  12.113  -1.235
  384   1HB   ASN  54          1HB       ASN  54  -6.740  10.818  -3.205
  385   2HB   ASN  54          2HB       ASN  54  -8.284   9.978  -3.131
  386   1HD2  ASN  54          2HD2      ASN  54  -9.684  10.850  -4.654
  387   2HD2  ASN  54          1HD2      ASN  54  -9.825  12.501  -5.020
  388    H    MET  55           H        MET  55  -9.460  11.284   0.563
  389    HA   MET  55           HA       MET  55  -9.332   8.454   1.285
  390   1HB   MET  55          1HB       MET  55 -10.459  11.000   2.275
  391   2HB   MET  55          2HB       MET  55 -11.406   9.572   2.692
  392   1HG   MET  55          1HG       MET  55  -9.881   8.913   4.214
  393   2HG   MET  55          2HG       MET  55  -8.565   9.080   3.051
  394   1HE   MET  55          1HE       MET  55  -6.892   9.929   3.636
  395   2HE   MET  55          2HE       MET  55  -6.523  11.212   4.785
  396   3HE   MET  55          3HE       MET  55  -6.881  11.617   3.108
  397    H    ASP  56           H        ASP  56 -10.502   9.337  -1.423
  398    HA   ASP  56           HA       ASP  56 -13.350   8.688  -1.255
  399   1HB   ASP  56          1HB       ASP  56 -11.960  10.169  -2.930
  400   2HB   ASP  56          2HB       ASP  56 -11.665   8.635  -3.750
  401    H    LYS  57           H        LYS  57 -10.376   6.942  -1.538
  402    HA   LYS  57           HA       LYS  57  -9.950   4.626  -1.733
  403   1HB   LYS  57          1HB       LYS  57 -12.936   4.497  -1.245
  404   2HB   LYS  57          2HB       LYS  57 -11.773   3.209  -0.941
  405   1HG   LYS  57          1HG       LYS  57 -10.747   4.417   0.832
  406   2HG   LYS  57          2HG       LYS  57 -11.541   5.922   0.367
  407   1HD   LYS  57          1HD       LYS  57 -12.931   3.448   1.438
  408   2HD   LYS  57          2HD       LYS  57 -12.648   4.940   2.335
  409   1HE   LYS  57          1HE       LYS  57 -13.882   5.794  -0.030
  410   2HE   LYS  57          2HE       LYS  57 -14.773   4.332   0.440
  411   1HZ   LYS  57          1HZ       LYS  57 -14.160   6.684   2.150
  412   2HZ   LYS  57          2HZ       LYS  57 -14.799   5.225   2.743
  413   3HZ   LYS  57          3HZ       LYS  57 -15.693   6.163   1.644
  414    H    LYS  58           H        LYS  58 -11.407   6.397  -3.991
  415    HA   LYS  58           HA       LYS  58 -11.754   4.072  -5.851
  416   1HB   LYS  58          1HB       LYS  58 -13.432   6.595  -5.649
  417   2HB   LYS  58          2HB       LYS  58 -13.678   5.288  -6.807
  418   1HG   LYS  58          1HG       LYS  58 -13.602   4.651  -3.875
  419   2HG   LYS  58          2HG       LYS  58 -15.071   5.333  -4.571
  420   1HD   LYS  58          1HD       LYS  58 -15.068   3.526  -6.282
  421   2HD   LYS  58          2HD       LYS  58 -13.656   2.818  -5.498
  422   1HE   LYS  58          1HE       LYS  58 -14.892   1.960  -3.774
  423   2HE   LYS  58          2HE       LYS  58 -15.943   3.388  -3.694
  424   1HZ   LYS  58          1HZ       LYS  58 -17.263   2.636  -5.388
  425   2HZ   LYS  58          2HZ       LYS  58 -16.835   1.151  -4.684
  426   3HZ   LYS  58          3HZ       LYS  58 -16.041   1.690  -6.086
  427    H    ASP  59           H        ASP  59 -10.263   7.075  -5.196
  428    HA   ASP  59           HA       ASP  59  -9.989   8.238  -7.777
  429   1HB   ASP  59          1HB       ASP  59  -9.329   9.481  -5.870
  430   2HB   ASP  59          2HB       ASP  59  -8.330   8.165  -5.254
  431    H    LYS  60           H        LYS  60  -9.462   6.800  -9.453
  432    HA   LYS  60           HA       LYS  60  -7.273   4.852  -9.120
  433   1HB   LYS  60          1HB       LYS  60  -9.560   5.337 -10.832
  434   2HB   LYS  60          2HB       LYS  60  -8.121   5.036 -11.807
  435   1HG   LYS  60          1HG       LYS  60  -8.737   3.267  -9.454
  436   2HG   LYS  60          2HG       LYS  60  -9.549   2.998 -10.996
  437   1HD   LYS  60          1HD       LYS  60  -6.562   3.327 -10.924
  438   2HD   LYS  60          2HD       LYS  60  -7.282   1.770 -10.512
  439   1HE   LYS  60          1HE       LYS  60  -8.092   1.419 -12.665
  440   2HE   LYS  60          2HE       LYS  60  -8.191   3.155 -13.019
  441   1HZ   LYS  60          1HZ       LYS  60  -5.894   3.326 -13.238
  442   2HZ   LYS  60          2HZ       LYS  60  -6.243   1.858 -14.019
  443   3HZ   LYS  60          3HZ       LYS  60  -5.601   1.855 -12.446
  444    H    SER  61           H        SER  61  -6.695   7.802  -9.003
  445    HA   SER  61           HA       SER  61  -4.994   8.096 -11.451
  446   1HB   SER  61          1HB       SER  61  -6.783   9.789 -10.012
  447   2HB   SER  61          2HB       SER  61  -5.164  10.455  -9.821
  448    HG   SER  61           HG       SER  61  -6.321  11.140 -11.744
  449    H    ALA  62           H        ALA  62  -3.263  10.053 -10.329
  450    HA   ALA  62           HA       ALA  62  -1.543   8.307  -8.641
  451   1HB   ALA  62          1HB       ALA  62  -1.199  10.099 -10.805
  452   2HB   ALA  62          2HB       ALA  62   0.064   9.234  -9.929
  453   3HB   ALA  62          3HB       ALA  62  -0.414  10.853  -9.418
  454    H    LYS  63           H        LYS  63  -3.953   9.869  -7.602
  455    HA   LYS  63           HA       LYS  63  -2.483  11.390  -5.477
  456   1HB   LYS  63          1HB       LYS  63  -3.850  12.550  -7.518
  457   2HB   LYS  63          2HB       LYS  63  -5.156  12.342  -6.347
  458   1HG   LYS  63          1HG       LYS  63  -4.391  14.079  -5.140
  459   2HG   LYS  63          2HG       LYS  63  -2.813  13.304  -4.983
  460   1HD   LYS  63          1HD       LYS  63  -1.983  14.931  -6.302
  461   2HD   LYS  63          2HD       LYS  63  -2.899  14.220  -7.631
  462   1HE   LYS  63          1HE       LYS  63  -4.904  15.608  -6.637
  463   2HE   LYS  63          2HE       LYS  63  -3.612  16.571  -5.895
  464   1HZ   LYS  63          1HZ       LYS  63  -4.223  16.155  -8.729
  465   2HZ   LYS  63          2HZ       LYS  63  -2.588  16.307  -8.288
  466   3HZ   LYS  63          3HZ       LYS  63  -3.686  17.555  -7.936
  467    H    GLY  64           H        GLY  64  -4.515   8.842  -6.144
  468   1HA   GLY  64          1HA       GLY  64  -6.168   9.228  -3.704
  469   2HA   GLY  64          2HA       GLY  64  -6.473   8.029  -4.952
  470    H    TYR  65           H        TYR  65  -5.711   8.148  -1.868
  471    HA   TYR  65           HA       TYR  65  -3.336   6.683  -1.423
  472   1HB   TYR  65          1HB       TYR  65  -5.440   7.701   0.024
  473   2HB   TYR  65          2HB       TYR  65  -5.712   5.968   0.194
  474    HD1  TYR  65           HD1      TYR  65  -2.401   7.605  -0.238
  475    HD2  TYR  65           HD2      TYR  65  -5.110   5.701   2.496
  476    HE1  TYR  65           HE1      TYR  65  -0.606   7.501   1.466
  477    HE2  TYR  65           HE2      TYR  65  -3.312   5.598   4.202
  478    HH   TYR  65           HH       TYR  65  -0.345   7.304   3.849
  479    H    TYR  66           H        TYR  66  -6.639   5.324  -1.520
  480    HA   TYR  66           HA       TYR  66  -6.190   2.625  -1.542
  481   1HB   TYR  66          1HB       TYR  66  -8.246   4.326  -2.083
  482   2HB   TYR  66          2HB       TYR  66  -8.002   3.596  -3.669
  483    HD1  TYR  66           HD1      TYR  66  -9.405   3.168  -0.410
  484    HD2  TYR  66           HD2      TYR  66  -7.854   1.017  -3.785
  485    HE1  TYR  66           HE1      TYR  66 -10.579   1.122   0.353
  486    HE2  TYR  66           HE2      TYR  66  -9.026  -1.031  -3.021
  487    HH   TYR  66           HH       TYR  66 -10.096  -1.984  -1.253
  488    H    HIS  67           H        HIS  67  -6.596   4.288  -4.675
  489    HA   HIS  67           HA       HIS  67  -5.741   2.383  -6.428
  490   1HB   HIS  67          1HB       HIS  67  -6.429   4.541  -7.187
  491   2HB   HIS  67          2HB       HIS  67  -5.113   5.337  -6.320
  492    HD1  HIS  67           HD1      HIS  67  -5.534   2.735  -9.069
  493    HD2  HIS  67           HD2      HIS  67  -2.867   5.714  -7.896
  494    HE1  HIS  67           HE1      HIS  67  -3.687   2.758 -10.794
  495    H    ALA  68           H        ALA  68  -3.300   4.839  -5.710
  496    HA   ALA  68           HA       ALA  68  -1.030   3.422  -6.410
  497   1HB   ALA  68          1HB       ALA  68  -1.740   5.643  -4.596
  498   2HB   ALA  68          2HB       ALA  68  -0.503   5.569  -5.849
  499   3HB   ALA  68          3HB       ALA  68  -0.182   4.893  -4.252
  500    H    MET  69           H        MET  69  -2.956   2.966  -3.489
  501    HA   MET  69           HA       MET  69  -0.856   1.385  -2.166
  502   1HB   MET  69          1HB       MET  69  -3.730   2.072  -1.529
  503   2HB   MET  69          2HB       MET  69  -2.653   1.209  -0.434
  504   1HG   MET  69          1HG       MET  69  -1.438   3.637  -1.516
  505   2HG   MET  69          2HG       MET  69  -2.907   3.966  -0.601
  506   1HE   MET  69          1HE       MET  69   0.193   4.954   0.732
  507   2HE   MET  69          2HE       MET  69   0.350   4.008  -0.746
  508   3HE   MET  69          3HE       MET  69   1.150   3.466   0.727
  509    H    HIS  70           H        HIS  70  -3.871   0.729  -3.945
  510    HA   HIS  70           HA       HIS  70  -3.413  -2.180  -3.416
  511   1HB   HIS  70          1HB       HIS  70  -5.890  -0.699  -4.351
  512   2HB   HIS  70          2HB       HIS  70  -5.808  -2.393  -3.862
  513    HD1  HIS  70           HD1      HIS  70  -6.031   1.050  -2.511
  514    HD2  HIS  70           HD2      HIS  70  -5.310  -2.773  -1.024
  515    HE1  HIS  70           HE1      HIS  70  -6.246   1.213   0.006
  516    H    ASP  71           H        ASP  71  -3.167   0.203  -5.859
  517    HA   ASP  71           HA       ASP  71  -3.755  -1.616  -8.101
  518   1HB   ASP  71          1HB       ASP  71  -2.798   1.224  -7.748
  519   2HB   ASP  71          2HB       ASP  71  -2.858   0.471  -9.340
  520    H    LYS  72           H        LYS  72  -2.158  -2.391  -9.578
  521    HA   LYS  72           HA       LYS  72   0.590  -2.573  -8.423
  522   1HB   LYS  72          1HB       LYS  72  -0.740  -4.215 -10.595
  523   2HB   LYS  72          2HB       LYS  72   0.727  -4.624  -9.705
  524   1HG   LYS  72          1HG       LYS  72  -0.665  -5.792  -8.343
  525   2HG   LYS  72          2HG       LYS  72  -1.070  -4.213  -7.667
  526   1HD   LYS  72          1HD       LYS  72  -3.083  -4.087  -8.800
  527   2HD   LYS  72          2HD       LYS  72  -2.517  -5.100 -10.129
  528   1HE   LYS  72          1HE       LYS  72  -2.969  -7.081  -8.994
  529   2HE   LYS  72          2HE       LYS  72  -2.778  -6.328  -7.398
  530   1HZ   LYS  72          1HZ       LYS  72  -4.893  -5.412  -9.237
  531   2HZ   LYS  72          2HZ       LYS  72  -4.817  -5.279  -7.544
  532   3HZ   LYS  72          3HZ       LYS  72  -5.151  -6.780  -8.268
  533    H    GLY  73           H        GLY  73  -0.942  -2.422 -11.649
  534   1HA   GLY  73          1HA       GLY  73   1.446  -1.507 -12.971
  535   2HA   GLY  73          2HA       GLY  73  -0.184  -1.435 -13.645
  536    H    THR  74           H        THR  74   1.564   0.130 -10.942
  537    HA   THR  74           HA       THR  74   0.201   2.694 -11.634
  538    HB   THR  74           HB       THR  74   1.230   3.230  -9.301
  539    HG1  THR  74           1HG      THR  74   1.585   1.241  -8.135
  540   1HG2  THR  74          1HG2      THR  74  -1.122   2.889  -9.457
  541   2HG2  THR  74          2HG2      THR  74  -0.573   1.796  -8.185
  542   3HG2  THR  74          3HG2      THR  74  -0.922   1.169  -9.797
  543    H    LYS  75           H        LYS  75   1.563   4.681 -11.533
  544    HA   LYS  75           HA       LYS  75   3.724   4.872 -13.208
  545   1HB   LYS  75          1HB       LYS  75   2.411   6.557 -11.605
  546   2HB   LYS  75          2HB       LYS  75   3.839   6.348 -10.599
  547   1HG   LYS  75          1HG       LYS  75   4.383   8.191 -11.970
  548   2HG   LYS  75          2HG       LYS  75   5.185   6.834 -12.755
  549   1HD   LYS  75          1HD       LYS  75   4.108   7.815 -14.569
  550   2HD   LYS  75          2HD       LYS  75   2.900   6.633 -14.060
  551   1HE   LYS  75          1HE       LYS  75   2.277   8.783 -12.459
  552   2HE   LYS  75          2HE       LYS  75   2.778   9.573 -13.967
  553   1HZ   LYS  75          1HZ       LYS  75   0.371   8.745 -13.801
  554   2HZ   LYS  75          2HZ       LYS  75   1.030   7.192 -14.004
  555   3HZ   LYS  75          3HZ       LYS  75   1.243   8.374 -15.207
  556    H    PHE  76           H        PHE  76   3.774   3.761  -9.854
  557    HA   PHE  76           HA       PHE  76   6.564   2.750 -10.264
  558   1HB   PHE  76          1HB       PHE  76   5.505   4.229  -7.837
  559   2HB   PHE  76          2HB       PHE  76   7.143   3.625  -8.053
  560    HD1  PHE  76           HD1      PHE  76   8.576   4.596  -9.909
  561    HD2  PHE  76           HD2      PHE  76   4.781   6.267  -8.787
  562    HE1  PHE  76           HE1      PHE  76   9.145   6.697 -11.100
  563    HE2  PHE  76           HE2      PHE  76   5.352   8.364  -9.973
  564    HZ   PHE  76           HZ       PHE  76   7.525   8.573 -11.128
  565    H    LYS  77           H        LYS  77   7.098   1.195  -8.297
  566    HA   LYS  77           HA       LYS  77   4.982  -0.772  -8.166
  567   1HB   LYS  77          1HB       LYS  77   6.536  -1.873  -6.585
  568   2HB   LYS  77          2HB       LYS  77   7.345  -1.377  -8.067
  569   1HG   LYS  77          1HG       LYS  77   8.090   0.709  -6.883
  570   2HG   LYS  77          2HG       LYS  77   7.408   0.050  -5.395
  571   1HD   LYS  77          1HD       LYS  77   9.845  -0.423  -5.587
  572   2HD   LYS  77          2HD       LYS  77   8.884  -1.900  -5.551
  573   1HE   LYS  77          1HE       LYS  77   9.480  -0.698  -8.230
  574   2HE   LYS  77          2HE       LYS  77  10.771  -1.586  -7.398
  575   1HZ   LYS  77          1HZ       LYS  77   9.724  -3.509  -7.714
  576   2HZ   LYS  77          2HZ       LYS  77   8.674  -2.699  -8.776
  577   3HZ   LYS  77          3HZ       LYS  77   8.250  -2.894  -7.142
  578    H    SER  78           H        SER  78   3.230  -0.403  -7.050
  579    HA   SER  78           HA       SER  78   3.016   1.511  -4.874
  580   1HB   SER  78          1HB       SER  78   0.702  -0.071  -5.054
  581   2HB   SER  78          2HB       SER  78   0.987   1.475  -5.846
  582    HG   SER  78           HG       SER  78   1.528  -1.127  -6.829
  583    H    CYS  79           H        CYS  79   1.551   0.630  -2.934
  584    HA   CYS  79           HA       CYS  79   3.179  -1.037  -1.291
  585   1HB   CYS  79          1HB       CYS  79   0.269  -0.198  -1.191
  586   2HB   CYS  79          2HB       CYS  79   1.107  -0.966   0.155
  587    H    VAL  80           H        VAL  80  -0.152  -1.801  -2.335
  588    HA   VAL  80           HA       VAL  80   0.147  -4.641  -1.924
  589    HB   VAL  80           HB       VAL  80  -1.791  -2.848  -3.394
  590   1HG1  VAL  80          1HG1      VAL  80  -3.053  -5.304  -2.999
  591   2HG1  VAL  80          2HG1      VAL  80  -1.455  -5.738  -3.606
  592   3HG1  VAL  80          3HG1      VAL  80  -2.491  -4.662  -4.542
  593   1HG2  VAL  80          1HG2      VAL  80  -1.436  -3.426  -0.703
  594   2HG2  VAL  80          2HG2      VAL  80  -2.720  -4.538  -1.176
  595   3HG2  VAL  80          3HG2      VAL  80  -2.921  -2.803  -1.421
  596    H    GLY  81           H        GLY  81   0.714  -2.493  -4.659
  597   1HA   GLY  81          1HA       GLY  81   0.828  -4.531  -6.695
  598   2HA   GLY  81          2HA       GLY  81   1.534  -2.919  -6.822
  599    H    CYS  82           H        CYS  82   3.291  -2.998  -4.627
  600    HA   CYS  82           HA       CYS  82   5.498  -4.560  -5.736
  601   1HB   CYS  82          1HB       CYS  82   5.430  -2.265  -4.453
  602   2HB   CYS  82          2HB       CYS  82   5.417  -3.271  -3.007
  603    H    HIS  83           H        HIS  83   3.014  -4.974  -3.398
  604    HA   HIS  83           HA       HIS  83   4.288  -7.064  -1.825
  605   1HB   HIS  83          1HB       HIS  83   1.649  -5.691  -2.106
  606   2HB   HIS  83          2HB       HIS  83   1.671  -7.230  -1.268
  607    HD1  HIS  83           HD1      HIS  83   1.209  -5.981   1.019
  608    HD2  HIS  83           HD2      HIS  83   4.794  -4.935  -0.835
  609    HE1  HIS  83           HE1      HIS  83   2.585  -4.766   2.760
  610    H    LEU  84           H        LEU  84   1.462  -7.135  -4.066
  611    HA   LEU  84           HA       LEU  84   1.206  -9.906  -4.345
  612   1HB   LEU  84          1HB       LEU  84   0.236  -7.524  -5.461
  613   2HB   LEU  84          2HB       LEU  84   0.872  -8.429  -6.830
  614    HG   LEU  84           HG       LEU  84  -0.834  -9.812  -4.788
  615   1HD1  LEU  84          1HD1      LEU  84  -1.910  -7.633  -5.707
  616   2HD1  LEU  84          2HD1      LEU  84  -2.844  -9.127  -5.812
  617   3HD1  LEU  84          3HD1      LEU  84  -2.010  -8.505  -7.236
  618   1HD2  LEU  84          1HD2      LEU  84   0.261 -10.318  -7.470
  619   2HD2  LEU  84          2HD2      LEU  84  -1.450 -10.721  -7.323
  620   3HD2  LEU  84          3HD2      LEU  84  -0.272 -11.465  -6.241
  621    H    GLU  85           H        GLU  85   3.704  -7.791  -5.529
  622    HA   GLU  85           HA       GLU  85   4.736  -9.854  -7.413
  623   1HB   GLU  85          1HB       GLU  85   5.098  -6.922  -6.908
  624   2HB   GLU  85          2HB       GLU  85   6.401  -7.797  -7.713
  625   1HG   GLU  85          1HG       GLU  85   4.135  -8.722  -9.012
  626   2HG   GLU  85          2HG       GLU  85   3.772  -7.016  -8.743
  627    H    THR  86           H        THR  86   5.768  -7.935  -4.573
  628    HA   THR  86           HA       THR  86   8.375  -9.034  -4.278
  629    HB   THR  86           HB       THR  86   6.309  -7.811  -2.452
  630    HG1  THR  86           1HG      THR  86   7.460  -6.460  -3.831
  631   1HG2  THR  86          1HG2      THR  86   7.923  -7.827  -0.621
  632   2HG2  THR  86          2HG2      THR  86   9.088  -8.691  -1.624
  633   3HG2  THR  86          3HG2      THR  86   7.594  -9.484  -1.126
  634    H    ALA  87           H        ALA  87   5.300 -10.501  -3.879
  635    HA   ALA  87           HA       ALA  87   6.123 -12.493  -1.892
  636   1HB   ALA  87          1HB       ALA  87   3.782 -11.468  -2.452
  637   2HB   ALA  87          2HB       ALA  87   3.874 -13.188  -2.071
  638   3HB   ALA  87          3HB       ALA  87   3.754 -12.662  -3.750
  639    H    GLY  88           H        GLY  88   5.920 -12.257  -5.402
  640   1HA   GLY  88          1HA       GLY  88   6.615 -13.731  -7.091
  641   2HA   GLY  88          2HA       GLY  88   7.787 -14.315  -5.911
  642    H    ALA  89           H        ALA  89   4.328 -14.634  -6.759
  643    HA   ALA  89           HA       ALA  89   2.862 -16.472  -6.391
  644   1HB   ALA  89          1HB       ALA  89   3.530 -17.977  -7.946
  645   2HB   ALA  89          2HB       ALA  89   4.998 -18.363  -7.049
  646   3HB   ALA  89          3HB       ALA  89   4.962 -16.964  -8.121
  647    H    ASP  90           H        ASP  90   3.586 -15.815  -3.931
  648    HA   ASP  90           HA       ASP  90   4.397 -18.377  -2.630
  649   1HB   ASP  90          1HB       ASP  90   6.186 -16.711  -2.586
  650   2HB   ASP  90          2HB       ASP  90   5.085 -15.512  -1.919
  651    H    ALA  91           H        ALA  91   2.115 -18.796  -2.424
  652    HA   ALA  91           HA       ALA  91   0.002 -17.324  -1.520
  653   1HB   ALA  91          1HB       ALA  91   0.980 -20.069  -0.714
  654   2HB   ALA  91          2HB       ALA  91  -0.249 -19.660  -1.911
  655   3HB   ALA  91          3HB       ALA  91  -0.588 -19.457  -0.192
  656    H    ALA  92           H        ALA  92   2.831 -18.182   0.387
  657    HA   ALA  92           HA       ALA  92   1.705 -17.360   2.951
  658   1HB   ALA  92          1HB       ALA  92   4.355 -18.152   1.796
  659   2HB   ALA  92          2HB       ALA  92   3.490 -18.840   3.172
  660   3HB   ALA  92          3HB       ALA  92   4.351 -17.310   3.346
  661    H    LYS  93           H        LYS  93   3.925 -15.945   0.570
  662    HA   LYS  93           HA       LYS  93   4.107 -13.373   1.929
  663   1HB   LYS  93          1HB       LYS  93   5.093 -14.758  -0.498
  664   2HB   LYS  93          2HB       LYS  93   5.015 -13.002  -0.610
  665   1HG   LYS  93          1HG       LYS  93   6.401 -14.582   1.574
  666   2HG   LYS  93          2HG       LYS  93   7.209 -13.739   0.251
  667   1HD   LYS  93          1HD       LYS  93   7.271 -11.928   1.598
  668   2HD   LYS  93          2HD       LYS  93   5.529 -11.805   1.355
  669   1HE   LYS  93          1HE       LYS  93   5.637 -11.920   3.690
  670   2HE   LYS  93          2HE       LYS  93   5.481 -13.643   3.290
  671   1HZ   LYS  93          1HZ       LYS  93   8.063 -13.413   2.998
  672   2HZ   LYS  93          2HZ       LYS  93   7.383 -13.701   4.529
  673   3HZ   LYS  93          3HZ       LYS  93   7.863 -12.131   4.090
  674    H    LYS  94           H        LYS  94   2.072 -14.839  -0.524
  675    HA   LYS  94           HA       LYS  94   0.993 -12.327  -1.555
  676   1HB   LYS  94          1HB       LYS  94   0.811 -15.200  -2.002
  677   2HB   LYS  94          2HB       LYS  94  -0.780 -14.440  -2.083
  678   1HG   LYS  94          1HG       LYS  94   0.630 -12.635  -3.506
  679   2HG   LYS  94          2HG       LYS  94   1.583 -14.078  -3.854
  680   1HD   LYS  94          1HD       LYS  94  -1.026 -14.978  -4.109
  681   2HD   LYS  94          2HD       LYS  94  -1.096 -13.352  -4.788
  682   1HE   LYS  94          1HE       LYS  94   1.017 -13.990  -6.121
  683   2HE   LYS  94          2HE       LYS  94   0.646 -15.665  -5.666
  684   1HZ   LYS  94          1HZ       LYS  94  -0.509 -15.248  -7.676
  685   2HZ   LYS  94          2HZ       LYS  94  -1.097 -13.754  -7.121
  686   3HZ   LYS  94          3HZ       LYS  94  -1.675 -15.202  -6.446
  687    H    LYS  95           H        LYS  95   0.724 -13.684   1.429
  688    HA   LYS  95           HA       LYS  95  -2.138 -12.829   1.768
  689   1HB   LYS  95          1HB       LYS  95  -2.289 -14.874   2.762
  690   2HB   LYS  95          2HB       LYS  95  -0.549 -15.119   2.615
  691   1HG   LYS  95          1HG       LYS  95  -0.146 -13.903   4.676
  692   2HG   LYS  95          2HG       LYS  95  -1.850 -13.460   4.795
  693   1HD   LYS  95          1HD       LYS  95  -0.776 -16.296   4.860
  694   2HD   LYS  95          2HD       LYS  95  -1.306 -15.376   6.270
  695   1HE   LYS  95          1HE       LYS  95  -3.509 -15.085   4.744
  696   2HE   LYS  95          2HE       LYS  95  -2.938 -16.648   4.124
  697   1HZ   LYS  95          1HZ       LYS  95  -2.691 -17.409   6.419
  698   2HZ   LYS  95          2HZ       LYS  95  -4.301 -16.981   6.086
  699   3HZ   LYS  95          3HZ       LYS  95  -3.310 -15.935   6.987
  700    H    GLU  96           H        GLU  96   1.136 -12.776   2.956
  701    HA   GLU  96           HA       GLU  96   0.770 -10.927   5.131
  702   1HB   GLU  96          1HB       GLU  96   2.797 -12.453   3.668
  703   2HB   GLU  96          2HB       GLU  96   3.401 -10.928   4.282
  704   1HG   GLU  96          1HG       GLU  96   2.242 -11.616   6.504
  705   2HG   GLU  96          2HG       GLU  96   2.213 -13.232   5.794
  706    H    LEU  97           H        LEU  97   1.832 -10.655   1.751
  707    HA   LEU  97           HA       LEU  97   2.296  -7.758   1.956
  708   1HB   LEU  97          1HB       LEU  97   2.331  -9.642  -0.403
  709   2HB   LEU  97          2HB       LEU  97   3.110  -8.062  -0.297
  710    HG   LEU  97           HG       LEU  97   3.809 -10.580   1.217
  711   1HD1  LEU  97          1HD1      LEU  97   6.079  -9.954   0.311
  712   2HD1  LEU  97          2HD1      LEU  97   5.284  -8.679  -0.612
  713   3HD1  LEU  97          3HD1      LEU  97   4.888 -10.370  -0.921
  714   1HD2  LEU  97          1HD2      LEU  97   4.539  -7.697   1.789
  715   2HD2  LEU  97          2HD2      LEU  97   5.521  -9.048   2.355
  716   3HD2  LEU  97          3HD2      LEU  97   3.853  -8.880   2.903
  717    H    THR  98           H        THR  98   0.211  -9.796  -0.127
  718    HA   THR  98           HA       THR  98  -1.430  -7.419  -0.762
  719    HB   THR  98           HB       THR  98  -2.379  -8.891  -2.441
  720    HG1  THR  98           1HG      THR  98  -0.799 -11.026  -1.630
  721   1HG2  THR  98          1HG2      THR  98   0.429  -8.392  -2.115
  722   2HG2  THR  98          2HG2      THR  98  -0.498  -8.501  -3.612
  723   3HG2  THR  98          3HG2      THR  98   0.216  -9.953  -2.906
  724    H    GLY  99           H        GLY  99  -1.526 -10.030   1.473
  725   1HA   GLY  99          1HA       GLY  99  -4.274 -10.603   1.644
  726   2HA   GLY  99          2HA       GLY  99  -3.189 -10.621   3.032
  727    H    CYS 100           H        CYS 100  -5.927  -9.211   1.884
  728    HA   CYS 100           HA       CYS 100  -5.525  -6.484   2.843
  729   1HB   CYS 100          1HB       CYS 100  -8.248  -7.565   2.601
  730   2HB   CYS 100          2HB       CYS 100  -7.566  -6.124   1.902
  731    H    LYS 101           H        LYS 101  -7.780  -9.031   3.927
  732    HA   LYS 101           HA       LYS 101  -7.874  -7.705   6.574
  733   1HB   LYS 101          1HB       LYS 101  -9.529  -9.530   4.932
  734   2HB   LYS 101          2HB       LYS 101  -9.636  -9.773   6.675
  735   1HG   LYS 101          1HG       LYS 101  -9.770  -6.970   5.643
  736   2HG   LYS 101          2HG       LYS 101 -11.190  -7.997   5.437
  737   1HD   LYS 101          1HD       LYS 101 -10.604  -8.559   8.015
  738   2HD   LYS 101          2HD       LYS 101  -9.987  -6.908   7.927
  739   1HE   LYS 101          1HE       LYS 101 -12.214  -6.228   6.911
  740   2HE   LYS 101          2HE       LYS 101 -12.808  -7.849   7.322
  741   1HZ   LYS 101          1HZ       LYS 101 -11.387  -6.223   9.330
  742   2HZ   LYS 101          2HZ       LYS 101 -12.480  -7.501   9.572
  743   3HZ   LYS 101          3HZ       LYS 101 -13.044  -5.981   9.063
  744    H    GLY 102           H        GLY 102  -5.625  -9.643   5.506
  745   1HA   GLY 102          1HA       GLY 102  -5.237 -10.955   8.088
  746   2HA   GLY 102          2HA       GLY 102  -5.574 -12.090   6.782
  747    H    SER 103           H        SER 103  -3.640  -9.077   6.796
  748    HA   SER 103           HA       SER 103  -1.290 -10.721   5.955
  749   1HB   SER 103          1HB       SER 103  -0.914  -9.124   4.256
  750   2HB   SER 103          2HB       SER 103  -2.640  -9.403   4.225
  751    HG   SER 103           HG       SER 103  -2.982  -7.465   5.077
  752    H    LYS 104           H        LYS 104   0.240  -8.240   5.668
  753    HA   LYS 104           HA       LYS 104   0.886  -7.747   8.540
  754   1HB   LYS 104          1HB       LYS 104   2.326  -7.182   5.927
  755   2HB   LYS 104          2HB       LYS 104   3.021  -7.011   7.538
  756   1HG   LYS 104          1HG       LYS 104   1.878  -9.631   6.560
  757   2HG   LYS 104          2HG       LYS 104   3.566  -9.190   6.297
  758   1HD   LYS 104          1HD       LYS 104   2.413  -8.972   9.059
  759   2HD   LYS 104          2HD       LYS 104   2.887 -10.557   8.448
  760   1HE   LYS 104          1HE       LYS 104   5.016  -8.843   7.758
  761   2HE   LYS 104          2HE       LYS 104   4.586  -8.422   9.427
  762   1HZ   LYS 104          1HZ       LYS 104   5.788 -10.263   9.891
  763   2HZ   LYS 104          2HZ       LYS 104   5.568 -10.941   8.349
  764   3HZ   LYS 104          3HZ       LYS 104   4.340 -11.061   9.516
  765    H    CYS 105           H        CYS 105  -0.209  -6.333   5.586
  766    HA   CYS 105           HA       CYS 105   0.215  -3.553   6.323
  767   1HB   CYS 105          1HB       CYS 105  -0.217  -5.082   4.056
  768   2HB   CYS 105          2HB       CYS 105  -1.741  -4.255   4.257
  769    H    HIS 106           H        HIS 106  -2.447  -5.877   6.544
  770    HA   HIS 106           HA       HIS 106  -4.137  -3.733   7.797
  771   1HB   HIS 106          1HB       HIS 106  -4.646  -6.023   5.941
  772   2HB   HIS 106          2HB       HIS 106  -5.935  -5.560   7.054
  773    HD1  HIS 106           HD1      HIS 106  -5.189  -2.462   7.011
  774    HD2  HIS 106           HD2      HIS 106  -5.895  -4.850   3.647
  775    HE1  HIS 106           HE1      HIS 106  -5.753  -0.880   5.123
  776    H    SER 107           H        SER 107  -2.958  -4.364   9.850
  777    HA   SER 107           HA       SER 107  -3.345  -7.046  10.937
  778   1HB   SER 107          1HB       SER 107  -2.717  -4.684  12.646
  779   2HB   SER 107          2HB       SER 107  -1.935  -6.261  12.587
  780    HG   SER 107           HG       SER 107  -0.593  -4.685  11.679
  781    HHA  HEC 201           HHA      HEC 201   6.046   8.705   5.613
  782    HHB  HEC 201           HHB      HEC 201  12.093   9.774   4.704
  783    HHC  HEC 201           HHC      HEC 201  12.525   4.620   1.042
  784    HHD  HEC 201           HHD      HEC 201   6.409   3.595   1.782
  785   1HMA  HEC 201          1HMA      HEC 201   9.858  10.823   7.782
  786   2HMA  HEC 201          2HMA      HEC 201  10.179  11.938   6.451
  787   3HMA  HEC 201          3HMA      HEC 201  11.343  10.671   6.839
  788   1HAA  HEC 201          1HAA      HEC 201   6.704   9.623   7.407
  789   2HAA  HEC 201          2HAA      HEC 201   7.907  10.859   7.757
  790   1HBA  HEC 201          1HBA      HEC 201   6.689  11.427   5.220
  791   2HBA  HEC 201          2HBA      HEC 201   5.427  11.186   6.426
  792   1HMB  HEC 201          1HMB      HEC 201  14.832   9.247   2.715
  793   2HMB  HEC 201          2HMB      HEC 201  14.035   9.588   4.252
  794   3HMB  HEC 201          3HMB      HEC 201  15.184   8.255   4.129
  795    HAB  HEC 201           HAB      HEC 201  14.363   5.411   1.128
  796   1HBB  HEC 201          1HBB      HEC 201  16.676   5.908   2.379
  797   2HBB  HEC 201          2HBB      HEC 201  15.559   4.673   2.960
  798   3HBB  HEC 201          3HBB      HEC 201  15.583   6.266   3.716
  799   1HMC  HEC 201          1HMC      HEC 201  11.768   3.147  -0.620
  800   2HMC  HEC 201          2HMC      HEC 201  10.615   1.812  -0.606
  801   3HMC  HEC 201          3HMC      HEC 201  11.822   1.949   0.673
  802    HAC  HEC 201           HAC      HEC 201   7.008   2.239   0.627
  803   1HBC  HEC 201          1HBC      HEC 201   8.081   0.320   1.395
  804   2HBC  HEC 201          2HBC      HEC 201   9.578   0.693   0.542
  805   3HBC  HEC 201          3HBC      HEC 201   8.180   0.093  -0.350
  806   1HMD  HEC 201          1HMD      HEC 201   4.593   3.302   3.732
  807   2HMD  HEC 201          2HMD      HEC 201   3.398   4.479   4.272
  808   3HMD  HEC 201          3HMD      HEC 201   3.716   4.276   2.550
  809   1HAD  HEC 201          1HAD      HEC 201   4.257   8.151   5.274
  810   2HAD  HEC 201          2HAD      HEC 201   3.176   7.275   4.197
  811   1HBD  HEC 201          1HBD      HEC 201   2.995   5.446   5.756
  812   2HBD  HEC 201          2HBD      HEC 201   4.260   6.127   6.778
  813    HHA  HEC 202           HHA      HEC 202   1.592   7.717  -9.488
  814    HHB  HEC 202           HHB      HEC 202   2.795   4.124  -4.829
  815    HHC  HEC 202           HHC      HEC 202   4.554   8.950  -1.229
  816    HHD  HEC 202           HHD      HEC 202   2.612  12.932  -5.820
  817   1HMA  HEC 202          1HMA      HEC 202   0.911   3.272  -5.877
  818   2HMA  HEC 202          2HMA      HEC 202   2.067   2.850  -7.141
  819   3HMA  HEC 202          3HMA      HEC 202   0.411   3.278  -7.567
  820   1HAA  HEC 202          1HAA      HEC 202   1.093   5.296 -10.013
  821   2HAA  HEC 202          2HAA      HEC 202  -0.026   4.466  -8.974
  822   1HBA  HEC 202          1HBA      HEC 202  -1.356   6.453  -8.697
  823   2HBA  HEC 202          2HBA      HEC 202  -0.173   7.421  -9.569
  824   1HMB  HEC 202          1HMB      HEC 202   4.191   3.320  -3.196
  825   2HMB  HEC 202          2HMB      HEC 202   4.509   3.742  -1.513
  826   3HMB  HEC 202          3HMB      HEC 202   2.847   3.587  -2.084
  827    HAB  HEC 202           HAB      HEC 202   4.250   7.041   0.088
  828   1HBB  HEC 202          1HBB      HEC 202   6.595   6.212  -1.346
  829   2HBB  HEC 202          2HBB      HEC 202   6.401   5.173   0.064
  830   3HBB  HEC 202          3HBB      HEC 202   6.497   6.922   0.267
  831   1HMC  HEC 202          1HMC      HEC 202   4.064  12.249  -0.539
  832   2HMC  HEC 202          2HMC      HEC 202   5.162  10.874  -0.665
  833   3HMC  HEC 202          3HMC      HEC 202   5.611  12.429  -1.367
  834    HAC  HEC 202           HAC      HEC 202   2.713  14.018  -4.010
  835   1HBC  HEC 202          1HBC      HEC 202   5.166  14.428  -3.764
  836   2HBC  HEC 202          2HBC      HEC 202   5.033  14.091  -2.037
  837   3HBC  HEC 202          3HBC      HEC 202   4.225  15.500  -2.725
  838   1HMD  HEC 202          1HMD      HEC 202   2.842  13.560  -8.332
  839   2HMD  HEC 202          2HMD      HEC 202   1.091  13.437  -8.172
  840   3HMD  HEC 202          3HMD      HEC 202   1.869  13.013  -9.698
  841   1HAD  HEC 202          1HAD      HEC 202   1.958   9.313 -10.729
  842   2HAD  HEC 202          2HAD      HEC 202   1.229  10.908 -10.876
  843   1HBD  HEC 202          1HBD      HEC 202   3.666  11.759 -10.405
  844   2HBD  HEC 202          2HBD      HEC 202   4.126  10.136 -10.921
  845    HHA  HEC 203           HHA      HEC 203   6.987  -6.938   4.665
  846    HHB  HEC 203           HHB      HEC 203   2.675  -2.127   5.017
  847    HHC  HEC 203           HHC      HEC 203   4.650   0.061  -0.329
  848    HHD  HEC 203           HHD      HEC 203   8.931  -4.506  -0.835
  849   1HMA  HEC 203          1HMA      HEC 203   3.485  -3.441   7.712
  850   2HMA  HEC 203          2HMA      HEC 203   2.998  -5.132   7.596
  851   3HMA  HEC 203          3HMA      HEC 203   2.161  -3.905   6.645
  852   1HAA  HEC 203          1HAA      HEC 203   4.845  -6.141   7.810
  853   2HAA  HEC 203          2HAA      HEC 203   4.613  -7.366   6.569
  854   1HBA  HEC 203          1HBA      HEC 203   6.849  -7.781   6.377
  855   2HBA  HEC 203          2HBA      HEC 203   7.286  -6.089   6.611
  856   1HMB  HEC 203          1HMB      HEC 203   1.868  -0.434   5.014
  857   2HMB  HEC 203          2HMB      HEC 203   2.308   1.176   4.444
  858   3HMB  HEC 203          3HMB      HEC 203   1.040   0.266   3.623
  859    HAB  HEC 203           HAB      HEC 203   2.692   0.901   0.273
  860   1HBB  HEC 203          1HBB      HEC 203   4.478   2.488   2.096
  861   2HBB  HEC 203          2HBB      HEC 203   3.364   3.337   1.021
  862   3HBB  HEC 203          3HBB      HEC 203   4.593   2.263   0.351
  863   1HMC  HEC 203          1HMC      HEC 203   5.874  -0.785  -3.394
  864   2HMC  HEC 203          2HMC      HEC 203   5.527   0.334  -2.076
  865   3HMC  HEC 203          3HMC      HEC 203   7.170   0.190  -2.701
  866    HAC  HEC 203           HAC      HEC 203   9.182  -3.292  -2.475
  867   1HBC  HEC 203          1HBC      HEC 203   8.918  -0.647  -2.560
  868   2HBC  HEC 203          2HBC      HEC 203   8.097  -1.004  -4.077
  869   3HBC  HEC 203          3HBC      HEC 203   9.771  -1.506  -3.842
  870   1HMD  HEC 203          1HMD      HEC 203  10.957  -6.367   1.006
  871   2HMD  HEC 203          2HMD      HEC 203  10.021  -6.340  -0.489
  872   3HMD  HEC 203          3HMD      HEC 203  10.070  -7.804   0.494
  873   1HAD  HEC 203          1HAD      HEC 203  10.001  -7.843   3.355
  874   2HAD  HEC 203          2HAD      HEC 203   8.424  -8.143   4.075
  875   1HBD  HEC 203          1HBD      HEC 203   7.914  -9.794   2.593
  876   2HBD  HEC 203          2HBD      HEC 203   8.679  -8.954   1.243
  877    HHA  HEC 204           HHA      HEC 204  -6.869   2.203   3.855
  878    HHB  HEC 204           HHB      HEC 204 -10.174  -2.332   1.008
  879    HHC  HEC 204           HHC      HEC 204  -4.851  -5.886   0.917
  880    HHD  HEC 204           HHD      HEC 204  -1.536  -0.990   2.629
  881   1HMA  HEC 204          1HMA      HEC 204 -11.506  -0.836   1.518
  882   2HMA  HEC 204          2HMA      HEC 204 -11.552   0.901   1.815
  883   3HMA  HEC 204          3HMA      HEC 204 -11.734  -0.228   3.157
  884   1HAA  HEC 204          1HAA      HEC 204 -10.059   2.028   4.511
  885   2HAA  HEC 204          2HAA      HEC 204  -8.598   2.814   3.924
  886   1HBA  HEC 204          1HBA      HEC 204  -9.766   3.111   1.699
  887   2HBA  HEC 204          2HBA      HEC 204 -11.236   2.541   2.482
  888   1HMB  HEC 204          1HMB      HEC 204 -10.625  -3.870  -0.302
  889   2HMB  HEC 204          2HMB      HEC 204 -10.283  -5.592  -0.144
  890   3HMB  HEC 204          3HMB      HEC 204  -9.811  -4.730  -1.609
  891    HAB  HEC 204           HAB      HEC 204  -6.512  -6.954   0.189
  892   1HBB  HEC 204          1HBB      HEC 204  -5.704  -6.288  -1.918
  893   2HBB  HEC 204          2HBB      HEC 204  -7.299  -5.776  -2.471
  894   3HBB  HEC 204          3HBB      HEC 204  -6.933  -7.494  -2.303
  895   1HMC  HEC 204          1HMC      HEC 204  -3.026  -6.494   0.703
  896   2HMC  HEC 204          2HMC      HEC 204  -1.472  -5.792   0.252
  897   3HMC  HEC 204          3HMC      HEC 204  -1.761  -6.298   1.917
  898    HAC  HEC 204           HAC      HEC 204  -0.506  -2.509   2.947
  899   1HBC  HEC 204          1HBC      HEC 204   0.181  -2.538   0.500
  900   2HBC  HEC 204          2HBC      HEC 204   0.414  -4.277   0.659
  901   3HBC  HEC 204          3HBC      HEC 204   1.396  -3.165   1.613
  902   1HMD  HEC 204          1HMD      HEC 204  -1.056   1.421   2.726
  903   2HMD  HEC 204          2HMD      HEC 204  -1.270   1.127   4.451
  904   3HMD  HEC 204          3HMD      HEC 204  -1.690   2.696   3.766
  905   1HAD  HEC 204          1HAD      HEC 204  -3.789   3.877   3.580
  906   2HAD  HEC 204          2HAD      HEC 204  -5.422   3.483   4.101
  907   1HBD  HEC 204          1HBD      HEC 204  -4.162   2.290   6.091
  908   2HBD  HEC 204          2HBD      HEC 204  -2.871   3.408   5.657
  Start of MODEL    9
    1   1H    ALA   1          1H        ALA   1  19.677  15.998   2.279
    2   2H    ALA   1          2H        ALA   1  18.377  15.486   1.311
    3   3H    ALA   1          3H        ALA   1  19.971  15.360   0.735
    4    HA   ALA   1           HA       ALA   1  19.473  13.184   1.381
    5   1HB   ALA   1          1HB       ALA   1  20.628  14.040   3.964
    6   2HB   ALA   1          2HB       ALA   1  21.424  14.721   2.545
    7   3HB   ALA   1          3HB       ALA   1  21.302  12.972   2.733
    8    HA   PRO   2           HA       PRO   2  15.742  13.484   3.929
    9   1HB   PRO   2          1HB       PRO   2  14.655  11.151   3.001
   10   2HB   PRO   2          2HB       PRO   2  14.519  12.690   2.135
   11   1HG   PRO   2          1HG       PRO   2  16.339  10.395   1.638
   12   2HG   PRO   2          2HG       PRO   2  15.528  11.462   0.483
   13   1HD   PRO   2          1HD       PRO   2  18.168  11.683   1.169
   14   2HD   PRO   2          2HD       PRO   2  17.178  13.040   0.587
   15    H    LYS   3           H        LYS   3  15.632  12.674   6.002
   16    HA   LYS   3           HA       LYS   3  17.327  10.318   6.670
   17   1HB   LYS   3          1HB       LYS   3  15.836  12.196   8.501
   18   2HB   LYS   3          2HB       LYS   3  17.196  11.152   8.902
   19   1HG   LYS   3          1HG       LYS   3  18.740  12.503   7.757
   20   2HG   LYS   3          2HG       LYS   3  17.486  13.273   6.785
   21   1HD   LYS   3          1HD       LYS   3  17.216  14.900   8.316
   22   2HD   LYS   3          2HD       LYS   3  16.983  13.713   9.600
   23   1HE   LYS   3          1HE       LYS   3  19.323  13.581  10.051
   24   2HE   LYS   3          2HE       LYS   3  19.733  14.421   8.542
   25   1HZ   LYS   3          1HZ       LYS   3  18.338  16.307   9.411
   26   2HZ   LYS   3          2HZ       LYS   3  19.807  16.054  10.225
   27   3HZ   LYS   3          3HZ       LYS   3  18.347  15.528  10.917
   28    H    ALA   4           H        ALA   4  15.850   8.743   5.826
   29    HA   ALA   4           HA       ALA   4  13.152   8.356   6.148
   30   1HB   ALA   4          1HB       ALA   4  15.369   6.819   5.525
   31   2HB   ALA   4          2HB       ALA   4  13.703   6.240   5.516
   32   3HB   ALA   4          3HB       ALA   4  14.715   5.996   6.940
   33    HA   PRO   5           HA       PRO   5  12.571   8.454  10.516
   34   1HB   PRO   5          1HB       PRO   5   9.935   7.705  10.526
   35   2HB   PRO   5          2HB       PRO   5  10.491   9.332  10.101
   36   1HG   PRO   5          1HG       PRO   5   9.530   7.153   8.350
   37   2HG   PRO   5          2HG       PRO   5   9.455   8.904   8.131
   38   1HD   PRO   5          1HD       PRO   5  11.269   7.180   6.890
   39   2HD   PRO   5          2HD       PRO   5  11.404   8.946   6.984
   40    H    ALA   6           H        ALA   6  11.989   6.932  12.267
   41    HA   ALA   6           HA       ALA   6  13.132   4.368  11.984
   42   1HB   ALA   6          1HB       ALA   6  12.866   4.514  14.222
   43   2HB   ALA   6          2HB       ALA   6  11.111   4.480  14.053
   44   3HB   ALA   6          3HB       ALA   6  11.976   6.015  13.967
   45    H    ASP   7           H        ASP   7  11.750   2.340  12.615
   46    HA   ASP   7           HA       ASP   7   9.746   1.953  10.506
   47   1HB   ASP   7          1HB       ASP   7  10.621   0.046  12.683
   48   2HB   ASP   7          2HB       ASP   7  10.041  -0.343  11.067
   49    H    GLY   8           H        GLY   8   7.623   1.012  11.075
   50   1HA   GLY   8          1HA       GLY   8   5.840   0.579  12.652
   51   2HA   GLY   8          2HA       GLY   8   6.684   1.580  13.831
   52    H    LEU   9           H        LEU   9   6.569   2.914  10.670
   53    HA   LEU   9           HA       LEU   9   5.116   5.232  11.495
   54   1HB   LEU   9          1HB       LEU   9   6.515   4.288   9.234
   55   2HB   LEU   9          2HB       LEU   9   4.888   4.662   8.659
   56    HG   LEU   9           HG       LEU   9   6.134   6.635  10.500
   57   1HD1  LEU   9          1HD1      LEU   9   7.202   7.653   8.341
   58   2HD1  LEU   9          2HD1      LEU   9   7.127   6.000   7.726
   59   3HD1  LEU   9          3HD1      LEU   9   8.063   6.361   9.179
   60   1HD2  LEU   9          1HD2      LEU   9   4.779   8.146   9.360
   61   2HD2  LEU   9          2HD2      LEU   9   3.829   6.668   9.187
   62   3HD2  LEU   9          3HD2      LEU   9   4.845   7.230   7.856
   63    H    LYS  10           H        LYS  10   2.944   5.497  11.719
   64    HA   LYS  10           HA       LYS  10   1.192   3.260  10.804
   65   1HB   LYS  10          1HB       LYS  10   1.325   5.107  13.075
   66   2HB   LYS  10          2HB       LYS  10  -0.300   4.929  12.409
   67   1HG   LYS  10          1HG       LYS  10   0.162   2.390  12.444
   68   2HG   LYS  10          2HG       LYS  10   1.509   2.783  13.513
   69   1HD   LYS  10          1HD       LYS  10  -0.173   4.073  14.938
   70   2HD   LYS  10          2HD       LYS  10  -1.433   3.300  13.977
   71   1HE   LYS  10          1HE       LYS  10  -0.253   1.067  14.572
   72   2HE   LYS  10          2HE       LYS  10   0.554   2.004  15.846
   73   1HZ   LYS  10          1HZ       LYS  10  -2.361   1.661  15.414
   74   2HZ   LYS  10          2HZ       LYS  10  -1.717   2.865  16.428
   75   3HZ   LYS  10          3HZ       LYS  10  -1.456   1.223  16.781
   76    H    MET  11           H        MET  11   0.261   3.635   8.867
   77    HA   MET  11           HA       MET  11  -0.286   6.362   7.900
   78   1HB   MET  11          1HB       MET  11  -0.067   3.624   6.886
   79   2HB   MET  11          2HB       MET  11  -1.467   4.456   6.214
   80   1HG   MET  11          1HG       MET  11   1.431   5.289   6.069
   81   2HG   MET  11          2HG       MET  11   0.340   4.939   4.735
   82   1HE   MET  11          1HE       MET  11   0.011   7.649   3.336
   83   2HE   MET  11          2HE       MET  11   1.430   6.737   3.844
   84   3HE   MET  11          3HE       MET  11   1.302   8.448   4.242
   85    H    ASP  12           H        ASP  12  -2.030   7.271   9.011
   86    HA   ASP  12           HA       ASP  12  -4.461   5.540   9.342
   87   1HB   ASP  12          1HB       ASP  12  -4.942   7.425  11.079
   88   2HB   ASP  12          2HB       ASP  12  -3.713   6.224  11.451
   89    H    LYS  13           H        LYS  13  -3.515   7.405   7.045
   90    HA   LYS  13           HA       LYS  13  -5.147   9.691   6.832
   91   1HB   LYS  13          1HB       LYS  13  -3.997   7.657   4.942
   92   2HB   LYS  13          2HB       LYS  13  -5.008   8.956   4.317
   93   1HG   LYS  13          1HG       LYS  13  -2.502   9.293   5.994
   94   2HG   LYS  13          2HG       LYS  13  -2.648   9.637   4.268
   95   1HD   LYS  13          1HD       LYS  13  -4.516  11.267   4.892
   96   2HD   LYS  13          2HD       LYS  13  -3.991  11.074   6.565
   97   1HE   LYS  13          1HE       LYS  13  -1.618  11.530   5.133
   98   2HE   LYS  13          2HE       LYS  13  -2.791  12.682   4.465
   99   1HZ   LYS  13          1HZ       LYS  13  -3.424  13.277   6.735
  100   2HZ   LYS  13          2HZ       LYS  13  -1.777  13.590   6.455
  101   3HZ   LYS  13          3HZ       LYS  13  -2.245  12.224   7.351
  102    H    THR  14           H        THR  14  -5.970   6.299   6.556
  103    HA   THR  14           HA       THR  14  -8.797   7.049   5.855
  104    HB   THR  14           HB       THR  14  -8.825   4.633   5.015
  105    HG1  THR  14           1HG      THR  14  -7.136   3.561   5.613
  106   1HG2  THR  14          1HG2      THR  14  -7.675   5.204   2.934
  107   2HG2  THR  14          2HG2      THR  14  -6.819   6.516   3.745
  108   3HG2  THR  14          3HG2      THR  14  -8.567   6.605   3.527
  109    H    LYS  15           H        LYS  15 -10.271   5.031   6.615
  110    HA   LYS  15           HA       LYS  15 -10.248   5.029   9.502
  111   1HB   LYS  15          1HB       LYS  15 -11.823   3.957   7.247
  112   2HB   LYS  15          2HB       LYS  15 -11.908   2.982   8.714
  113   1HG   LYS  15          1HG       LYS  15 -13.324   4.469   9.628
  114   2HG   LYS  15          2HG       LYS  15 -12.102   5.733   9.469
  115   1HD   LYS  15          1HD       LYS  15 -13.760   6.640   8.140
  116   2HD   LYS  15          2HD       LYS  15 -12.906   5.684   6.927
  117   1HE   LYS  15          1HE       LYS  15 -14.604   3.791   7.882
  118   2HE   LYS  15          2HE       LYS  15 -15.593   5.248   8.113
  119   1HZ   LYS  15          1HZ       LYS  15 -14.100   4.699   5.612
  120   2HZ   LYS  15          2HZ       LYS  15 -15.306   5.867   5.870
  121   3HZ   LYS  15          3HZ       LYS  15 -15.710   4.217   5.834
  122    H    GLN  16           H        GLN  16  -8.878   2.951   7.055
  123    HA   GLN  16           HA       GLN  16  -8.196   0.875   9.094
  124   1HB   GLN  16          1HB       GLN  16  -8.534   1.026   6.123
  125   2HB   GLN  16          2HB       GLN  16  -7.402  -0.171   6.756
  126   1HG   GLN  16          1HG       GLN  16  -9.445  -0.640   8.427
  127   2HG   GLN  16          2HG       GLN  16 -10.365  -0.021   7.054
  128   1HE2  GLN  16          2HE2      GLN  16 -10.521  -1.347   5.168
  129   2HE2  GLN  16          1HE2      GLN  16  -9.845  -2.900   5.072
  130    HA   PRO  17           HA       PRO  17  -4.402   3.448   8.661
  131   1HB   PRO  17          1HB       PRO  17  -3.599   3.081  11.258
  132   2HB   PRO  17          2HB       PRO  17  -4.726   4.358  10.755
  133   1HG   PRO  17          1HG       PRO  17  -5.309   1.694  11.968
  134   2HG   PRO  17          2HG       PRO  17  -6.033   3.273  12.317
  135   1HD   PRO  17          1HD       PRO  17  -7.270   1.442  10.773
  136   2HD   PRO  17          2HD       PRO  17  -7.432   3.190  10.483
  137    H    VAL  18           H        VAL  18  -2.505   2.542   7.971
  138    HA   VAL  18           HA       VAL  18  -1.904  -0.278   8.783
  139    HB   VAL  18           HB       VAL  18  -1.573   1.315   6.235
  140   1HG1  VAL  18          1HG1      VAL  18  -0.241  -0.483   5.320
  141   2HG1  VAL  18          2HG1      VAL  18  -0.410  -1.424   6.803
  142   3HG1  VAL  18          3HG1      VAL  18   0.535   0.066   6.807
  143   1HG2  VAL  18          1HG2      VAL  18  -3.233  -0.929   7.220
  144   2HG2  VAL  18          2HG2      VAL  18  -2.566  -1.154   5.604
  145   3HG2  VAL  18          3HG2      VAL  18  -3.573   0.251   5.954
  146    H    VAL  19           H        VAL  19   0.159  -0.658   9.594
  147    HA   VAL  19           HA       VAL  19   1.859   1.697  10.129
  148    HB   VAL  19           HB       VAL  19   1.943  -1.218  10.960
  149   1HG1  VAL  19          1HG1      VAL  19   4.108  -0.717  11.456
  150   2HG1  VAL  19          2HG1      VAL  19   3.410   0.173  12.809
  151   3HG1  VAL  19          3HG1      VAL  19   3.834   1.021  11.322
  152   1HG2  VAL  19          1HG2      VAL  19   0.695  -0.623  12.782
  153   2HG2  VAL  19          2HG2      VAL  19   0.156   0.682  11.726
  154   3HG2  VAL  19          3HG2      VAL  19   1.442   0.970  12.898
  155    H    PHE  20           H        PHE  20   3.643   2.151   8.859
  156    HA   PHE  20           HA       PHE  20   4.595   0.017   6.990
  157   1HB   PHE  20          1HB       PHE  20   3.822   2.132   5.987
  158   2HB   PHE  20          2HB       PHE  20   4.955   3.036   6.986
  159    HD1  PHE  20           HD1      PHE  20   4.968   0.077   4.685
  160    HD2  PHE  20           HD2      PHE  20   7.014   3.603   6.025
  161    HE1  PHE  20           HE1      PHE  20   6.758  -0.325   3.019
  162    HE2  PHE  20           HE2      PHE  20   8.797   3.201   4.358
  163    HZ   PHE  20           HZ       PHE  20   8.674   1.238   2.854
  164    H    ASN  21           H        ASN  21   6.482  -0.974   7.586
  165    HA   ASN  21           HA       ASN  21   8.270   0.380   9.537
  166   1HB   ASN  21          1HB       ASN  21   7.303  -2.271   8.966
  167   2HB   ASN  21          2HB       ASN  21   9.058  -2.258   8.876
  168   1HD2  ASN  21          2HD2      ASN  21   6.572  -0.738  11.014
  169   2HD2  ASN  21          1HD2      ASN  21   7.368  -1.133  12.460
  170    H    HIS  22           H        HIS  22   9.539   1.772   8.217
  171    HA   HIS  22           HA       HIS  22  10.486   1.363   5.621
  172   1HB   HIS  22          1HB       HIS  22  11.513   2.739   8.084
  173   2HB   HIS  22          2HB       HIS  22  12.529   2.698   6.645
  174    HD1  HIS  22           HD1      HIS  22   9.725   4.488   8.142
  175    HD2  HIS  22           HD2      HIS  22  11.099   3.833   4.257
  176    HE1  HIS  22           HE1      HIS  22   8.678   6.283   6.701
  177    H    SER  23           H        SER  23  11.742   0.027   8.664
  178    HA   SER  23           HA       SER  23  14.217  -1.012   7.863
  179   1HB   SER  23          1HB       SER  23  12.100  -1.610   9.822
  180   2HB   SER  23          2HB       SER  23  13.107  -3.000   9.427
  181    HG   SER  23           HG       SER  23  14.345  -2.061  10.882
  182    H    THR  24           H        THR  24  10.973  -2.417   7.372
  183    HA   THR  24           HA       THR  24  11.940  -4.778   5.979
  184    HB   THR  24           HB       THR  24   9.215  -3.936   5.388
  185    HG1  THR  24           1HG      THR  24   8.526  -3.755   7.500
  186   1HG2  THR  24          1HG2      THR  24   9.294  -6.035   7.280
  187   2HG2  THR  24          2HG2      THR  24  10.704  -6.250   6.243
  188   3HG2  THR  24          3HG2      THR  24   9.091  -6.175   5.533
  189    H    HIS  25           H        HIS  25  11.766  -1.526   5.107
  190    HA   HIS  25           HA       HIS  25  11.607  -2.214   2.205
  191   1HB   HIS  25          1HB       HIS  25  10.819   0.287   3.726
  192   2HB   HIS  25          2HB       HIS  25  10.612   0.026   1.997
  193    HD1  HIS  25           HD1      HIS  25   9.314  -1.108   5.332
  194    HD2  HIS  25           HD2      HIS  25   8.519  -1.766   1.295
  195    HE1  HIS  25           HE1      HIS  25   7.142  -2.406   5.233
  196    H    LYS  26           H        LYS  26  13.607  -1.065   4.704
  197    HA   LYS  26           HA       LYS  26  15.171   0.974   3.598
  198   1HB   LYS  26          1HB       LYS  26  16.892   0.135   5.083
  199   2HB   LYS  26          2HB       LYS  26  15.337  -0.177   5.856
  200   1HG   LYS  26          1HG       LYS  26  15.370  -2.490   4.982
  201   2HG   LYS  26          2HG       LYS  26  16.939  -2.179   4.238
  202   1HD   LYS  26          1HD       LYS  26  17.831  -1.613   6.522
  203   2HD   LYS  26          2HD       LYS  26  16.291  -2.142   7.198
  204   1HE   LYS  26          1HE       LYS  26  17.406  -4.161   7.330
  205   2HE   LYS  26          2HE       LYS  26  16.875  -4.294   5.642
  206   1HZ   LYS  26          1HZ       LYS  26  19.313  -4.591   5.952
  207   2HZ   LYS  26          2HZ       LYS  26  19.402  -2.980   6.483
  208   3HZ   LYS  26          3HZ       LYS  26  18.906  -3.328   4.896
  209    H    ALA  27           H        ALA  27  14.893  -2.363   2.622
  210    HA   ALA  27           HA       ALA  27  17.310  -2.264   0.916
  211   1HB   ALA  27          1HB       ALA  27  16.287  -4.227   2.349
  212   2HB   ALA  27          2HB       ALA  27  16.990  -4.582   0.771
  213   3HB   ALA  27          3HB       ALA  27  15.241  -4.447   0.946
  214    H    VAL  28           H        VAL  28  14.116  -1.251   0.690
  215    HA   VAL  28           HA       VAL  28  13.665  -1.962  -2.129
  216    HB   VAL  28           HB       VAL  28  12.251  -0.237  -0.082
  217   1HG1  VAL  28          1HG1      VAL  28  11.467  -0.922  -2.925
  218   2HG1  VAL  28          2HG1      VAL  28  11.753   0.687  -2.262
  219   3HG1  VAL  28          3HG1      VAL  28  10.358  -0.250  -1.731
  220   1HG2  VAL  28          1HG2      VAL  28  10.874  -2.059   0.292
  221   2HG2  VAL  28          2HG2      VAL  28  12.371  -2.900  -0.113
  222   3HG2  VAL  28          3HG2      VAL  28  11.113  -2.701  -1.333
  223    H    LYS  29           H        LYS  29  13.005   0.054  -3.558
  224    HA   LYS  29           HA       LYS  29  15.341   1.860  -3.513
  225   1HB   LYS  29          1HB       LYS  29  13.486   0.761  -5.432
  226   2HB   LYS  29          2HB       LYS  29  13.566   2.517  -5.586
  227   1HG   LYS  29          1HG       LYS  29  15.390   2.011  -6.877
  228   2HG   LYS  29          2HG       LYS  29  16.184   2.006  -5.300
  229   1HD   LYS  29          1HD       LYS  29  15.770  -0.447  -5.137
  230   2HD   LYS  29          2HD       LYS  29  15.085  -0.414  -6.762
  231   1HE   LYS  29          1HE       LYS  29  17.905   0.508  -6.104
  232   2HE   LYS  29          2HE       LYS  29  17.504  -1.096  -6.749
  233   1HZ   LYS  29          1HZ       LYS  29  17.825   0.111  -8.671
  234   2HZ   LYS  29          2HZ       LYS  29  17.187   1.544  -8.017
  235   3HZ   LYS  29          3HZ       LYS  29  16.150   0.273  -8.458
  236    H    CYS  30           H        CYS  30  15.067   3.471  -2.072
  237    HA   CYS  30           HA       CYS  30  12.768   4.658  -1.039
  238   1HB   CYS  30          1HB       CYS  30  15.498   5.716  -1.770
  239   2HB   CYS  30          2HB       CYS  30  14.299   6.780  -1.042
  240    H    GLY  31           H        GLY  31  14.099   4.946  -4.251
  241   1HA   GLY  31          1HA       GLY  31  12.375   7.237  -4.940
  242   2HA   GLY  31          2HA       GLY  31  13.517   6.438  -6.024
  243    H    ASP  32           H        ASP  32  12.127   3.816  -4.877
  244    HA   ASP  32           HA       ASP  32  10.261   3.594  -7.126
  245   1HB   ASP  32          1HB       ASP  32  11.826   1.917  -5.514
  246   2HB   ASP  32          2HB       ASP  32  10.168   1.492  -5.110
  247    H    CYS  33           H        CYS  33  10.146   4.090  -3.651
  248    HA   CYS  33           HA       CYS  33   7.176   3.967  -3.597
  249   1HB   CYS  33          1HB       CYS  33   9.448   4.189  -1.621
  250   2HB   CYS  33          2HB       CYS  33   7.815   4.610  -1.115
  251    H    HIS  34           H        HIS  34   9.739   6.267  -2.568
  252    HA   HIS  34           HA       HIS  34   7.884   8.556  -2.868
  253   1HB   HIS  34          1HB       HIS  34  10.787   8.236  -2.024
  254   2HB   HIS  34          2HB       HIS  34   9.947   9.777  -2.055
  255    HD1  HIS  34           HD1      HIS  34   7.514   9.637  -0.601
  256    HD2  HIS  34           HD2      HIS  34  10.604   7.040   0.440
  257    HE1  HIS  34           HE1      HIS  34   7.051   8.880   1.773
  258    H    HIS  35           H        HIS  35   8.333   7.201  -5.298
  259    HA   HIS  35           HA       HIS  35  10.378   7.684  -7.001
  260   1HB   HIS  35          1HB       HIS  35   8.545   8.198  -8.723
  261   2HB   HIS  35          2HB       HIS  35   8.363   6.715  -7.804
  262    HD1  HIS  35           HD1      HIS  35   7.031  10.160  -8.117
  263    HD2  HIS  35           HD2      HIS  35   6.137   6.683  -6.022
  264    HE1  HIS  35           HE1      HIS  35   4.766  10.538  -7.062
  265    HA   PRO  36           HA       PRO  36  11.396  11.884  -7.388
  266   1HB   PRO  36          1HB       PRO  36  11.712  12.182 -10.097
  267   2HB   PRO  36          2HB       PRO  36  12.873  11.322  -9.064
  268   1HG   PRO  36          1HG       PRO  36  10.697  10.217 -10.785
  269   2HG   PRO  36          2HG       PRO  36  12.362   9.649 -10.574
  270   1HD   PRO  36          1HD       PRO  36  10.293   8.459  -9.336
  271   2HD   PRO  36          2HD       PRO  36  11.893   8.597  -8.567
  272    H    VAL  37           H        VAL  37   9.814  13.316  -6.894
  273    HA   VAL  37           HA       VAL  37   7.710  13.895  -8.953
  274    HB   VAL  37           HB       VAL  37   7.651  13.816  -5.927
  275   1HG1  VAL  37          1HG1      VAL  37   5.554  14.868  -7.851
  276   2HG1  VAL  37          2HG1      VAL  37   6.461  15.827  -6.681
  277   3HG1  VAL  37          3HG1      VAL  37   5.308  14.615  -6.123
  278   1HG2  VAL  37          1HG2      VAL  37   6.053  12.396  -8.081
  279   2HG2  VAL  37          2HG2      VAL  37   5.800  12.215  -6.345
  280   3HG2  VAL  37          3HG2      VAL  37   7.309  11.670  -7.078
  281    H    ASN  38           H        ASN  38   7.078  16.187  -9.028
  282    HA   ASN  38           HA       ASN  38   7.693  18.482  -9.154
  283   1HB   ASN  38          1HB       ASN  38   7.094  17.841  -6.729
  284   2HB   ASN  38          2HB       ASN  38   8.812  17.900  -6.421
  285   1HD2  ASN  38          2HD2      ASN  38   9.924  20.031  -7.160
  286   2HD2  ASN  38          1HD2      ASN  38   9.047  21.466  -6.934
  287    H    GLY  39           H        GLY  39   9.871  16.282  -9.731
  288   1HA   GLY  39          1HA       GLY  39  12.027  16.697 -10.708
  289   2HA   GLY  39          2HA       GLY  39  12.119  18.206  -9.793
  290    H    LYS  40           H        LYS  40  10.986  16.296  -7.498
  291    HA   LYS  40           HA       LYS  40  13.571  14.940  -6.841
  292   1HB   LYS  40          1HB       LYS  40  13.556  16.076  -4.631
  293   2HB   LYS  40          2HB       LYS  40  13.665  17.238  -5.955
  294   1HG   LYS  40          1HG       LYS  40  11.034  17.227  -5.787
  295   2HG   LYS  40          2HG       LYS  40  11.343  16.635  -4.154
  296   1HD   LYS  40          1HD       LYS  40  13.093  18.650  -4.151
  297   2HD   LYS  40          2HD       LYS  40  11.979  19.293  -5.358
  298   1HE   LYS  40          1HE       LYS  40  10.223  19.477  -3.840
  299   2HE   LYS  40          2HE       LYS  40  10.850  18.177  -2.805
  300   1HZ   LYS  40          1HZ       LYS  40  11.190  20.634  -2.093
  301   2HZ   LYS  40          2HZ       LYS  40  12.452  20.610  -3.230
  302   3HZ   LYS  40          3HZ       LYS  40  12.466  19.531  -1.917
  303    H    GLU  41           H        GLU  41  13.270  13.089  -5.558
  304    HA   GLU  41           HA       GLU  41  10.694  11.862  -5.448
  305   1HB   GLU  41          1HB       GLU  41  13.337  11.420  -4.054
  306   2HB   GLU  41          2HB       GLU  41  11.953  10.375  -3.744
  307   1HG   GLU  41          1HG       GLU  41  11.973   9.483  -5.884
  308   2HG   GLU  41          2HG       GLU  41  12.709  10.922  -6.590
  309    H    ASP  42           H        ASP  42   9.028  12.697  -4.219
  310    HA   ASP  42           HA       ASP  42   9.383  14.352  -1.905
  311   1HB   ASP  42          1HB       ASP  42   7.055  12.587  -2.700
  312   2HB   ASP  42          2HB       ASP  42   6.985  13.990  -1.637
  313    H    TYR  43           H        TYR  43  10.681  13.399  -0.332
  314    HA   TYR  43           HA       TYR  43  10.287  10.619   0.510
  315   1HB   TYR  43          1HB       TYR  43  11.941  12.914   1.616
  316   2HB   TYR  43          2HB       TYR  43  12.101  11.227   2.101
  317    HD1  TYR  43           HD1      TYR  43  12.466   9.504   0.125
  318    HD2  TYR  43           HD2      TYR  43  13.258  13.721  -0.134
  319    HE1  TYR  43           HE1      TYR  43  13.988   9.102  -1.790
  320    HE2  TYR  43           HE2      TYR  43  14.779  13.316  -2.051
  321    HH   TYR  43           HH       TYR  43  16.067  11.566  -3.035
  322    H    GLN  44           H        GLN  44   7.869  11.997   0.817
  323    HA   GLN  44           HA       GLN  44   7.683  12.305   3.799
  324   1HB   GLN  44          1HB       GLN  44   5.772  13.906   3.148
  325   2HB   GLN  44          2HB       GLN  44   7.413  14.463   2.821
  326   1HG   GLN  44          1HG       GLN  44   7.231  13.815   0.490
  327   2HG   GLN  44          2HG       GLN  44   5.658  13.070   0.781
  328   1HE2  GLN  44          2HE2      GLN  44   6.576  16.127   2.319
  329   2HE2  GLN  44          1HE2      GLN  44   5.491  17.095   1.445
  330    H    LYS  45           H        LYS  45   5.313  11.961   4.516
  331    HA   LYS  45           HA       LYS  45   4.426   9.390   4.206
  332   1HB   LYS  45          1HB       LYS  45   2.074  10.514   4.522
  333   2HB   LYS  45          2HB       LYS  45   3.293  10.688   5.779
  334   1HG   LYS  45          1HG       LYS  45   3.917  12.885   4.937
  335   2HG   LYS  45          2HG       LYS  45   2.833  12.700   3.558
  336   1HD   LYS  45          1HD       LYS  45   1.868  14.095   5.411
  337   2HD   LYS  45          2HD       LYS  45   0.894  12.679   5.015
  338   1HE   LYS  45          1HE       LYS  45   1.329  11.656   7.028
  339   2HE   LYS  45          2HE       LYS  45   2.984  12.294   7.107
  340   1HZ   LYS  45          1HZ       LYS  45   2.253  14.355   7.817
  341   2HZ   LYS  45          2HZ       LYS  45   1.201  13.310   8.647
  342   3HZ   LYS  45          3HZ       LYS  45   0.672  14.118   7.249
  343    H    CYS  46           H        CYS  46   3.321   8.196   2.694
  344    HA   CYS  46           HA       CYS  46   3.306   8.890  -0.043
  345   1HB   CYS  46          1HB       CYS  46   1.558   6.976   1.523
  346   2HB   CYS  46          2HB       CYS  46   1.833   6.907  -0.211
  347    H    ALA  47           H        ALA  47   0.727   9.125   2.381
  348    HA   ALA  47           HA       ALA  47  -1.022  10.502   0.389
  349   1HB   ALA  47          1HB       ALA  47  -2.670  10.101   2.352
  350   2HB   ALA  47          2HB       ALA  47  -1.399   9.074   3.011
  351   3HB   ALA  47          3HB       ALA  47  -2.111   8.697   1.443
  352    H    THR  48           H        THR  48   0.955  12.174   1.080
  353    HA   THR  48           HA       THR  48   0.929  13.684   3.411
  354    HB   THR  48           HB       THR  48   1.047  15.167   0.842
  355    HG1  THR  48           1HG      THR  48   3.121  13.381   1.296
  356   1HG2  THR  48          1HG2      THR  48   3.457  15.443   1.919
  357   2HG2  THR  48          2HG2      THR  48   2.628  14.862   3.363
  358   3HG2  THR  48          3HG2      THR  48   2.074  16.331   2.558
  359    H    ALA  49           H        ALA  49   0.136  16.226   3.049
  360    HA   ALA  49           HA       ALA  49  -2.732  16.141   3.445
  361   1HB   ALA  49          1HB       ALA  49  -1.407  17.735   4.636
  362   2HB   ALA  49          2HB       ALA  49  -2.337  18.678   3.471
  363   3HB   ALA  49          3HB       ALA  49  -0.642  18.309   3.154
  364    H    GLY  50           H        GLY  50  -0.678  16.731   0.671
  365   1HA   GLY  50          1HA       GLY  50  -3.135  17.197  -0.963
  366   2HA   GLY  50          2HA       GLY  50  -1.710  18.210  -1.200
  367    H    CYS  51           H        CYS  51  -1.755  14.753  -0.508
  368    HA   CYS  51           HA       CYS  51  -0.623  14.247  -3.235
  369   1HB   CYS  51          1HB       CYS  51   0.725  14.321  -0.857
  370   2HB   CYS  51          2HB       CYS  51   0.348  12.626  -0.953
  371    H    HIS  52           H        HIS  52  -0.499  11.417  -1.531
  372    HA   HIS  52           HA       HIS  52  -2.869  10.329  -2.856
  373   1HB   HIS  52          1HB       HIS  52  -0.810   9.251  -0.919
  374   2HB   HIS  52          2HB       HIS  52  -2.080   8.259  -1.598
  375    HD1  HIS  52           HD1      HIS  52  -2.159   8.730  -4.399
  376    HD2  HIS  52           HD2      HIS  52   1.482   8.929  -2.413
  377    HE1  HIS  52           HE1      HIS  52  -0.370   8.374  -6.164
  378    H    ASP  53           H        ASP  53  -3.866  12.298  -1.268
  379    HA   ASP  53           HA       ASP  53  -4.759  10.988   1.265
  380   1HB   ASP  53          1HB       ASP  53  -5.271  13.319   1.929
  381   2HB   ASP  53          2HB       ASP  53  -3.593  13.153   1.410
  382    H    ASN  54           H        ASN  54  -5.940  10.611  -1.586
  383    HA   ASN  54           HA       ASN  54  -8.565  11.908  -1.411
  384   1HB   ASN  54          1HB       ASN  54  -7.020  10.867  -3.406
  385   2HB   ASN  54          2HB       ASN  54  -8.144   9.541  -3.148
  386   1HD2  ASN  54          2HD2      ASN  54  -9.873   9.723  -4.565
  387   2HD2  ASN  54          1HD2      ASN  54 -10.622  11.180  -5.012
  388    H    MET  55           H        MET  55  -9.760  11.203   0.354
  389    HA   MET  55           HA       MET  55  -9.665   8.444   1.292
  390   1HB   MET  55          1HB       MET  55 -11.580  10.706   1.949
  391   2HB   MET  55          2HB       MET  55 -11.224   9.299   2.951
  392   1HG   MET  55          1HG       MET  55  -9.173  11.371   2.125
  393   2HG   MET  55          2HG       MET  55  -9.992  11.345   3.686
  394   1HE   MET  55          1HE       MET  55  -7.246  11.589   3.103
  395   2HE   MET  55          2HE       MET  55  -6.141  10.231   3.298
  396   3HE   MET  55          3HE       MET  55  -6.920  10.934   4.713
  397    H    ASP  56           H        ASP  56 -10.831   9.328  -1.510
  398    HA   ASP  56           HA       ASP  56 -13.624   8.473  -1.363
  399   1HB   ASP  56          1HB       ASP  56 -12.043   9.953  -3.073
  400   2HB   ASP  56          2HB       ASP  56 -12.215   8.434  -3.954
  401    H    LYS  57           H        LYS  57 -10.540   6.950  -1.633
  402    HA   LYS  57           HA       LYS  57  -9.930   4.688  -1.938
  403   1HB   LYS  57          1HB       LYS  57 -12.868   4.319  -1.293
  404   2HB   LYS  57          2HB       LYS  57 -11.592   3.125  -1.066
  405   1HG   LYS  57          1HG       LYS  57 -10.582   4.372   0.677
  406   2HG   LYS  57          2HG       LYS  57 -11.472   5.836   0.256
  407   1HD   LYS  57          1HD       LYS  57 -12.664   3.290   1.396
  408   2HD   LYS  57          2HD       LYS  57 -12.456   4.817   2.255
  409   1HE   LYS  57          1HE       LYS  57 -13.833   5.542  -0.069
  410   2HE   LYS  57          2HE       LYS  57 -14.592   4.019   0.437
  411   1HZ   LYS  57          1HZ       LYS  57 -15.098   4.850   2.511
  412   2HZ   LYS  57          2HZ       LYS  57 -15.338   6.226   1.543
  413   3HZ   LYS  57          3HZ       LYS  57 -13.910   6.058   2.449
  414    H    LYS  58           H        LYS  58 -11.443   6.353  -4.148
  415    HA   LYS  58           HA       LYS  58 -11.909   4.002  -5.952
  416   1HB   LYS  58          1HB       LYS  58 -13.459   6.608  -5.792
  417   2HB   LYS  58          2HB       LYS  58 -13.797   5.275  -6.897
  418   1HG   LYS  58          1HG       LYS  58 -13.621   4.391  -4.116
  419   2HG   LYS  58          2HG       LYS  58 -14.888   5.595  -4.359
  420   1HD   LYS  58          1HD       LYS  58 -14.547   3.135  -6.095
  421   2HD   LYS  58          2HD       LYS  58 -15.654   3.223  -4.725
  422   1HE   LYS  58          1HE       LYS  58 -16.791   5.169  -5.797
  423   2HE   LYS  58          2HE       LYS  58 -15.726   4.982  -7.203
  424   1HZ   LYS  58          1HZ       LYS  58 -17.969   3.745  -7.204
  425   2HZ   LYS  58          2HZ       LYS  58 -17.212   2.672  -6.125
  426   3HZ   LYS  58          3HZ       LYS  58 -16.580   2.899  -7.686
  427    H    ASP  59           H        ASP  59 -10.596   7.215  -5.497
  428    HA   ASP  59           HA       ASP  59 -10.192   8.071  -8.156
  429   1HB   ASP  59          1HB       ASP  59  -9.690   9.557  -6.392
  430   2HB   ASP  59          2HB       ASP  59  -8.690   8.367  -5.557
  431    H    LYS  60           H        LYS  60  -9.417   6.645  -9.702
  432    HA   LYS  60           HA       LYS  60  -7.222   4.773  -9.053
  433   1HB   LYS  60          1HB       LYS  60  -9.370   5.085 -10.989
  434   2HB   LYS  60          2HB       LYS  60  -7.844   4.720 -11.797
  435   1HG   LYS  60          1HG       LYS  60  -8.560   3.143  -9.358
  436   2HG   LYS  60          2HG       LYS  60  -9.394   2.770 -10.867
  437   1HD   LYS  60          1HD       LYS  60  -6.385   2.999 -10.727
  438   2HD   LYS  60          2HD       LYS  60  -7.220   1.479 -10.403
  439   1HE   LYS  60          1HE       LYS  60  -8.033   1.310 -12.612
  440   2HE   LYS  60          2HE       LYS  60  -7.792   3.040 -12.927
  441   1HZ   LYS  60          1HZ       LYS  60  -5.336   2.348 -12.234
  442   2HZ   LYS  60          2HZ       LYS  60  -5.879   2.287 -13.842
  443   3HZ   LYS  60          3HZ       LYS  60  -5.842   0.873 -12.901
  444    H    SER  61           H        SER  61  -6.910   7.838  -9.251
  445    HA   SER  61           HA       SER  61  -5.028   8.050 -11.548
  446   1HB   SER  61          1HB       SER  61  -6.918   9.717 -10.349
  447   2HB   SER  61          2HB       SER  61  -5.376  10.374  -9.810
  448    HG   SER  61           HG       SER  61  -5.115  11.116 -11.749
  449    H    ALA  62           H        ALA  62  -3.239   9.910 -10.553
  450    HA   ALA  62           HA       ALA  62  -1.574   8.240  -8.771
  451   1HB   ALA  62          1HB       ALA  62  -0.004   9.181 -10.092
  452   2HB   ALA  62          2HB       ALA  62  -0.414  10.768  -9.444
  453   3HB   ALA  62          3HB       ALA  62  -1.249  10.155 -10.871
  454    H    LYS  63           H        LYS  63  -4.057   9.909  -7.873
  455    HA   LYS  63           HA       LYS  63  -2.646  11.404  -5.683
  456   1HB   LYS  63          1HB       LYS  63  -4.159  12.436  -7.735
  457   2HB   LYS  63          2HB       LYS  63  -5.361  12.251  -6.454
  458   1HG   LYS  63          1HG       LYS  63  -4.447  13.905  -5.195
  459   2HG   LYS  63          2HG       LYS  63  -2.798  13.376  -5.537
  460   1HD   LYS  63          1HD       LYS  63  -2.694  15.269  -6.796
  461   2HD   LYS  63          2HD       LYS  63  -3.568  14.308  -7.989
  462   1HE   LYS  63          1HE       LYS  63  -5.701  15.189  -7.237
  463   2HE   LYS  63          2HE       LYS  63  -4.924  16.018  -5.873
  464   1HZ   LYS  63          1HZ       LYS  63  -5.266  17.475  -7.832
  465   2HZ   LYS  63          2HZ       LYS  63  -4.227  16.472  -8.726
  466   3HZ   LYS  63          3HZ       LYS  63  -3.637  17.331  -7.384
  467    H    GLY  64           H        GLY  64  -5.006   9.029  -6.542
  468   1HA   GLY  64          1HA       GLY  64  -6.514   9.245  -4.047
  469   2HA   GLY  64          2HA       GLY  64  -6.715   7.995  -5.265
  470    H    TYR  65           H        TYR  65  -5.859   8.397  -2.162
  471    HA   TYR  65           HA       TYR  65  -3.464   7.045  -1.661
  472   1HB   TYR  65          1HB       TYR  65  -5.375   8.087  -0.162
  473   2HB   TYR  65          2HB       TYR  65  -5.991   6.437  -0.140
  474    HD1  TYR  65           HD1      TYR  65  -5.586   6.586   2.367
  475    HD2  TYR  65           HD2      TYR  65  -2.401   6.702  -0.514
  476    HE1  TYR  65           HE1      TYR  65  -3.959   5.989   4.137
  477    HE2  TYR  65           HE2      TYR  65  -0.779   6.106   1.258
  478    HH   TYR  65           HH       TYR  65  -1.848   5.538   4.611
  479    H    TYR  66           H        TYR  66  -6.678   5.491  -1.688
  480    HA   TYR  66           HA       TYR  66  -6.090   2.822  -1.604
  481   1HB   TYR  66          1HB       TYR  66  -8.231   4.370  -2.149
  482   2HB   TYR  66          2HB       TYR  66  -7.952   3.689  -3.749
  483    HD1  TYR  66           HD1      TYR  66  -7.735   1.145  -3.962
  484    HD2  TYR  66           HD2      TYR  66  -9.254   3.106  -0.461
  485    HE1  TYR  66           HE1      TYR  66  -8.805  -0.975  -3.244
  486    HE2  TYR  66           HE2      TYR  66 -10.327   0.988   0.258
  487    HH   TYR  66           HH       TYR  66 -11.065  -1.394  -1.516
  488    H    HIS  67           H        HIS  67  -6.510   4.432  -4.764
  489    HA   HIS  67           HA       HIS  67  -5.673   2.514  -6.504
  490   1HB   HIS  67          1HB       HIS  67  -6.332   4.672  -7.278
  491   2HB   HIS  67          2HB       HIS  67  -5.015   5.460  -6.407
  492    HD1  HIS  67           HD1      HIS  67  -5.430   2.837  -9.135
  493    HD2  HIS  67           HD2      HIS  67  -2.762   5.817  -7.972
  494    HE1  HIS  67           HE1      HIS  67  -3.566   2.829 -10.841
  495    H    ALA  68           H        ALA  68  -3.202   4.944  -5.825
  496    HA   ALA  68           HA       ALA  68  -0.956   3.492  -6.521
  497   1HB   ALA  68          1HB       ALA  68  -0.453   5.665  -6.001
  498   2HB   ALA  68          2HB       ALA  68  -0.022   4.970  -4.437
  499   3HB   ALA  68          3HB       ALA  68  -1.604   5.715  -4.666
  500    H    MET  69           H        MET  69  -2.873   3.049  -3.607
  501    HA   MET  69           HA       MET  69  -0.760   1.481  -2.279
  502   1HB   MET  69          1HB       MET  69  -3.616   2.196  -1.598
  503   2HB   MET  69          2HB       MET  69  -2.510   1.367  -0.507
  504   1HG   MET  69          1HG       MET  69  -1.303   3.746  -1.674
  505   2HG   MET  69          2HG       MET  69  -2.773   4.128  -0.777
  506   1HE   MET  69          1HE       MET  69   0.585   3.856  -0.956
  507   2HE   MET  69          2HE       MET  69   1.294   3.575   0.634
  508   3HE   MET  69          3HE       MET  69   0.408   5.066   0.323
  509    H    HIS  70           H        HIS  70  -3.849   0.831  -3.945
  510    HA   HIS  70           HA       HIS  70  -3.400  -2.072  -3.392
  511   1HB   HIS  70          1HB       HIS  70  -5.870  -0.567  -4.308
  512   2HB   HIS  70          2HB       HIS  70  -5.807  -2.259  -3.813
  513    HD1  HIS  70           HD1      HIS  70  -5.869   1.209  -2.464
  514    HD2  HIS  70           HD2      HIS  70  -5.359  -2.652  -0.986
  515    HE1  HIS  70           HE1      HIS  70  -6.078   1.376   0.055
  516    H    ASP  71           H        ASP  71  -3.170   0.263  -5.891
  517    HA   ASP  71           HA       ASP  71  -3.830  -1.564  -8.095
  518   1HB   ASP  71          1HB       ASP  71  -2.732   1.228  -7.782
  519   2HB   ASP  71          2HB       ASP  71  -2.830   0.463  -9.366
  520    H    LYS  72           H        LYS  72  -2.185  -2.084  -9.777
  521    HA   LYS  72           HA       LYS  72   0.516  -2.555  -8.563
  522   1HB   LYS  72          1HB       LYS  72  -0.873  -4.097 -10.769
  523   2HB   LYS  72          2HB       LYS  72   0.540  -4.599  -9.841
  524   1HG   LYS  72          1HG       LYS  72  -0.812  -5.554  -8.321
  525   2HG   LYS  72          2HG       LYS  72  -1.519  -3.975  -7.976
  526   1HD   LYS  72          1HD       LYS  72  -3.092  -4.279  -9.869
  527   2HD   LYS  72          2HD       LYS  72  -2.407  -5.876 -10.166
  528   1HE   LYS  72          1HE       LYS  72  -3.639  -6.800  -8.500
  529   2HE   LYS  72          2HE       LYS  72  -3.174  -5.519  -7.363
  530   1HZ   LYS  72          1HZ       LYS  72  -5.011  -4.918  -9.584
  531   2HZ   LYS  72          2HZ       LYS  72  -4.849  -4.134  -8.085
  532   3HZ   LYS  72          3HZ       LYS  72  -5.616  -5.648  -8.178
  533    H    GLY  73           H        GLY  73  -0.986  -2.332 -11.800
  534   1HA   GLY  73          1HA       GLY  73   1.442  -1.467 -13.085
  535   2HA   GLY  73          2HA       GLY  73  -0.175  -1.358 -13.784
  536    H    THR  74           H        THR  74   1.578   0.156 -11.058
  537    HA   THR  74           HA       THR  74   0.266   2.751 -11.733
  538    HB   THR  74           HB       THR  74   1.372   3.209  -9.383
  539    HG1  THR  74           1HG      THR  74   1.147   0.413  -9.235
  540   1HG2  THR  74          1HG2      THR  74  -0.566   1.949  -8.298
  541   2HG2  THR  74          2HG2      THR  74  -0.960   1.360  -9.915
  542   3HG2  THR  74          3HG2      THR  74  -1.006   3.089  -9.570
  543    H    LYS  75           H        LYS  75   1.659   4.713 -11.612
  544    HA   LYS  75           HA       LYS  75   3.838   4.882 -13.270
  545   1HB   LYS  75          1HB       LYS  75   2.540   6.572 -11.633
  546   2HB   LYS  75          2HB       LYS  75   3.990   6.347 -10.660
  547   1HG   LYS  75          1HG       LYS  75   4.171   8.279 -12.233
  548   2HG   LYS  75          2HG       LYS  75   5.401   7.049 -12.518
  549   1HD   LYS  75          1HD       LYS  75   3.053   6.389 -14.037
  550   2HD   LYS  75          2HD       LYS  75   3.506   8.061 -14.373
  551   1HE   LYS  75          1HE       LYS  75   5.426   7.447 -15.451
  552   2HE   LYS  75          2HE       LYS  75   5.776   6.156 -14.282
  553   1HZ   LYS  75          1HZ       LYS  75   5.000   5.504 -16.642
  554   2HZ   LYS  75          2HZ       LYS  75   3.455   5.942 -16.088
  555   3HZ   LYS  75          3HZ       LYS  75   4.320   4.705 -15.309
  556    H    PHE  76           H        PHE  76   3.821   3.708  -9.946
  557    HA   PHE  76           HA       PHE  76   6.597   2.654 -10.328
  558   1HB   PHE  76          1HB       PHE  76   5.548   4.124  -7.890
  559   2HB   PHE  76          2HB       PHE  76   7.172   3.484  -8.101
  560    HD1  PHE  76           HD1      PHE  76   8.601   4.414 -10.016
  561    HD2  PHE  76           HD2      PHE  76   4.926   6.225  -8.729
  562    HE1  PHE  76           HE1      PHE  76   9.230   6.518 -11.170
  563    HE2  PHE  76           HE2      PHE  76   5.555   8.325  -9.880
  564    HZ   PHE  76           HZ       PHE  76   7.701   8.466 -11.098
  565    H    LYS  77           H        LYS  77   7.063   1.102  -8.320
  566    HA   LYS  77           HA       LYS  77   4.894  -0.825  -8.246
  567   1HB   LYS  77          1HB       LYS  77   6.414  -2.013  -6.728
  568   2HB   LYS  77          2HB       LYS  77   7.283  -1.435  -8.148
  569   1HG   LYS  77          1HG       LYS  77   7.743   0.675  -6.662
  570   2HG   LYS  77          2HG       LYS  77   7.373  -0.418  -5.328
  571   1HD   LYS  77          1HD       LYS  77   9.544  -0.715  -7.417
  572   2HD   LYS  77          2HD       LYS  77   9.746  -0.562  -5.671
  573   1HE   LYS  77          1HE       LYS  77   9.512  -2.802  -5.392
  574   2HE   LYS  77          2HE       LYS  77   8.020  -2.819  -6.353
  575   1HZ   LYS  77          1HZ       LYS  77   9.425  -3.951  -7.744
  576   2HZ   LYS  77          2HZ       LYS  77  10.806  -3.094  -7.244
  577   3HZ   LYS  77          3HZ       LYS  77   9.684  -2.367  -8.292
  578    H    SER  78           H        SER  78   3.162  -0.468  -7.096
  579    HA   SER  78           HA       SER  78   2.969   1.470  -4.943
  580   1HB   SER  78          1HB       SER  78   0.624   0.051  -4.998
  581   2HB   SER  78          2HB       SER  78   0.997   1.400  -6.066
  582    HG   SER  78           HG       SER  78   0.525  -1.083  -6.744
  583    H    CYS  79           H        CYS  79   1.592   0.670  -2.953
  584    HA   CYS  79           HA       CYS  79   3.195  -0.999  -1.303
  585   1HB   CYS  79          1HB       CYS  79   0.290  -0.136  -1.207
  586   2HB   CYS  79          2HB       CYS  79   1.124  -0.889   0.148
  587    H    VAL  80           H        VAL  80  -0.132  -1.739  -2.380
  588    HA   VAL  80           HA       VAL  80   0.153  -4.586  -1.932
  589    HB   VAL  80           HB       VAL  80  -1.802  -2.792  -3.373
  590   1HG1  VAL  80          1HG1      VAL  80  -3.094  -5.209  -2.970
  591   2HG1  VAL  80          2HG1      VAL  80  -1.496  -5.701  -3.530
  592   3HG1  VAL  80          3HG1      VAL  80  -2.483  -4.623  -4.517
  593   1HG2  VAL  80          1HG2      VAL  80  -1.416  -3.271  -0.700
  594   2HG2  VAL  80          2HG2      VAL  80  -2.623  -4.495  -1.096
  595   3HG2  VAL  80          3HG2      VAL  80  -2.961  -2.792  -1.402
  596    H    GLY  81           H        GLY  81   0.769  -2.432  -4.628
  597   1HA   GLY  81          1HA       GLY  81   0.786  -4.423  -6.715
  598   2HA   GLY  81          2HA       GLY  81   1.558  -2.838  -6.805
  599    H    CYS  82           H        CYS  82   3.326  -3.032  -4.638
  600    HA   CYS  82           HA       CYS  82   5.453  -4.675  -5.793
  601   1HB   CYS  82          1HB       CYS  82   5.581  -2.397  -4.565
  602   2HB   CYS  82          2HB       CYS  82   5.390  -3.325  -3.081
  603    H    HIS  83           H        HIS  83   3.026  -4.965  -3.365
  604    HA   HIS  83           HA       HIS  83   4.229  -7.087  -1.810
  605   1HB   HIS  83          1HB       HIS  83   1.620  -5.668  -2.113
  606   2HB   HIS  83          2HB       HIS  83   1.616  -7.191  -1.245
  607    HD1  HIS  83           HD1      HIS  83   1.191  -5.883   1.020
  608    HD2  HIS  83           HD2      HIS  83   4.787  -4.955  -0.876
  609    HE1  HIS  83           HE1      HIS  83   2.609  -4.680   2.733
  610    H    LEU  84           H        LEU  84   1.480  -7.105  -4.150
  611    HA   LEU  84           HA       LEU  84   1.134  -9.886  -4.358
  612   1HB   LEU  84          1HB       LEU  84   0.286  -7.494  -5.569
  613   2HB   LEU  84          2HB       LEU  84   0.916  -8.475  -6.888
  614    HG   LEU  84           HG       LEU  84  -0.883  -9.724  -4.846
  615   1HD1  LEU  84          1HD1      LEU  84  -1.916  -8.337  -7.327
  616   2HD1  LEU  84          2HD1      LEU  84  -1.911  -7.560  -5.744
  617   3HD1  LEU  84          3HD1      LEU  84  -2.855  -9.028  -6.002
  618   1HD2  LEU  84          1HD2      LEU  84   0.023 -10.233  -7.655
  619   2HD2  LEU  84          2HD2      LEU  84  -1.561 -10.837  -7.167
  620   3HD2  LEU  84          3HD2      LEU  84  -0.114 -11.358  -6.304
  621    H    GLU  85           H        GLU  85   3.667  -7.820  -5.614
  622    HA   GLU  85           HA       GLU  85   4.731  -9.948  -7.388
  623   1HB   GLU  85          1HB       GLU  85   5.069  -7.028  -6.929
  624   2HB   GLU  85          2HB       GLU  85   6.496  -7.890  -7.502
  625   1HG   GLU  85          1HG       GLU  85   4.678  -8.953  -9.171
  626   2HG   GLU  85          2HG       GLU  85   3.902  -7.397  -8.879
  627    H    THR  86           H        THR  86   5.877  -7.944  -4.637
  628    HA   THR  86           HA       THR  86   8.358  -9.194  -4.183
  629    HB   THR  86           HB       THR  86   6.278  -7.855  -2.459
  630    HG1  THR  86           1HG      THR  86   8.819  -7.274  -3.515
  631   1HG2  THR  86          1HG2      THR  86   7.777  -7.946  -0.545
  632   2HG2  THR  86          2HG2      THR  86   8.968  -8.850  -1.481
  633   3HG2  THR  86          3HG2      THR  86   7.422  -9.592  -1.070
  634    H    ALA  87           H        ALA  87   5.155 -10.436  -3.719
  635    HA   ALA  87           HA       ALA  87   5.978 -12.558  -1.848
  636   1HB   ALA  87          1HB       ALA  87   3.793 -11.892  -1.451
  637   2HB   ALA  87          2HB       ALA  87   3.482 -13.206  -2.586
  638   3HB   ALA  87          3HB       ALA  87   3.488 -11.535  -3.152
  639    H    GLY  88           H        GLY  88   5.188 -12.192  -5.277
  640   1HA   GLY  88          1HA       GLY  88   5.538 -13.633  -7.094
  641   2HA   GLY  88          2HA       GLY  88   6.786 -14.396  -6.108
  642    H    ALA  89           H        ALA  89   6.385 -16.553  -6.097
  643    HA   ALA  89           HA       ALA  89   3.581 -17.537  -6.081
  644   1HB   ALA  89          1HB       ALA  89   5.599 -18.297  -7.556
  645   2HB   ALA  89          2HB       ALA  89   4.536 -19.529  -6.879
  646   3HB   ALA  89          3HB       ALA  89   6.091 -19.191  -6.120
  647    H    ASP  90           H        ASP  90   4.269 -16.311  -3.662
  648    HA   ASP  90           HA       ASP  90   4.675 -18.642  -1.831
  649   1HB   ASP  90          1HB       ASP  90   6.506 -17.035  -1.788
  650   2HB   ASP  90          2HB       ASP  90   5.377 -15.704  -1.551
  651    H    ALA  91           H        ALA  91   2.322 -18.914  -2.055
  652    HA   ALA  91           HA       ALA  91   0.215 -17.225  -1.612
  653   1HB   ALA  91          1HB       ALA  91   0.522 -19.793  -0.047
  654   2HB   ALA  91          2HB       ALA  91   0.347 -19.795  -1.801
  655   3HB   ALA  91          3HB       ALA  91  -0.938 -19.139  -0.789
  656    H    ALA  92           H        ALA  92   2.673 -18.066   0.743
  657    HA   ALA  92           HA       ALA  92   1.237 -17.034   3.064
  658   1HB   ALA  92          1HB       ALA  92   4.205 -17.154   3.017
  659   2HB   ALA  92          2HB       ALA  92   3.383 -18.666   2.630
  660   3HB   ALA  92          3HB       ALA  92   3.075 -17.865   4.171
  661    H    LYS  93           H        LYS  93   3.693 -15.873   0.807
  662    HA   LYS  93           HA       LYS  93   4.023 -13.273   2.056
  663   1HB   LYS  93          1HB       LYS  93   4.886 -14.796  -0.334
  664   2HB   LYS  93          2HB       LYS  93   4.912 -13.047  -0.513
  665   1HG   LYS  93          1HG       LYS  93   6.234 -12.903   1.607
  666   2HG   LYS  93          2HG       LYS  93   6.282 -14.666   1.650
  667   1HD   LYS  93          1HD       LYS  93   7.422 -14.697  -0.534
  668   2HD   LYS  93          2HD       LYS  93   7.367 -12.935  -0.593
  669   1HE   LYS  93          1HE       LYS  93   9.174 -12.746   0.772
  670   2HE   LYS  93          2HE       LYS  93   8.526 -13.944   1.910
  671   1HZ   LYS  93          1HZ       LYS  93   9.464 -15.665   0.794
  672   2HZ   LYS  93          2HZ       LYS  93  10.596 -14.472   0.368
  673   3HZ   LYS  93          3HZ       LYS  93   9.363 -14.903  -0.717
  674    H    LYS  94           H        LYS  94   1.834 -14.709  -0.264
  675    HA   LYS  94           HA       LYS  94   0.895 -12.173  -1.389
  676   1HB   LYS  94          1HB       LYS  94   0.529 -15.039  -1.721
  677   2HB   LYS  94          2HB       LYS  94  -1.022 -14.200  -1.762
  678   1HG   LYS  94          1HG       LYS  94   0.392 -12.519  -3.313
  679   2HG   LYS  94          2HG       LYS  94   1.286 -14.006  -3.636
  680   1HD   LYS  94          1HD       LYS  94  -1.432 -14.735  -3.722
  681   2HD   LYS  94          2HD       LYS  94  -1.323 -13.211  -4.605
  682   1HE   LYS  94          1HE       LYS  94  -0.916 -15.075  -6.153
  683   2HE   LYS  94          2HE       LYS  94   0.601 -14.182  -5.916
  684   1HZ   LYS  94          1HZ       LYS  94   1.385 -15.754  -4.410
  685   2HZ   LYS  94          2HZ       LYS  94   0.663 -16.707  -5.616
  686   3HZ   LYS  94          3HZ       LYS  94  -0.148 -16.429  -4.149
  687    H    LYS  95           H        LYS  95   0.148 -14.155   1.384
  688    HA   LYS  95           HA       LYS  95  -2.444 -12.831   1.893
  689   1HB   LYS  95          1HB       LYS  95  -2.507 -14.391   3.762
  690   2HB   LYS  95          2HB       LYS  95  -1.932 -15.255   2.338
  691   1HG   LYS  95          1HG       LYS  95   0.122 -15.606   3.234
  692   2HG   LYS  95          2HG       LYS  95   0.208 -13.979   3.905
  693   1HD   LYS  95          1HD       LYS  95  -1.823 -15.590   5.235
  694   2HD   LYS  95          2HD       LYS  95  -0.224 -16.323   5.350
  695   1HE   LYS  95          1HE       LYS  95   0.591 -13.939   6.011
  696   2HE   LYS  95          2HE       LYS  95  -1.124 -13.617   6.338
  697   1HZ   LYS  95          1HZ       LYS  95   0.062 -16.122   7.307
  698   2HZ   LYS  95          2HZ       LYS  95  -1.222 -15.216   7.954
  699   3HZ   LYS  95          3HZ       LYS  95   0.382 -14.695   8.166
  700    H    GLU  96           H        GLU  96   0.897 -12.468   2.685
  701    HA   GLU  96           HA       GLU  96   0.372 -10.756   5.053
  702   1HB   GLU  96          1HB       GLU  96   2.787 -10.927   5.292
  703   2HB   GLU  96          2HB       GLU  96   2.167 -12.520   4.901
  704   1HG   GLU  96          1HG       GLU  96   2.796 -12.241   2.585
  705   2HG   GLU  96          2HG       GLU  96   3.305 -10.581   2.894
  706    H    LEU  97           H        LEU  97   1.816 -10.591   1.833
  707    HA   LEU  97           HA       LEU  97   2.325  -7.718   1.938
  708   1HB   LEU  97          1HB       LEU  97   2.275  -9.724  -0.327
  709   2HB   LEU  97          2HB       LEU  97   3.018  -8.126  -0.384
  710    HG   LEU  97           HG       LEU  97   3.849 -10.507   1.269
  711   1HD1  LEU  97          1HD1      LEU  97   6.085  -9.737   0.265
  712   2HD1  LEU  97          2HD1      LEU  97   5.112  -8.718  -0.795
  713   3HD1  LEU  97          3HD1      LEU  97   4.918 -10.470  -0.833
  714   1HD2  LEU  97          1HD2      LEU  97   5.540  -8.864   2.268
  715   2HD2  LEU  97          2HD2      LEU  97   3.883  -8.711   2.855
  716   3HD2  LEU  97          3HD2      LEU  97   4.502  -7.576   1.655
  717    H    THR  98           H        THR  98   0.218  -9.626  -0.242
  718    HA   THR  98           HA       THR  98  -1.390  -7.198  -0.756
  719    HB   THR  98           HB       THR  98  -2.415  -8.660  -2.468
  720    HG1  THR  98           1HG      THR  98  -2.345 -10.708  -2.102
  721   1HG2  THR  98          1HG2      THR  98   0.377  -9.392  -2.901
  722   2HG2  THR  98          2HG2      THR  98   0.205  -7.724  -2.358
  723   3HG2  THR  98          3HG2      THR  98  -0.638  -8.270  -3.808
  724    H    GLY  99           H        GLY  99  -1.475  -9.734   1.477
  725   1HA   GLY  99          1HA       GLY  99  -4.221 -10.410   1.591
  726   2HA   GLY  99          2HA       GLY  99  -3.145 -10.404   2.989
  727    H    CYS 100           H        CYS 100  -5.925  -9.070   1.853
  728    HA   CYS 100           HA       CYS 100  -5.586  -6.328   2.806
  729   1HB   CYS 100          1HB       CYS 100  -8.279  -7.485   2.568
  730   2HB   CYS 100          2HB       CYS 100  -7.642  -6.020   1.875
  731    H    LYS 101           H        LYS 101  -7.721  -8.972   3.888
  732    HA   LYS 101           HA       LYS 101  -7.828  -7.668   6.557
  733   1HB   LYS 101          1HB       LYS 101  -9.685  -8.801   4.836
  734   2HB   LYS 101          2HB       LYS 101  -9.482 -10.032   6.081
  735   1HG   LYS 101          1HG       LYS 101 -11.059  -8.753   7.155
  736   2HG   LYS 101          2HG       LYS 101  -9.626  -7.859   7.661
  737   1HD   LYS 101          1HD       LYS 101 -10.687  -6.062   6.760
  738   2HD   LYS 101          2HD       LYS 101 -10.139  -6.724   5.219
  739   1HE   LYS 101          1HE       LYS 101 -12.253  -7.919   4.927
  740   2HE   LYS 101          2HE       LYS 101 -12.805  -7.380   6.526
  741   1HZ   LYS 101          1HZ       LYS 101 -13.419  -5.993   4.431
  742   2HZ   LYS 101          2HZ       LYS 101 -11.834  -5.399   4.581
  743   3HZ   LYS 101          3HZ       LYS 101 -12.943  -5.201   5.853
  744    H    GLY 102           H        GLY 102  -5.610  -9.606   5.438
  745   1HA   GLY 102          1HA       GLY 102  -5.279 -11.025   7.978
  746   2HA   GLY 102          2HA       GLY 102  -5.579 -12.095   6.608
  747    H    SER 103           H        SER 103  -3.714  -9.064   6.568
  748    HA   SER 103           HA       SER 103  -1.304 -10.689   5.868
  749   1HB   SER 103          1HB       SER 103  -1.029  -9.326   4.053
  750   2HB   SER 103          2HB       SER 103  -2.759  -9.150   4.228
  751    HG   SER 103           HG       SER 103  -2.489  -7.202   5.121
  752    H    LYS 104           H        LYS 104   0.217  -8.191   5.641
  753    HA   LYS 104           HA       LYS 104   0.774  -7.728   8.538
  754   1HB   LYS 104          1HB       LYS 104   2.268  -7.241   5.942
  755   2HB   LYS 104          2HB       LYS 104   2.916  -6.872   7.539
  756   1HG   LYS 104          1HG       LYS 104   1.866  -9.630   7.061
  757   2HG   LYS 104          2HG       LYS 104   3.429  -9.207   6.362
  758   1HD   LYS 104          1HD       LYS 104   3.459  -8.198   9.002
  759   2HD   LYS 104          2HD       LYS 104   2.787  -9.826   9.109
  760   1HE   LYS 104          1HE       LYS 104   5.244  -9.342   7.432
  761   2HE   LYS 104          2HE       LYS 104   5.391  -9.556   9.188
  762   1HZ   LYS 104          1HZ       LYS 104   3.747 -11.379   7.541
  763   2HZ   LYS 104          2HZ       LYS 104   4.369 -11.634   9.100
  764   3HZ   LYS 104          3HZ       LYS 104   5.406 -11.653   7.755
  765    H    CYS 105           H        CYS 105  -0.239  -6.285   5.573
  766    HA   CYS 105           HA       CYS 105   0.160  -3.512   6.347
  767   1HB   CYS 105          1HB       CYS 105  -0.212  -5.029   4.061
  768   2HB   CYS 105          2HB       CYS 105  -1.736  -4.193   4.224
  769    H    HIS 106           H        HIS 106  -2.422  -5.872   6.660
  770    HA   HIS 106           HA       HIS 106  -4.172  -3.727   7.824
  771   1HB   HIS 106          1HB       HIS 106  -4.647  -5.975   5.911
  772   2HB   HIS 106          2HB       HIS 106  -5.958  -5.540   7.008
  773    HD1  HIS 106           HD1      HIS 106  -5.147  -2.434   7.031
  774    HD2  HIS 106           HD2      HIS 106  -5.926  -4.759   3.640
  775    HE1  HIS 106           HE1      HIS 106  -5.687  -0.813   5.170
  776    H    SER 107           H        SER 107  -2.522  -4.850   9.621
  777    HA   SER 107           HA       SER 107  -3.039  -7.355  10.759
  778   1HB   SER 107          1HB       SER 107  -1.407  -5.405  11.356
  779   2HB   SER 107          2HB       SER 107  -2.706  -4.853  12.410
  780    HG   SER 107           HG       SER 107  -1.903  -7.544  12.468
  781    HHA  HEC 201           HHA      HEC 201   6.048   8.527   5.683
  782    HHB  HEC 201           HHB      HEC 201  12.083   9.831   4.648
  783    HHC  HEC 201           HHC      HEC 201  12.627   4.637   1.069
  784    HHD  HEC 201           HHD      HEC 201   6.506   3.549   1.728
  785   1HMA  HEC 201          1HMA      HEC 201  10.161  11.978   6.251
  786   2HMA  HEC 201          2HMA      HEC 201  11.357  10.774   6.729
  787   3HMA  HEC 201          3HMA      HEC 201   9.890  10.988   7.686
  788   1HAA  HEC 201          1HAA      HEC 201   7.004   9.401   7.713
  789   2HAA  HEC 201          2HAA      HEC 201   7.998  10.853   7.780
  790   1HBA  HEC 201          1HBA      HEC 201   6.510  11.226   5.480
  791   2HBA  HEC 201          2HBA      HEC 201   5.361  10.457   6.575
  792   1HMB  HEC 201          1HMB      HEC 201  14.856   9.316   2.697
  793   2HMB  HEC 201          2HMB      HEC 201  14.028   9.686   4.210
  794   3HMB  HEC 201          3HMB      HEC 201  15.198   8.368   4.145
  795    HAB  HEC 201           HAB      HEC 201  14.441   5.476   1.136
  796   1HBB  HEC 201          1HBB      HEC 201  16.695   5.985   2.608
  797   2HBB  HEC 201          2HBB      HEC 201  15.629   4.604   2.869
  798   3HBB  HEC 201          3HBB      HEC 201  15.444   6.059   3.849
  799   1HMC  HEC 201          1HMC      HEC 201  11.478   1.597   0.423
  800   2HMC  HEC 201          2HMC      HEC 201  12.261   3.087  -0.101
  801   3HMC  HEC 201          3HMC      HEC 201  10.922   2.419  -1.034
  802    HAC  HEC 201           HAC      HEC 201   7.179   2.167   0.562
  803   1HBC  HEC 201          1HBC      HEC 201   8.317   0.277   1.293
  804   2HBC  HEC 201          2HBC      HEC 201   9.806   0.731   0.467
  805   3HBC  HEC 201          3HBC      HEC 201   8.447   0.088  -0.455
  806   1HMD  HEC 201          1HMD      HEC 201   4.675   3.172   3.642
  807   2HMD  HEC 201          2HMD      HEC 201   3.488   4.330   4.238
  808   3HMD  HEC 201          3HMD      HEC 201   3.810   4.211   2.507
  809   1HAD  HEC 201          1HAD      HEC 201   4.276   7.854   5.473
  810   2HAD  HEC 201          2HAD      HEC 201   3.205   6.932   4.426
  811   1HBD  HEC 201          1HBD      HEC 201   3.189   5.072   5.926
  812   2HBD  HEC 201          2HBD      HEC 201   4.533   5.730   6.860
  813    HHA  HEC 202           HHA      HEC 202   1.702   7.711  -9.514
  814    HHB  HEC 202           HHB      HEC 202   2.863   4.142  -4.830
  815    HHC  HEC 202           HHC      HEC 202   4.596   8.977  -1.236
  816    HHD  HEC 202           HHD      HEC 202   2.778  12.945  -5.723
  817   1HMA  HEC 202          1HMA      HEC 202   0.513   3.272  -7.608
  818   2HMA  HEC 202          2HMA      HEC 202   0.983   3.264  -5.908
  819   3HMA  HEC 202          3HMA      HEC 202   2.166   2.860  -7.153
  820   1HAA  HEC 202          1HAA      HEC 202   1.288   5.307 -10.052
  821   2HAA  HEC 202          2HAA      HEC 202   0.139   4.444  -9.071
  822   1HBA  HEC 202          1HBA      HEC 202  -1.240   6.411  -8.838
  823   2HBA  HEC 202          2HBA      HEC 202  -0.045   7.397  -9.672
  824   1HMB  HEC 202          1HMB      HEC 202   2.883   3.690  -1.943
  825   2HMB  HEC 202          2HMB      HEC 202   4.036   3.336  -3.229
  826   3HMB  HEC 202          3HMB      HEC 202   4.615   3.726  -1.610
  827    HAB  HEC 202           HAB      HEC 202   4.387   7.058   0.094
  828   1HBB  HEC 202          1HBB      HEC 202   6.700   6.221  -1.358
  829   2HBB  HEC 202          2HBB      HEC 202   6.483   5.116  -0.002
  830   3HBB  HEC 202          3HBB      HEC 202   6.621   6.849   0.288
  831   1HMC  HEC 202          1HMC      HEC 202   5.473  12.687  -1.378
  832   2HMC  HEC 202          2HMC      HEC 202   4.045  12.104  -0.522
  833   3HMC  HEC 202          3HMC      HEC 202   5.407  11.020  -0.807
  834    HAC  HEC 202           HAC      HEC 202   2.317  13.832  -3.544
  835   1HBC  HEC 202          1HBC      HEC 202   3.476  15.422  -2.248
  836   2HBC  HEC 202          2HBC      HEC 202   5.023  14.603  -2.463
  837   3HBC  HEC 202          3HBC      HEC 202   3.796  13.907  -1.406
  838   1HMD  HEC 202          1HMD      HEC 202   2.814  13.590  -8.212
  839   2HMD  HEC 202          2HMD      HEC 202   1.067  13.395  -8.350
  840   3HMD  HEC 202          3HMD      HEC 202   2.106  13.028  -9.728
  841   1HAD  HEC 202          1HAD      HEC 202   1.918   9.307 -10.744
  842   2HAD  HEC 202          2HAD      HEC 202   1.106  10.861 -10.848
  843   1HBD  HEC 202          1HBD      HEC 202   3.551  11.807 -10.528
  844   2HBD  HEC 202          2HBD      HEC 202   4.013  10.215 -11.131
  845    HHA  HEC 203           HHA      HEC 203   6.995  -6.892   4.728
  846    HHB  HEC 203           HHB      HEC 203   2.723  -2.028   4.930
  847    HHC  HEC 203           HHC      HEC 203   4.754  -0.005  -0.452
  848    HHD  HEC 203           HHD      HEC 203   8.979  -4.619  -0.827
  849   1HMA  HEC 203          1HMA      HEC 203   3.405  -3.299   7.603
  850   2HMA  HEC 203          2HMA      HEC 203   2.983  -5.012   7.577
  851   3HMA  HEC 203          3HMA      HEC 203   2.109  -3.873   6.553
  852   1HAA  HEC 203          1HAA      HEC 203   4.735  -6.072   7.790
  853   2HAA  HEC 203          2HAA      HEC 203   4.531  -7.301   6.550
  854   1HBA  HEC 203          1HBA      HEC 203   6.758  -7.760   6.457
  855   2HBA  HEC 203          2HBA      HEC 203   7.214  -6.065   6.642
  856   1HMB  HEC 203          1HMB      HEC 203   1.232  -0.312   4.096
  857   2HMB  HEC 203          2HMB      HEC 203   2.546   0.435   5.006
  858   3HMB  HEC 203          3HMB      HEC 203   1.844   1.272   3.620
  859    HAB  HEC 203           HAB      HEC 203   2.852   0.927   0.138
  860   1HBB  HEC 203          1HBB      HEC 203   3.568   3.353   0.922
  861   2HBB  HEC 203          2HBB      HEC 203   4.762   2.258   0.225
  862   3HBB  HEC 203          3HBB      HEC 203   4.666   2.457   1.975
  863   1HMC  HEC 203          1HMC      HEC 203   7.344   0.126  -2.702
  864   2HMC  HEC 203          2HMC      HEC 203   6.148  -0.893  -3.502
  865   3HMC  HEC 203          3HMC      HEC 203   5.651   0.205  -2.213
  866    HAC  HEC 203           HAC      HEC 203   9.193  -3.605  -2.485
  867   1HBC  HEC 203          1HBC      HEC 203   8.458  -1.418  -4.322
  868   2HBC  HEC 203          2HBC      HEC 203  10.045  -1.875  -3.707
  869   3HBC  HEC 203          3HBC      HEC 203   8.978  -0.865  -2.732
  870   1HMD  HEC 203          1HMD      HEC 203  10.327  -6.156  -0.181
  871   2HMD  HEC 203          2HMD      HEC 203   9.753  -7.805   0.066
  872   3HMD  HEC 203          3HMD      HEC 203  10.837  -7.062   1.244
  873   1HAD  HEC 203          1HAD      HEC 203   9.985  -7.894   3.405
  874   2HAD  HEC 203          2HAD      HEC 203   8.430  -8.111   4.199
  875   1HBD  HEC 203          1HBD      HEC 203   7.651  -9.583   2.485
  876   2HBD  HEC 203          2HBD      HEC 203   8.999  -9.167   1.425
  877    HHA  HEC 204           HHA      HEC 204  -6.829   2.290   3.940
  878    HHB  HEC 204           HHB      HEC 204 -10.147  -2.193   1.054
  879    HHC  HEC 204           HHC      HEC 204  -4.836  -5.767   0.900
  880    HHD  HEC 204           HHD      HEC 204  -1.498  -0.913   2.674
  881   1HMA  HEC 204          1HMA      HEC 204 -11.430   1.081   1.739
  882   2HMA  HEC 204          2HMA      HEC 204 -11.708   0.059   3.151
  883   3HMA  HEC 204          3HMA      HEC 204 -11.466  -0.674   1.565
  884   1HAA  HEC 204          1HAA      HEC 204 -10.052   2.163   4.519
  885   2HAA  HEC 204          2HAA      HEC 204  -8.550   2.922   4.003
  886   1HBA  HEC 204          1HBA      HEC 204  -9.657   3.138   1.689
  887   2HBA  HEC 204          2HBA      HEC 204 -11.164   2.758   2.517
  888   1HMB  HEC 204          1HMB      HEC 204 -10.691  -4.000   0.040
  889   2HMB  HEC 204          2HMB      HEC 204 -10.076  -5.550  -0.530
  890   3HMB  HEC 204          3HMB      HEC 204  -9.924  -4.115  -1.544
  891    HAB  HEC 204           HAB      HEC 204  -6.546  -6.841   0.169
  892   1HBB  HEC 204          1HBB      HEC 204  -5.717  -6.161  -1.925
  893   2HBB  HEC 204          2HBB      HEC 204  -7.299  -5.608  -2.476
  894   3HBB  HEC 204          3HBB      HEC 204  -6.968  -7.335  -2.332
  895   1HMC  HEC 204          1HMC      HEC 204  -1.466  -5.741   0.342
  896   2HMC  HEC 204          2HMC      HEC 204  -1.785  -6.210   2.013
  897   3HMC  HEC 204          3HMC      HEC 204  -3.034  -6.416   0.784
  898    HAC  HEC 204           HAC      HEC 204  -0.479  -2.432   2.969
  899   1HBC  HEC 204          1HBC      HEC 204   1.412  -3.111   1.625
  900   2HBC  HEC 204          2HBC      HEC 204   0.198  -2.458   0.524
  901   3HBC  HEC 204          3HBC      HEC 204   0.409  -4.203   0.669
  902   1HMD  HEC 204          1HMD      HEC 204  -1.049   1.666   2.771
  903   2HMD  HEC 204          2HMD      HEC 204  -1.145   1.030   4.413
  904   3HMD  HEC 204          3HMD      HEC 204  -1.636   2.691   4.081
  905   1HAD  HEC 204          1HAD      HEC 204  -3.767   3.963   3.581
  906   2HAD  HEC 204          2HAD      HEC 204  -5.353   3.566   4.227
  907   1HBD  HEC 204          1HBD      HEC 204  -4.262   2.700   6.286
  908   2HBD  HEC 204          2HBD      HEC 204  -2.703   3.206   5.639
  Start of MODEL   10
    1   1H    ALA   1          1H        ALA   1  18.840  14.909   1.144
    2   2H    ALA   1          2H        ALA   1  20.354  14.520   0.479
    3   3H    ALA   1          3H        ALA   1  20.256  15.220   2.024
    4    HA   ALA   1           HA       ALA   1  19.586  12.460   1.202
    5   1HB   ALA   1          1HB       ALA   1  21.041  12.086   3.228
    6   2HB   ALA   1          2HB       ALA   1  21.243  13.835   3.340
    7   3HB   ALA   1          3HB       ALA   1  21.848  12.965   1.930
    8    HA   PRO   2           HA       PRO   2  16.017  13.266   3.842
    9   1HB   PRO   2          1HB       PRO   2  14.692  10.981   3.137
   10   2HB   PRO   2          2HB       PRO   2  14.675  12.448   2.146
   11   1HG   PRO   2          1HG       PRO   2  16.262   9.958   1.810
   12   2HG   PRO   2          2HG       PRO   2  15.518  10.995   0.584
   13   1HD   PRO   2          1HD       PRO   2  18.184  11.029   1.188
   14   2HD   PRO   2          2HD       PRO   2  17.304  12.421   0.520
   15    H    LYS   3           H        LYS   3  15.645  12.502   5.934
   16    HA   LYS   3           HA       LYS   3  17.309  10.191   6.818
   17   1HB   LYS   3          1HB       LYS   3  15.762  12.188   8.466
   18   2HB   LYS   3          2HB       LYS   3  17.096  11.162   8.985
   19   1HG   LYS   3          1HG       LYS   3  18.607  12.360   7.422
   20   2HG   LYS   3          2HG       LYS   3  17.272  13.419   6.968
   21   1HD   LYS   3          1HD       LYS   3  17.556  14.694   8.806
   22   2HD   LYS   3          2HD       LYS   3  17.564  13.278   9.857
   23   1HE   LYS   3          1HE       LYS   3  19.727  14.542   9.947
   24   2HE   LYS   3          2HE       LYS   3  19.948  12.890   9.336
   25   1HZ   LYS   3          1HZ       LYS   3  20.802  15.022   8.012
   26   2HZ   LYS   3          2HZ       LYS   3  19.229  14.922   7.378
   27   3HZ   LYS   3          3HZ       LYS   3  20.293  13.604   7.233
   28    H    ALA   4           H        ALA   4  15.839   8.595   5.985
   29    HA   ALA   4           HA       ALA   4  13.121   8.258   6.259
   30   1HB   ALA   4          1HB       ALA   4  14.871   5.991   7.119
   31   2HB   ALA   4          2HB       ALA   4  15.172   6.696   5.530
   32   3HB   ALA   4          3HB       ALA   4  13.589   6.016   5.909
   33    HA   PRO   5           HA       PRO   5  12.448   8.380  10.609
   34   1HB   PRO   5          1HB       PRO   5   9.820   7.606  10.580
   35   2HB   PRO   5          2HB       PRO   5  10.371   9.228  10.126
   36   1HG   PRO   5          1HG       PRO   5   9.406   7.033   8.421
   37   2HG   PRO   5          2HG       PRO   5   9.432   8.773   8.127
   38   1HD   PRO   5          1HD       PRO   5  11.223   6.850   7.083
   39   2HD   PRO   5          2HD       PRO   5  11.349   8.615   6.955
   40    H    ALA   6           H        ALA   6  11.811   6.892  12.386
   41    HA   ALA   6           HA       ALA   6  13.005   4.343  12.210
   42   1HB   ALA   6          1HB       ALA   6  11.145   5.788  14.054
   43   2HB   ALA   6          2HB       ALA   6  12.770   5.176  14.361
   44   3HB   ALA   6          3HB       ALA   6  11.401   4.063  14.324
   45    H    ASP   7           H        ASP   7  11.633   2.311  12.856
   46    HA   ASP   7           HA       ASP   7   9.661   1.869  10.710
   47   1HB   ASP   7          1HB       ASP   7  10.666  -0.047  12.824
   48   2HB   ASP   7          2HB       ASP   7  10.077  -0.424  11.209
   49    H    GLY   8           H        GLY   8   7.603   0.766  11.295
   50   1HA   GLY   8          1HA       GLY   8   5.824   0.255  12.831
   51   2HA   GLY   8          2HA       GLY   8   6.675   1.165  14.077
   52    H    LEU   9           H        LEU   9   6.430   2.663  10.973
   53    HA   LEU   9           HA       LEU   9   5.115   4.990  11.937
   54   1HB   LEU   9          1HB       LEU   9   6.174   3.942   9.512
   55   2HB   LEU   9          2HB       LEU   9   4.531   4.474   9.156
   56    HG   LEU   9           HG       LEU   9   6.167   6.313  10.820
   57   1HD1  LEU   9          1HD1      LEU   9   7.330   5.217   8.526
   58   2HD1  LEU   9          2HD1      LEU   9   7.808   6.717   9.323
   59   3HD1  LEU   9          3HD1      LEU   9   6.662   6.757   7.982
   60   1HD2  LEU   9          1HD2      LEU   9   5.086   7.803   8.851
   61   2HD2  LEU   9          2HD2      LEU   9   4.160   7.314  10.273
   62   3HD2  LEU   9          3HD2      LEU   9   4.000   6.412   8.767
   63    H    LYS  10           H        LYS  10   2.907   5.483  10.392
   64    HA   LYS  10           HA       LYS  10   1.038   3.227  10.528
   65   1HB   LYS  10          1HB       LYS  10   1.226   5.386  12.572
   66   2HB   LYS  10          2HB       LYS  10  -0.387   4.846  12.099
   67   1HG   LYS  10          1HG       LYS  10   0.514   2.454  12.442
   68   2HG   LYS  10          2HG       LYS  10   1.847   3.222  13.307
   69   1HD   LYS  10          1HD       LYS  10  -0.035   4.466  14.618
   70   2HD   LYS  10          2HD       LYS  10  -1.080   3.180  14.012
   71   1HE   LYS  10          1HE       LYS  10   0.128   1.495  15.157
   72   2HE   LYS  10          2HE       LYS  10   1.536   2.550  15.397
   73   1HZ   LYS  10          1HZ       LYS  10  -1.013   3.531  16.403
   74   2HZ   LYS  10          2HZ       LYS  10   0.543   3.667  17.072
   75   3HZ   LYS  10          3HZ       LYS  10  -0.338   2.225  17.249
   76    H    MET  11           H        MET  11   0.185   3.542   8.545
   77    HA   MET  11           HA       MET  11  -0.428   6.234   7.503
   78   1HB   MET  11          1HB       MET  11  -0.322   3.401   6.576
   79   2HB   MET  11          2HB       MET  11  -1.468   4.447   5.738
   80   1HG   MET  11          1HG       MET  11   0.350   6.068   5.295
   81   2HG   MET  11          2HG       MET  11   1.488   4.994   6.108
   82   1HE   MET  11          1HE       MET  11  -0.641   5.176   2.406
   83   2HE   MET  11          2HE       MET  11   1.054   5.525   2.074
   84   3HE   MET  11          3HE       MET  11   0.232   6.357   3.393
   85    H    ASP  12           H        ASP  12  -2.059   6.899   9.045
   86    HA   ASP  12           HA       ASP  12  -4.516   5.198   9.162
   87   1HB   ASP  12          1HB       ASP  12  -4.996   6.897  11.051
   88   2HB   ASP  12          2HB       ASP  12  -3.692   5.743  11.297
   89    H    LYS  13           H        LYS  13  -3.555   7.351   7.054
   90    HA   LYS  13           HA       LYS  13  -5.241   9.586   7.040
   91   1HB   LYS  13          1HB       LYS  13  -4.155   7.742   4.919
   92   2HB   LYS  13          2HB       LYS  13  -5.084   9.176   4.487
   93   1HG   LYS  13          1HG       LYS  13  -2.616   9.182   6.249
   94   2HG   LYS  13          2HG       LYS  13  -2.626   9.612   4.539
   95   1HD   LYS  13          1HD       LYS  13  -4.635  11.200   5.436
   96   2HD   LYS  13          2HD       LYS  13  -3.619  11.142   6.876
   97   1HE   LYS  13          1HE       LYS  13  -1.670  11.602   5.126
   98   2HE   LYS  13          2HE       LYS  13  -3.003  12.288   4.176
   99   1HZ   LYS  13          1HZ       LYS  13  -3.654  13.317   6.459
  100   2HZ   LYS  13          2HZ       LYS  13  -2.459  14.061   5.508
  101   3HZ   LYS  13          3HZ       LYS  13  -2.014  13.087   6.827
  102    H    THR  14           H        THR  14  -6.013   6.226   6.273
  103    HA   THR  14           HA       THR  14  -8.855   7.024   5.740
  104    HB   THR  14           HB       THR  14  -8.863   4.637   4.744
  105    HG1  THR  14           1HG      THR  14  -6.099   5.067   4.579
  106   1HG2  THR  14          1HG2      THR  14  -8.910   6.574   3.314
  107   2HG2  THR  14          2HG2      THR  14  -7.690   5.473   2.673
  108   3HG2  THR  14          3HG2      THR  14  -7.199   6.890   3.603
  109    H    LYS  15           H        LYS  15 -10.398   5.111   6.406
  110    HA   LYS  15           HA       LYS  15 -10.374   4.857   9.249
  111   1HB   LYS  15          1HB       LYS  15 -11.897   3.882   6.911
  112   2HB   LYS  15          2HB       LYS  15 -12.011   2.852   8.338
  113   1HG   LYS  15          1HG       LYS  15 -13.463   4.298   9.261
  114   2HG   LYS  15          2HG       LYS  15 -12.229   5.557   9.212
  115   1HD   LYS  15          1HD       LYS  15 -12.904   6.268   7.030
  116   2HD   LYS  15          2HD       LYS  15 -13.923   4.845   6.809
  117   1HE   LYS  15          1HE       LYS  15 -15.274   5.661   8.829
  118   2HE   LYS  15          2HE       LYS  15 -14.396   7.195   8.663
  119   1HZ   LYS  15          1HZ       LYS  15 -15.039   7.214   6.299
  120   2HZ   LYS  15          2HZ       LYS  15 -16.385   7.287   7.335
  121   3HZ   LYS  15          3HZ       LYS  15 -15.986   5.831   6.555
  122    H    GLN  16           H        GLN  16  -8.897   2.926   6.741
  123    HA   GLN  16           HA       GLN  16  -8.305   0.738   8.688
  124   1HB   GLN  16          1HB       GLN  16  -8.174   1.024   5.674
  125   2HB   GLN  16          2HB       GLN  16  -7.570  -0.398   6.525
  126   1HG   GLN  16          1HG       GLN  16 -10.040  -0.146   7.653
  127   2HG   GLN  16          2HG       GLN  16 -10.357   0.455   6.025
  128   1HE2  GLN  16          2HE2      GLN  16  -8.062  -2.108   7.089
  129   2HE2  GLN  16          1HE2      GLN  16  -8.754  -3.331   6.136
  130    HA   PRO  17           HA       PRO  17  -4.465   3.312   8.544
  131   1HB   PRO  17          1HB       PRO  17  -3.811   2.864  11.170
  132   2HB   PRO  17          2HB       PRO  17  -4.886   4.174  10.640
  133   1HG   PRO  17          1HG       PRO  17  -5.579   1.492  11.751
  134   2HG   PRO  17          2HG       PRO  17  -6.295   3.074  12.102
  135   1HD   PRO  17          1HD       PRO  17  -7.479   1.306  10.449
  136   2HD   PRO  17          2HD       PRO  17  -7.592   3.063  10.193
  137    H    VAL  18           H        VAL  18  -2.375   2.501   8.266
  138    HA   VAL  18           HA       VAL  18  -1.888  -0.359   8.987
  139    HB   VAL  18           HB       VAL  18  -1.581   1.137   6.379
  140   1HG1  VAL  18          1HG1      VAL  18  -0.272  -0.708   5.518
  141   2HG1  VAL  18          2HG1      VAL  18  -0.409  -1.573   7.049
  142   3HG1  VAL  18          3HG1      VAL  18   0.528  -0.082   6.959
  143   1HG2  VAL  18          1HG2      VAL  18  -2.595  -1.324   5.818
  144   2HG2  VAL  18          2HG2      VAL  18  -3.600   0.076   6.193
  145   3HG2  VAL  18          3HG2      VAL  18  -3.213  -1.095   7.453
  146    H    VAL  19           H        VAL  19   0.167  -0.713   9.810
  147    HA   VAL  19           HA       VAL  19   1.897   1.641  10.254
  148    HB   VAL  19           HB       VAL  19   1.991  -1.267  11.122
  149   1HG1  VAL  19          1HG1      VAL  19   3.919  -0.848  12.284
  150   2HG1  VAL  19          2HG1      VAL  19   3.487   0.834  12.595
  151   3HG1  VAL  19          3HG1      VAL  19   4.149   0.368  11.027
  152   1HG2  VAL  19          1HG2      VAL  19   1.541   0.928  13.059
  153   2HG2  VAL  19          2HG2      VAL  19   0.761  -0.651  12.945
  154   3HG2  VAL  19          3HG2      VAL  19   0.235   0.670  11.903
  155    H    PHE  20           H        PHE  20   3.629   2.074   8.919
  156    HA   PHE  20           HA       PHE  20   4.538  -0.103   7.078
  157   1HB   PHE  20          1HB       PHE  20   3.698   1.909   5.996
  158   2HB   PHE  20          2HB       PHE  20   4.752   2.927   6.975
  159    HD1  PHE  20           HD1      PHE  20   4.920  -0.012   4.665
  160    HD2  PHE  20           HD2      PHE  20   6.851   3.541   6.095
  161    HE1  PHE  20           HE1      PHE  20   6.729  -0.324   3.002
  162    HE2  PHE  20           HE2      PHE  20   8.658   3.229   4.434
  163    HZ   PHE  20           HZ       PHE  20   8.601   1.296   2.888
  164    H    ASN  21           H        ASN  21   6.342  -1.115   7.875
  165    HA   ASN  21           HA       ASN  21   8.209   0.299   9.660
  166   1HB   ASN  21          1HB       ASN  21   7.320  -2.372   9.028
  167   2HB   ASN  21          2HB       ASN  21   9.072  -2.290   8.925
  168   1HD2  ASN  21          2HD2      ASN  21   6.504  -1.023  11.126
  169   2HD2  ASN  21          1HD2      ASN  21   7.349  -1.388  12.553
  170    H    HIS  22           H        HIS  22   9.420   1.753   8.348
  171    HA   HIS  22           HA       HIS  22  10.304   1.431   5.715
  172   1HB   HIS  22          1HB       HIS  22  11.294   2.804   8.180
  173   2HB   HIS  22          2HB       HIS  22  12.368   2.757   6.784
  174    HD1  HIS  22           HD1      HIS  22   9.545   4.585   8.167
  175    HD2  HIS  22           HD2      HIS  22  10.988   3.842   4.322
  176    HE1  HIS  22           HE1      HIS  22   8.552   6.367   6.672
  177    H    SER  23           H        SER  23  11.669   0.060   8.692
  178    HA   SER  23           HA       SER  23  14.146  -0.904   7.809
  179   1HB   SER  23          1HB       SER  23  13.666  -2.748   9.483
  180   2HB   SER  23          2HB       SER  23  13.377  -1.122  10.093
  181    HG   SER  23           HG       SER  23  11.185  -1.412   9.717
  182    H    THR  24           H        THR  24  10.929  -2.402   7.392
  183    HA   THR  24           HA       THR  24  11.884  -4.723   5.958
  184    HB   THR  24           HB       THR  24   9.199  -3.972   5.260
  185    HG1  THR  24           1HG      THR  24   8.389  -3.394   7.190
  186   1HG2  THR  24          1HG2      THR  24  10.663  -6.147   6.398
  187   2HG2  THR  24          2HG2      THR  24   9.034  -6.162   5.721
  188   3HG2  THR  24          3HG2      THR  24   9.275  -5.816   7.434
  189    H    HIS  25           H        HIS  25  11.659  -1.445   5.110
  190    HA   HIS  25           HA       HIS  25  11.616  -2.115   2.199
  191   1HB   HIS  25          1HB       HIS  25  10.745   0.373   3.699
  192   2HB   HIS  25          2HB       HIS  25  10.556   0.082   1.972
  193    HD1  HIS  25           HD1      HIS  25   9.275  -1.049   5.319
  194    HD2  HIS  25           HD2      HIS  25   8.497  -1.750   1.284
  195    HE1  HIS  25           HE1      HIS  25   7.129  -2.392   5.226
  196    H    LYS  26           H        LYS  26  13.553  -1.016   4.748
  197    HA   LYS  26           HA       LYS  26  15.092   1.093   3.720
  198   1HB   LYS  26          1HB       LYS  26  16.780   0.287   5.243
  199   2HB   LYS  26          2HB       LYS  26  15.221  -0.122   5.960
  200   1HG   LYS  26          1HG       LYS  26  15.393  -2.403   4.998
  201   2HG   LYS  26          2HG       LYS  26  16.978  -1.990   4.343
  202   1HD   LYS  26          1HD       LYS  26  16.414  -1.635   7.278
  203   2HD   LYS  26          2HD       LYS  26  16.860  -3.220   6.642
  204   1HE   LYS  26          1HE       LYS  26  18.632  -1.230   5.536
  205   2HE   LYS  26          2HE       LYS  26  18.621  -1.103   7.306
  206   1HZ   LYS  26          1HZ       LYS  26  18.972  -3.599   5.729
  207   2HZ   LYS  26          2HZ       LYS  26  18.865  -3.523   7.423
  208   3HZ   LYS  26          3HZ       LYS  26  20.178  -2.805   6.618
  209    H    ALA  27           H        ALA  27  14.902  -2.229   2.679
  210    HA   ALA  27           HA       ALA  27  17.337  -2.013   0.997
  211   1HB   ALA  27          1HB       ALA  27  15.588  -4.365   0.746
  212   2HB   ALA  27          2HB       ALA  27  16.077  -4.035   2.408
  213   3HB   ALA  27          3HB       ALA  27  17.299  -4.284   1.162
  214    H    VAL  28           H        VAL  28  14.101  -1.162   0.775
  215    HA   VAL  28           HA       VAL  28  13.642  -1.923  -2.021
  216    HB   VAL  28           HB       VAL  28  12.237  -0.258   0.068
  217   1HG1  VAL  28          1HG1      VAL  28  11.784   0.805  -2.081
  218   2HG1  VAL  28          2HG1      VAL  28  10.353  -0.065  -1.533
  219   3HG1  VAL  28          3HG1      VAL  28  11.377  -0.758  -2.791
  220   1HG2  VAL  28          1HG2      VAL  28  12.289  -2.861  -0.003
  221   2HG2  VAL  28          2HG2      VAL  28  11.194  -2.684  -1.375
  222   3HG2  VAL  28          3HG2      VAL  28  10.732  -2.059   0.209
  223    H    LYS  29           H        LYS  29  12.897   0.083  -3.462
  224    HA   LYS  29           HA       LYS  29  15.232   1.896  -3.504
  225   1HB   LYS  29          1HB       LYS  29  13.379   0.726  -5.372
  226   2HB   LYS  29          2HB       LYS  29  13.408   2.480  -5.563
  227   1HG   LYS  29          1HG       LYS  29  15.228   2.013  -6.867
  228   2HG   LYS  29          2HG       LYS  29  16.046   2.035  -5.303
  229   1HD   LYS  29          1HD       LYS  29  14.949  -0.562  -5.602
  230   2HD   LYS  29          2HD       LYS  29  15.734  -0.168  -7.132
  231   1HE   LYS  29          1HE       LYS  29  17.774   0.544  -5.806
  232   2HE   LYS  29          2HE       LYS  29  16.986  -0.137  -4.368
  233   1HZ   LYS  29          1HZ       LYS  29  18.364  -1.801  -5.470
  234   2HZ   LYS  29          2HZ       LYS  29  17.494  -1.587  -6.914
  235   3HZ   LYS  29          3HZ       LYS  29  16.725  -2.232  -5.543
  236    H    CYS  30           H        CYS  30  14.958   3.524  -2.082
  237    HA   CYS  30           HA       CYS  30  12.652   4.727  -1.076
  238   1HB   CYS  30          1HB       CYS  30  15.384   5.789  -1.813
  239   2HB   CYS  30          2HB       CYS  30  14.183   6.833  -1.057
  240    H    GLY  31           H        GLY  31  13.997   4.947  -4.285
  241   1HA   GLY  31          1HA       GLY  31  12.308   7.245  -5.033
  242   2HA   GLY  31          2HA       GLY  31  13.431   6.396  -6.098
  243    H    ASP  32           H        ASP  32  12.004   3.843  -4.856
  244    HA   ASP  32           HA       ASP  32  10.127   3.562  -7.089
  245   1HB   ASP  32          1HB       ASP  32  11.687   1.923  -5.438
  246   2HB   ASP  32          2HB       ASP  32  10.031   1.532  -4.993
  247    H    CYS  33           H        CYS  33   9.990   3.985  -3.573
  248    HA   CYS  33           HA       CYS  33   7.027   3.982  -3.556
  249   1HB   CYS  33          1HB       CYS  33   9.273   4.260  -1.545
  250   2HB   CYS  33          2HB       CYS  33   7.607   4.608  -1.085
  251    H    HIS  34           H        HIS  34   9.639   6.239  -2.580
  252    HA   HIS  34           HA       HIS  34   7.837   8.568  -2.884
  253   1HB   HIS  34          1HB       HIS  34  10.737   8.176  -2.058
  254   2HB   HIS  34          2HB       HIS  34   9.938   9.741  -2.091
  255    HD1  HIS  34           HD1      HIS  34   7.490   9.642  -0.643
  256    HD2  HIS  34           HD2      HIS  34  10.553   7.028   0.431
  257    HE1  HIS  34           HE1      HIS  34   7.021   8.922   1.741
  258    H    HIS  35           H        HIS  35   8.213   7.216  -5.324
  259    HA   HIS  35           HA       HIS  35  10.266   7.630  -7.037
  260   1HB   HIS  35          1HB       HIS  35   8.437   8.254  -8.742
  261   2HB   HIS  35          2HB       HIS  35   8.230   6.751  -7.864
  262    HD1  HIS  35           HD1      HIS  35   7.002  10.255  -8.004
  263    HD2  HIS  35           HD2      HIS  35   5.980   6.686  -6.136
  264    HE1  HIS  35           HE1      HIS  35   4.729  10.634  -6.961
  265    HA   PRO  36           HA       PRO  36  11.460  11.791  -7.307
  266   1HB   PRO  36          1HB       PRO  36  11.987  12.050  -9.988
  267   2HB   PRO  36          2HB       PRO  36  13.036  11.161  -8.866
  268   1HG   PRO  36          1HG       PRO  36  10.962  10.117 -10.741
  269   2HG   PRO  36          2HG       PRO  36  12.583   9.490 -10.392
  270   1HD   PRO  36          1HD       PRO  36  10.369   8.396  -9.315
  271   2HD   PRO  36          2HD       PRO  36  11.912   8.466  -8.433
  272    H    VAL  37           H        VAL  37   9.651  13.036  -6.830
  273    HA   VAL  37           HA       VAL  37   7.735  13.657  -9.037
  274    HB   VAL  37           HB       VAL  37   7.715  13.807  -6.023
  275   1HG1  VAL  37          1HG1      VAL  37   6.704  15.869  -6.495
  276   2HG1  VAL  37          2HG1      VAL  37   5.322  14.772  -6.459
  277   3HG1  VAL  37          3HG1      VAL  37   6.001  15.287  -8.004
  278   1HG2  VAL  37          1HG2      VAL  37   5.413  12.654  -6.666
  279   2HG2  VAL  37          2HG2      VAL  37   6.910  11.722  -6.664
  280   3HG2  VAL  37          3HG2      VAL  37   6.252  12.329  -8.183
  281    H    ASN  38           H        ASN  38   7.251  15.947  -9.414
  282    HA   ASN  38           HA       ASN  38   8.000  18.169  -9.812
  283   1HB   ASN  38          1HB       ASN  38   7.318  17.877  -7.343
  284   2HB   ASN  38          2HB       ASN  38   9.031  17.877  -6.997
  285   1HD2  ASN  38          2HD2      ASN  38   6.527  19.963  -6.906
  286   2HD2  ASN  38          1HD2      ASN  38   7.309  21.407  -7.335
  287    H    GLY  39           H        GLY  39  10.026  15.856 -10.192
  288   1HA   GLY  39          1HA       GLY  39  12.231  15.984 -11.094
  289   2HA   GLY  39          2HA       GLY  39  12.393  17.599 -10.400
  290    H    LYS  40           H        LYS  40  11.109  16.040  -7.900
  291    HA   LYS  40           HA       LYS  40  13.657  14.753  -6.987
  292   1HB   LYS  40          1HB       LYS  40  13.370  16.103  -4.852
  293   2HB   LYS  40          2HB       LYS  40  13.801  17.053  -6.276
  294   1HG   LYS  40          1HG       LYS  40  11.799  18.133  -6.316
  295   2HG   LYS  40          2HG       LYS  40  10.900  16.678  -5.885
  296   1HD   LYS  40          1HD       LYS  40  10.621  17.880  -3.933
  297   2HD   LYS  40          2HD       LYS  40  12.131  17.052  -3.547
  298   1HE   LYS  40          1HE       LYS  40  13.431  18.972  -3.912
  299   2HE   LYS  40          2HE       LYS  40  12.198  19.725  -4.944
  300   1HZ   LYS  40          1HZ       LYS  40  12.349  20.550  -2.556
  301   2HZ   LYS  40          2HZ       LYS  40  11.665  19.059  -2.111
  302   3HZ   LYS  40          3HZ       LYS  40  10.809  20.121  -3.124
  303    H    GLU  41           H        GLU  41  13.281  12.976  -5.650
  304    HA   GLU  41           HA       GLU  41  10.655  11.840  -5.465
  305   1HB   GLU  41          1HB       GLU  41  13.297  11.353  -4.079
  306   2HB   GLU  41          2HB       GLU  41  11.879  10.363  -3.746
  307   1HG   GLU  41          1HG       GLU  41  11.798   9.532  -5.953
  308   2HG   GLU  41          2HG       GLU  41  12.821  10.825  -6.576
  309    H    ASP  42           H        ASP  42   9.051  12.818  -4.241
  310    HA   ASP  42           HA       ASP  42   9.555  14.520  -1.981
  311   1HB   ASP  42          1HB       ASP  42   7.169  12.972  -2.998
  312   2HB   ASP  42          2HB       ASP  42   7.077  14.027  -1.590
  313    H    TYR  43           H        TYR  43  10.781  13.546  -0.381
  314    HA   TYR  43           HA       TYR  43  10.263  10.805   0.512
  315   1HB   TYR  43          1HB       TYR  43  12.037  13.052   1.522
  316   2HB   TYR  43          2HB       TYR  43  12.100  11.391   2.110
  317    HD1  TYR  43           HD1      TYR  43  12.404   9.528   0.285
  318    HD2  TYR  43           HD2      TYR  43  13.344  13.677  -0.318
  319    HE1  TYR  43           HE1      TYR  43  13.887   8.918  -1.607
  320    HE2  TYR  43           HE2      TYR  43  14.827  13.066  -2.210
  321    HH   TYR  43           HH       TYR  43  15.676  11.417  -3.420
  322    H    GLN  44           H        GLN  44   7.865  11.831   0.905
  323    HA   GLN  44           HA       GLN  44   7.731  12.391   3.842
  324   1HB   GLN  44          1HB       GLN  44   5.911  14.049   3.259
  325   2HB   GLN  44          2HB       GLN  44   7.516  14.516   2.698
  326   1HG   GLN  44          1HG       GLN  44   6.678  13.092   0.553
  327   2HG   GLN  44          2HG       GLN  44   5.128  13.701   1.135
  328   1HE2  GLN  44          2HE2      GLN  44   8.473  14.966   0.589
  329   2HE2  GLN  44          1HE2      GLN  44   7.958  16.459  -0.035
  330    H    LYS  45           H        LYS  45   5.363  12.087   4.597
  331    HA   LYS  45           HA       LYS  45   4.458   9.495   4.272
  332   1HB   LYS  45          1HB       LYS  45   3.223  12.119   4.970
  333   2HB   LYS  45          2HB       LYS  45   2.139  10.748   4.730
  334   1HG   LYS  45          1HG       LYS  45   3.325   9.447   6.401
  335   2HG   LYS  45          2HG       LYS  45   4.546  10.708   6.568
  336   1HD   LYS  45          1HD       LYS  45   1.861  11.773   6.927
  337   2HD   LYS  45          2HD       LYS  45   2.201  10.474   8.070
  338   1HE   LYS  45          1HE       LYS  45   4.333  11.621   8.697
  339   2HE   LYS  45          2HE       LYS  45   3.888  12.963   7.625
  340   1HZ   LYS  45          1HZ       LYS  45   3.100  13.441   9.833
  341   2HZ   LYS  45          2HZ       LYS  45   2.311  11.939   9.927
  342   3HZ   LYS  45          3HZ       LYS  45   1.765  13.123   8.837
  343    H    CYS  46           H        CYS  46   3.356   8.370   2.722
  344    HA   CYS  46           HA       CYS  46   3.201   9.130   0.041
  345   1HB   CYS  46          1HB       CYS  46   1.423   7.278   1.650
  346   2HB   CYS  46          2HB       CYS  46   1.587   7.242  -0.102
  347    H    ALA  47           H        ALA  47   0.679   9.454   2.530
  348    HA   ALA  47           HA       ALA  47  -1.070  10.894   0.601
  349   1HB   ALA  47          1HB       ALA  47  -2.277  10.725   3.112
  350   2HB   ALA  47          2HB       ALA  47  -1.322   9.249   2.986
  351   3HB   ALA  47          3HB       ALA  47  -2.533   9.625   1.760
  352    H    THR  48           H        THR  48   1.067  12.486   1.089
  353    HA   THR  48           HA       THR  48   1.147  14.102   3.375
  354    HB   THR  48           HB       THR  48   1.470  15.402   0.720
  355    HG1  THR  48           1HG      THR  48   3.388  14.096   0.422
  356   1HG2  THR  48          1HG2      THR  48   3.797  15.102   2.445
  357   2HG2  THR  48          2HG2      THR  48   2.417  15.770   3.316
  358   3HG2  THR  48          3HG2      THR  48   3.018  16.573   1.865
  359    H    ALA  49           H        ALA  49   0.549  16.639   2.986
  360    HA   ALA  49           HA       ALA  49  -2.360  16.751   3.109
  361   1HB   ALA  49          1HB       ALA  49  -1.915  19.106   3.601
  362   2HB   ALA  49          2HB       ALA  49  -0.265  18.939   3.004
  363   3HB   ALA  49          3HB       ALA  49  -0.760  18.100   4.473
  364    H    GLY  50           H        GLY  50  -2.124  15.783   0.711
  365   1HA   GLY  50          1HA       GLY  50  -3.479  17.097  -1.166
  366   2HA   GLY  50          2HA       GLY  50  -1.943  17.958  -1.305
  367    H    CYS  51           H        CYS  51  -0.877  15.154  -0.341
  368    HA   CYS  51           HA       CYS  51  -0.093  14.218  -2.977
  369   1HB   CYS  51          1HB       CYS  51   0.565  14.059  -0.157
  370   2HB   CYS  51          2HB       CYS  51   0.672  12.486  -0.883
  371    H    HIS  52           H        HIS  52  -0.364  11.381  -1.378
  372    HA   HIS  52           HA       HIS  52  -2.756  10.558  -2.844
  373   1HB   HIS  52          1HB       HIS  52  -0.816   9.256  -0.928
  374   2HB   HIS  52          2HB       HIS  52  -2.176   8.381  -1.602
  375    HD1  HIS  52           HD1      HIS  52  -2.266   8.712  -4.365
  376    HD2  HIS  52           HD2      HIS  52   1.431   8.958  -2.494
  377    HE1  HIS  52           HE1      HIS  52  -0.529   8.297  -6.170
  378    H    ASP  53           H        ASP  53  -3.580  12.560  -1.140
  379    HA   ASP  53           HA       ASP  53  -4.608  11.290   1.341
  380   1HB   ASP  53          1HB       ASP  53  -5.058  13.596   1.984
  381   2HB   ASP  53          2HB       ASP  53  -3.432  13.507   1.305
  382    H    ASN  54           H        ASN  54  -5.781  10.763  -1.486
  383    HA   ASN  54           HA       ASN  54  -8.401  12.084  -1.391
  384   1HB   ASN  54          1HB       ASN  54  -6.854  10.951  -3.326
  385   2HB   ASN  54          2HB       ASN  54  -7.973   9.629  -3.003
  386   1HD2  ASN  54          2HD2      ASN  54  -9.670   9.734  -4.474
  387   2HD2  ASN  54          1HD2      ASN  54 -10.441  11.160  -4.977
  388    H    MET  55           H        MET  55  -9.679  11.472   0.340
  389    HA   MET  55           HA       MET  55  -9.591   8.784   1.473
  390   1HB   MET  55          1HB       MET  55 -11.528  11.082   1.894
  391   2HB   MET  55          2HB       MET  55 -11.242   9.737   2.997
  392   1HG   MET  55          1HG       MET  55  -8.909  11.413   2.150
  393   2HG   MET  55          2HG       MET  55 -10.014  12.056   3.363
  394   1HE   MET  55          1HE       MET  55  -6.808   8.971   3.678
  395   2HE   MET  55          2HE       MET  55  -7.291  10.026   2.352
  396   3HE   MET  55          3HE       MET  55  -8.110   8.483   2.584
  397    H    ASP  56           H        ASP  56 -10.797   9.669  -1.396
  398    HA   ASP  56           HA       ASP  56 -13.520   8.606  -1.232
  399   1HB   ASP  56          1HB       ASP  56 -12.083  10.253  -2.913
  400   2HB   ASP  56          2HB       ASP  56 -12.168   8.759  -3.847
  401    H    LYS  57           H        LYS  57 -10.417   7.231  -1.349
  402    HA   LYS  57           HA       LYS  57  -9.630   5.077  -1.959
  403   1HB   LYS  57          1HB       LYS  57 -10.961   4.710   0.065
  404   2HB   LYS  57          2HB       LYS  57 -12.430   4.580  -0.899
  405   1HG   LYS  57          1HG       LYS  57 -10.489   2.769  -1.972
  406   2HG   LYS  57          2HG       LYS  57 -10.589   2.511  -0.230
  407   1HD   LYS  57          1HD       LYS  57 -12.727   1.727  -0.336
  408   2HD   LYS  57          2HD       LYS  57 -13.189   2.873  -1.593
  409   1HE   LYS  57          1HE       LYS  57 -12.144   1.523  -3.312
  410   2HE   LYS  57          2HE       LYS  57 -11.437   0.443  -2.094
  411   1HZ   LYS  57          1HZ       LYS  57 -14.350   0.952  -2.341
  412   2HZ   LYS  57          2HZ       LYS  57 -13.587  -0.218  -1.375
  413   3HZ   LYS  57          3HZ       LYS  57 -13.573  -0.369  -3.066
  414    H    LYS  58           H        LYS  58 -11.187   6.624  -4.063
  415    HA   LYS  58           HA       LYS  58 -11.873   4.268  -5.778
  416   1HB   LYS  58          1HB       LYS  58 -13.870   5.373  -6.493
  417   2HB   LYS  58          2HB       LYS  58 -13.840   5.547  -4.738
  418   1HG   LYS  58          1HG       LYS  58 -14.132   7.760  -5.151
  419   2HG   LYS  58          2HG       LYS  58 -12.412   7.752  -5.545
  420   1HD   LYS  58          1HD       LYS  58 -12.922   7.353  -7.904
  421   2HD   LYS  58          2HD       LYS  58 -14.645   7.263  -7.538
  422   1HE   LYS  58          1HE       LYS  58 -14.635   9.605  -6.784
  423   2HE   LYS  58          2HE       LYS  58 -12.889   9.707  -7.091
  424   1HZ   LYS  58          1HZ       LYS  58 -13.178   9.463  -9.354
  425   2HZ   LYS  58          2HZ       LYS  58 -14.529  10.412  -8.948
  426   3HZ   LYS  58          3HZ       LYS  58 -14.705   8.741  -9.200
  427    H    ASP  59           H        ASP  59 -10.566   7.513  -5.485
  428    HA   ASP  59           HA       ASP  59 -10.295   8.298  -8.174
  429   1HB   ASP  59          1HB       ASP  59  -9.693   9.816  -6.462
  430   2HB   ASP  59          2HB       ASP  59  -8.640   8.642  -5.673
  431    H    LYS  60           H        LYS  60  -9.552   6.922  -9.764
  432    HA   LYS  60           HA       LYS  60  -7.406   4.974  -9.196
  433   1HB   LYS  60          1HB       LYS  60  -9.489   5.505 -11.212
  434   2HB   LYS  60          2HB       LYS  60  -7.982   4.888 -11.892
  435   1HG   LYS  60          1HG       LYS  60  -9.175   3.578  -9.462
  436   2HG   LYS  60          2HG       LYS  60  -9.792   3.186 -11.068
  437   1HD   LYS  60          1HD       LYS  60  -6.853   3.200 -10.890
  438   2HD   LYS  60          2HD       LYS  60  -7.626   1.970  -9.891
  439   1HE   LYS  60          1HE       LYS  60  -8.521   0.850 -11.721
  440   2HE   LYS  60          2HE       LYS  60  -8.577   2.316 -12.719
  441   1HZ   LYS  60          1HZ       LYS  60  -6.699   0.594 -13.116
  442   2HZ   LYS  60          2HZ       LYS  60  -5.990   1.303 -11.744
  443   3HZ   LYS  60          3HZ       LYS  60  -6.324   2.249 -13.116
  444    H    SER  61           H        SER  61  -6.953   8.009  -9.266
  445    HA   SER  61           HA       SER  61  -5.107   8.242 -11.591
  446   1HB   SER  61          1HB       SER  61  -6.854   9.949 -10.121
  447   2HB   SER  61          2HB       SER  61  -5.217  10.554  -9.889
  448    HG   SER  61           HG       SER  61  -6.690  10.995 -11.937
  449    H    ALA  62           H        ALA  62  -3.371  10.153 -10.319
  450    HA   ALA  62           HA       ALA  62  -1.708   8.281  -8.698
  451   1HB   ALA  62          1HB       ALA  62  -0.524  10.836  -9.422
  452   2HB   ALA  62          2HB       ALA  62  -1.267  10.069 -10.825
  453   3HB   ALA  62          3HB       ALA  62  -0.034   9.212  -9.902
  454    H    LYS  63           H        LYS  63  -4.082  10.057  -7.735
  455    HA   LYS  63           HA       LYS  63  -2.557  11.464  -5.559
  456   1HB   LYS  63          1HB       LYS  63  -4.019  12.634  -7.522
  457   2HB   LYS  63          2HB       LYS  63  -5.285  12.366  -6.321
  458   1HG   LYS  63          1HG       LYS  63  -4.542  14.128  -5.140
  459   2HG   LYS  63          2HG       LYS  63  -2.972  13.345  -4.957
  460   1HD   LYS  63          1HD       LYS  63  -2.762  15.560  -6.050
  461   2HD   LYS  63          2HD       LYS  63  -2.246  14.256  -7.121
  462   1HE   LYS  63          1HE       LYS  63  -3.639  15.448  -8.564
  463   2HE   LYS  63          2HE       LYS  63  -4.823  14.336  -7.849
  464   1HZ   LYS  63          1HZ       LYS  63  -4.235  16.711  -6.292
  465   2HZ   LYS  63          2HZ       LYS  63  -5.724  15.948  -6.589
  466   3HZ   LYS  63          3HZ       LYS  63  -5.058  16.997  -7.747
  467    H    GLY  64           H        GLY  64  -4.767   9.002  -6.289
  468   1HA   GLY  64          1HA       GLY  64  -6.455   9.254  -3.949
  469   2HA   GLY  64          2HA       GLY  64  -6.361   7.849  -5.001
  470    H    TYR  65           H        TYR  65  -6.319   8.052  -2.048
  471    HA   TYR  65           HA       TYR  65  -3.596   7.273  -1.250
  472   1HB   TYR  65          1HB       TYR  65  -5.290   8.626   0.094
  473   2HB   TYR  65          2HB       TYR  65  -6.190   7.121   0.296
  474    HD1  TYR  65           HD1      TYR  65  -5.871   6.286   2.450
  475    HD2  TYR  65           HD2      TYR  65  -2.524   7.919   0.312
  476    HE1  TYR  65           HE1      TYR  65  -4.360   5.610   4.294
  477    HE2  TYR  65           HE2      TYR  65  -1.013   7.245   2.159
  478    HH   TYR  65           HH       TYR  65  -1.369   6.804   4.753
  479    H    TYR  66           H        TYR  66  -6.500   5.706  -2.323
  480    HA   TYR  66           HA       TYR  66  -5.656   3.096  -1.179
  481   1HB   TYR  66          1HB       TYR  66  -7.932   3.474  -0.839
  482   2HB   TYR  66          2HB       TYR  66  -8.114   4.337  -2.365
  483    HD1  TYR  66           HD1      TYR  66  -7.785   2.974  -4.531
  484    HD2  TYR  66           HD2      TYR  66  -8.542   1.216  -0.691
  485    HE1  TYR  66           HE1      TYR  66  -8.552   0.886  -5.640
  486    HE2  TYR  66           HE2      TYR  66  -9.303  -0.873  -1.791
  487    HH   TYR  66           HH       TYR  66  -8.817  -2.001  -4.130
  488    H    HIS  67           H        HIS  67  -6.193   4.716  -4.305
  489    HA   HIS  67           HA       HIS  67  -5.842   2.487  -6.038
  490   1HB   HIS  67          1HB       HIS  67  -6.629   4.523  -6.944
  491   2HB   HIS  67          2HB       HIS  67  -5.329   5.455  -6.201
  492    HD1  HIS  67           HD1      HIS  67  -5.867   2.857  -8.918
  493    HD2  HIS  67           HD2      HIS  67  -3.060   5.730  -7.803
  494    HE1  HIS  67           HE1      HIS  67  -4.111   2.887 -10.739
  495    H    ALA  68           H        ALA  68  -3.345   4.994  -5.587
  496    HA   ALA  68           HA       ALA  68  -1.148   3.650  -6.584
  497   1HB   ALA  68          1HB       ALA  68  -0.472   5.717  -5.953
  498   2HB   ALA  68          2HB       ALA  68  -0.172   5.017  -4.361
  499   3HB   ALA  68          3HB       ALA  68  -1.711   5.813  -4.700
  500    H    MET  69           H        MET  69  -2.817   2.902  -3.599
  501    HA   MET  69           HA       MET  69  -0.545   1.320  -2.568
  502   1HB   MET  69          1HB       MET  69  -3.338   1.904  -1.571
  503   2HB   MET  69          2HB       MET  69  -2.108   1.036  -0.651
  504   1HG   MET  69          1HG       MET  69  -1.053   3.513  -1.741
  505   2HG   MET  69          2HG       MET  69  -2.462   3.809  -0.731
  506   1HE   MET  69          1HE       MET  69   0.822   3.951  -1.000
  507   2HE   MET  69          2HE       MET  69   1.588   3.667   0.561
  508   3HE   MET  69          3HE       MET  69   0.428   4.979   0.385
  509    H    HIS  70           H        HIS  70  -3.901   0.697  -3.674
  510    HA   HIS  70           HA       HIS  70  -3.377  -2.207  -3.473
  511   1HB   HIS  70          1HB       HIS  70  -5.827  -0.655  -4.355
  512   2HB   HIS  70          2HB       HIS  70  -5.779  -2.357  -3.893
  513    HD1  HIS  70           HD1      HIS  70  -6.046   1.043  -2.510
  514    HD2  HIS  70           HD2      HIS  70  -5.172  -2.761  -1.051
  515    HE1  HIS  70           HE1      HIS  70  -6.257   1.179   0.008
  516    H    ASP  71           H        ASP  71  -3.439   0.304  -5.876
  517    HA   ASP  71           HA       ASP  71  -3.919  -1.473  -8.150
  518   1HB   ASP  71          1HB       ASP  71  -3.078   1.398  -7.727
  519   2HB   ASP  71          2HB       ASP  71  -3.220   0.697  -9.333
  520    H    LYS  72           H        LYS  72  -2.355  -2.741  -9.064
  521    HA   LYS  72           HA       LYS  72   0.461  -2.431  -8.276
  522   1HB   LYS  72          1HB       LYS  72   0.699  -4.571  -9.329
  523   2HB   LYS  72          2HB       LYS  72  -0.876  -4.597  -8.536
  524   1HG   LYS  72          1HG       LYS  72  -1.935  -3.937 -10.695
  525   2HG   LYS  72          2HG       LYS  72  -0.354  -4.037 -11.470
  526   1HD   LYS  72          1HD       LYS  72  -0.187  -6.416 -10.802
  527   2HD   LYS  72          2HD       LYS  72  -1.790  -6.312 -10.072
  528   1HE   LYS  72          1HE       LYS  72  -2.721  -5.661 -12.310
  529   2HE   LYS  72          2HE       LYS  72  -1.115  -5.945 -13.011
  530   1HZ   LYS  72          1HZ       LYS  72  -1.214  -8.176 -11.862
  531   2HZ   LYS  72          2HZ       LYS  72  -2.244  -7.985 -13.199
  532   3HZ   LYS  72          3HZ       LYS  72  -2.868  -7.889 -11.622
  533    H    GLY  73           H        GLY  73  -1.441  -2.241 -11.287
  534   1HA   GLY  73          1HA       GLY  73   0.838  -1.515 -12.926
  535   2HA   GLY  73          2HA       GLY  73  -0.857  -1.364 -13.397
  536    H    THR  74           H        THR  74   1.253   0.114 -10.915
  537    HA   THR  74           HA       THR  74  -0.014   2.751 -11.530
  538    HB   THR  74           HB       THR  74   1.181   3.194  -9.234
  539    HG1  THR  74           1HG      THR  74   2.276   1.068  -9.553
  540   1HG2  THR  74          1HG2      THR  74  -1.218   1.410  -9.675
  541   2HG2  THR  74          2HG2      THR  74  -1.198   3.134  -9.303
  542   3HG2  THR  74          3HG2      THR  74  -0.744   1.959  -8.068
  543    H    LYS  75           H        LYS  75   1.429   4.645 -11.534
  544    HA   LYS  75           HA       LYS  75   3.562   4.713 -13.254
  545   1HB   LYS  75          1HB       LYS  75   2.343   6.493 -11.680
  546   2HB   LYS  75          2HB       LYS  75   3.776   6.253 -10.685
  547   1HG   LYS  75          1HG       LYS  75   4.069   8.128 -12.283
  548   2HG   LYS  75          2HG       LYS  75   5.220   6.827 -12.581
  549   1HD   LYS  75          1HD       LYS  75   2.877   6.224 -14.074
  550   2HD   LYS  75          2HD       LYS  75   3.264   7.919 -14.374
  551   1HE   LYS  75          1HE       LYS  75   5.745   6.587 -14.436
  552   2HE   LYS  75          2HE       LYS  75   4.630   5.557 -15.355
  553   1HZ   LYS  75          1HZ       LYS  75   3.812   7.681 -16.403
  554   2HZ   LYS  75          2HZ       LYS  75   5.373   7.191 -16.862
  555   3HZ   LYS  75          3HZ       LYS  75   5.169   8.448 -15.736
  556    H    PHE  76           H        PHE  76   3.682   3.776  -9.831
  557    HA   PHE  76           HA       PHE  76   6.441   2.681 -10.283
  558   1HB   PHE  76          1HB       PHE  76   5.380   4.116  -7.831
  559   2HB   PHE  76          2HB       PHE  76   7.016   3.511  -8.055
  560    HD1  PHE  76           HD1      PHE  76   8.451   4.510  -9.899
  561    HD2  PHE  76           HD2      PHE  76   4.672   6.180  -8.724
  562    HE1  PHE  76           HE1      PHE  76   9.032   6.636 -11.039
  563    HE2  PHE  76           HE2      PHE  76   5.254   8.302  -9.861
  564    HZ   PHE  76           HZ       PHE  76   7.428   8.524 -11.015
  565    H    LYS  77           H        LYS  77   6.958   1.140  -8.278
  566    HA   LYS  77           HA       LYS  77   4.841  -0.844  -8.206
  567   1HB   LYS  77          1HB       LYS  77   6.401  -1.990  -6.675
  568   2HB   LYS  77          2HB       LYS  77   7.218  -1.435  -8.133
  569   1HG   LYS  77          1HG       LYS  77   7.913   0.625  -6.847
  570   2HG   LYS  77          2HG       LYS  77   7.274  -0.146  -5.394
  571   1HD   LYS  77          1HD       LYS  77   9.739  -0.514  -5.703
  572   2HD   LYS  77          2HD       LYS  77   8.810  -2.011  -5.645
  573   1HE   LYS  77          1HE       LYS  77   8.878  -2.240  -8.054
  574   2HE   LYS  77          2HE       LYS  77   9.619  -0.638  -8.229
  575   1HZ   LYS  77          1HZ       LYS  77  11.289  -1.661  -6.496
  576   2HZ   LYS  77          2HZ       LYS  77  11.492  -1.913  -8.164
  577   3HZ   LYS  77          3HZ       LYS  77  10.785  -3.120  -7.200
  578    H    SER  78           H        SER  78   3.095  -0.508  -7.060
  579    HA   SER  78           HA       SER  78   2.893   1.373  -4.853
  580   1HB   SER  78          1HB       SER  78   0.531   0.214  -4.882
  581   2HB   SER  78          2HB       SER  78   1.021   1.230  -6.235
  582    HG   SER  78           HG       SER  78   0.836  -0.480  -7.427
  583    H    CYS  79           H        CYS  79   1.621   0.556  -2.835
  584    HA   CYS  79           HA       CYS  79   3.221  -1.190  -1.283
  585   1HB   CYS  79          1HB       CYS  79   0.289  -0.437  -1.061
  586   2HB   CYS  79          2HB       CYS  79   1.271  -1.075   0.255
  587    H    VAL  80           H        VAL  80  -0.106  -1.876  -2.408
  588    HA   VAL  80           HA       VAL  80   0.143  -4.739  -2.044
  589    HB   VAL  80           HB       VAL  80  -1.759  -2.872  -3.462
  590   1HG1  VAL  80          1HG1      VAL  80  -1.436  -5.720  -3.865
  591   2HG1  VAL  80          2HG1      VAL  80  -2.531  -4.598  -4.676
  592   3HG1  VAL  80          3HG1      VAL  80  -3.015  -5.365  -3.164
  593   1HG2  VAL  80          1HG2      VAL  80  -2.454  -4.722  -1.201
  594   2HG2  VAL  80          2HG2      VAL  80  -3.117  -3.134  -1.582
  595   3HG2  VAL  80          3HG2      VAL  80  -1.522  -3.268  -0.845
  596    H    GLY  81           H        GLY  81   0.741  -2.507  -4.700
  597   1HA   GLY  81          1HA       GLY  81   0.863  -4.464  -6.809
  598   2HA   GLY  81          2HA       GLY  81   1.587  -2.855  -6.864
  599    H    CYS  82           H        CYS  82   3.297  -3.069  -4.623
  600    HA   CYS  82           HA       CYS  82   5.498  -4.622  -5.783
  601   1HB   CYS  82          1HB       CYS  82   5.465  -2.333  -4.496
  602   2HB   CYS  82          2HB       CYS  82   5.438  -3.341  -3.051
  603    H    HIS  83           H        HIS  83   3.046  -5.000  -3.393
  604    HA   HIS  83           HA       HIS  83   4.305  -7.102  -1.840
  605   1HB   HIS  83          1HB       HIS  83   1.665  -5.733  -2.125
  606   2HB   HIS  83          2HB       HIS  83   1.694  -7.265  -1.269
  607    HD1  HIS  83           HD1      HIS  83   1.234  -5.950   0.994
  608    HD2  HIS  83           HD2      HIS  83   4.837  -5.001  -0.875
  609    HE1  HIS  83           HE1      HIS  83   2.629  -4.729   2.713
  610    H    LEU  84           H        LEU  84   1.446  -7.207  -4.041
  611    HA   LEU  84           HA       LEU  84   1.237  -9.982  -4.322
  612   1HB   LEU  84          1HB       LEU  84   0.221  -7.611  -5.430
  613   2HB   LEU  84          2HB       LEU  84   0.842  -8.518  -6.803
  614    HG   LEU  84           HG       LEU  84  -0.805  -9.916  -4.727
  615   1HD1  LEU  84          1HD1      LEU  84  -2.842  -9.208  -5.632
  616   2HD1  LEU  84          2HD1      LEU  84  -2.097  -8.666  -7.137
  617   3HD1  LEU  84          3HD1      LEU  84  -1.896  -7.720  -5.662
  618   1HD2  LEU  84          1HD2      LEU  84  -1.520 -11.005  -7.046
  619   2HD2  LEU  84          2HD2      LEU  84  -0.009 -11.467  -6.264
  620   3HD2  LEU  84          3HD2      LEU  84   0.005 -10.301  -7.587
  621    H    GLU  85           H        GLU  85   3.675  -7.815  -5.547
  622    HA   GLU  85           HA       GLU  85   4.695  -9.756  -7.534
  623   1HB   GLU  85          1HB       GLU  85   4.595  -7.043  -7.397
  624   2HB   GLU  85          2HB       GLU  85   6.217  -7.322  -6.762
  625   1HG   GLU  85          1HG       GLU  85   5.835  -9.031  -9.027
  626   2HG   GLU  85          2HG       GLU  85   5.367  -7.392  -9.483
  627    H    THR  86           H        THR  86   5.727  -8.268  -4.449
  628    HA   THR  86           HA       THR  86   8.232  -9.702  -4.286
  629    HB   THR  86           HB       THR  86   6.465  -8.057  -2.503
  630    HG1  THR  86           1HG      THR  86   7.922  -6.927  -3.648
  631   1HG2  THR  86          1HG2      THR  86   7.236 -10.008  -1.118
  632   2HG2  THR  86          2HG2      THR  86   7.865  -8.456  -0.565
  633   3HG2  THR  86          3HG2      THR  86   8.899  -9.550  -1.487
  634    H    ALA  87           H        ALA  87   5.074 -10.807  -4.116
  635    HA   ALA  87           HA       ALA  87   5.908 -13.185  -2.488
  636   1HB   ALA  87          1HB       ALA  87   3.733 -13.154  -1.458
  637   2HB   ALA  87          2HB       ALA  87   3.150 -11.932  -2.589
  638   3HB   ALA  87          3HB       ALA  87   4.350 -11.505  -1.371
  639    H    GLY  88           H        GLY  88   5.586 -12.451  -5.510
  640   1HA   GLY  88          1HA       GLY  88   3.377 -13.976  -6.520
  641   2HA   GLY  88          2HA       GLY  88   4.810 -13.527  -7.446
  642    H    ALA  89           H        ALA  89   6.193 -14.979  -4.945
  643    HA   ALA  89           HA       ALA  89   5.886 -17.737  -6.089
  644   1HB   ALA  89          1HB       ALA  89   8.231 -17.934  -6.133
  645   2HB   ALA  89          2HB       ALA  89   8.454 -16.628  -4.968
  646   3HB   ALA  89          3HB       ALA  89   7.977 -16.260  -6.626
  647    H    ASP  90           H        ASP  90   5.358 -15.898  -3.390
  648    HA   ASP  90           HA       ASP  90   5.856 -18.220  -1.573
  649   1HB   ASP  90          1HB       ASP  90   7.476 -16.426  -1.258
  650   2HB   ASP  90          2HB       ASP  90   6.186 -15.245  -1.110
  651    H    ALA  91           H        ALA  91   3.595 -18.737  -2.094
  652    HA   ALA  91           HA       ALA  91   1.279 -17.286  -1.920
  653   1HB   ALA  91          1HB       ALA  91   0.353 -19.390  -0.770
  654   2HB   ALA  91          2HB       ALA  91   2.018 -19.972  -0.738
  655   3HB   ALA  91          3HB       ALA  91   1.227 -19.647  -2.280
  656    H    ALA  92           H        ALA  92   3.480 -17.920   0.731
  657    HA   ALA  92           HA       ALA  92   1.632 -17.115   2.846
  658   1HB   ALA  92          1HB       ALA  92   3.914 -18.559   2.740
  659   2HB   ALA  92          2HB       ALA  92   3.391 -17.740   4.212
  660   3HB   ALA  92          3HB       ALA  92   4.595 -16.989   3.165
  661    H    LYS  93           H        LYS  93   4.281 -15.646   1.014
  662    HA   LYS  93           HA       LYS  93   4.235 -13.095   2.355
  663   1HB   LYS  93          1HB       LYS  93   5.380 -14.405  -0.035
  664   2HB   LYS  93          2HB       LYS  93   5.224 -12.658  -0.162
  665   1HG   LYS  93          1HG       LYS  93   6.278 -12.698   2.257
  666   2HG   LYS  93          2HG       LYS  93   6.860 -14.284   1.751
  667   1HD   LYS  93          1HD       LYS  93   7.219 -11.968  -0.116
  668   2HD   LYS  93          2HD       LYS  93   8.298 -12.107   1.273
  669   1HE   LYS  93          1HE       LYS  93   8.681 -14.545   0.537
  670   2HE   LYS  93          2HE       LYS  93   7.922 -14.074  -0.996
  671   1HZ   LYS  93          1HZ       LYS  93  10.436 -13.747  -0.783
  672   2HZ   LYS  93          2HZ       LYS  93  10.056 -12.438   0.232
  673   3HZ   LYS  93          3HZ       LYS  93   9.525 -12.447  -1.382
  674    H    LYS  94           H        LYS  94   2.278 -14.613  -0.085
  675    HA   LYS  94           HA       LYS  94   1.193 -12.170  -1.249
  676   1HB   LYS  94          1HB       LYS  94   0.987 -15.059  -1.507
  677   2HB   LYS  94          2HB       LYS  94  -0.606 -14.305  -1.597
  678   1HG   LYS  94          1HG       LYS  94   0.568 -12.613  -3.213
  679   2HG   LYS  94          2HG       LYS  94   1.787 -13.878  -3.370
  680   1HD   LYS  94          1HD       LYS  94  -0.790 -15.102  -3.567
  681   2HD   LYS  94          2HD       LYS  94  -0.751 -13.719  -4.663
  682   1HE   LYS  94          1HE       LYS  94   1.281 -14.553  -5.727
  683   2HE   LYS  94          2HE       LYS  94   1.379 -15.886  -4.559
  684   1HZ   LYS  94          1HZ       LYS  94  -0.922 -15.371  -6.369
  685   2HZ   LYS  94          2HZ       LYS  94  -0.770 -16.669  -5.282
  686   3HZ   LYS  94          3HZ       LYS  94   0.263 -16.557  -6.626
  687    H    LYS  95           H        LYS  95   0.279 -14.329   1.410
  688    HA   LYS  95           HA       LYS  95  -2.308 -13.042   1.867
  689   1HB   LYS  95          1HB       LYS  95  -2.452 -14.630   3.642
  690   2HB   LYS  95          2HB       LYS  95  -1.533 -15.447   2.379
  691   1HG   LYS  95          1HG       LYS  95   0.115 -15.776   3.872
  692   2HG   LYS  95          2HG       LYS  95   0.368 -14.032   3.907
  693   1HD   LYS  95          1HD       LYS  95  -1.823 -14.265   5.520
  694   2HD   LYS  95          2HD       LYS  95  -0.985 -15.779   5.870
  695   1HE   LYS  95          1HE       LYS  95   1.145 -14.306   6.120
  696   2HE   LYS  95          2HE       LYS  95   0.005 -12.953   6.262
  697   1HZ   LYS  95          1HZ       LYS  95   0.379 -13.872   8.435
  698   2HZ   LYS  95          2HZ       LYS  95   0.019 -15.440   7.889
  699   3HZ   LYS  95          3HZ       LYS  95  -1.201 -14.258   7.953
  700    H    GLU  96           H        GLU  96   0.973 -12.466   2.761
  701    HA   GLU  96           HA       GLU  96   0.246 -10.718   5.058
  702   1HB   GLU  96          1HB       GLU  96   2.635 -10.806   5.460
  703   2HB   GLU  96          2HB       GLU  96   2.103 -12.430   5.067
  704   1HG   GLU  96          1HG       GLU  96   2.904 -12.212   2.821
  705   2HG   GLU  96          2HG       GLU  96   3.263 -10.503   3.063
  706    H    LEU  97           H        LEU  97   1.817 -10.633   1.908
  707    HA   LEU  97           HA       LEU  97   2.310  -7.761   1.928
  708   1HB   LEU  97          1HB       LEU  97   2.354  -9.907  -0.197
  709   2HB   LEU  97          2HB       LEU  97   2.958  -8.267  -0.431
  710    HG   LEU  97           HG       LEU  97   3.981 -10.337   1.519
  711   1HD1  LEU  97          1HD1      LEU  97   5.463 -10.707  -0.112
  712   2HD1  LEU  97          2HD1      LEU  97   5.992  -9.028   0.015
  713   3HD1  LEU  97          3HD1      LEU  97   4.704  -9.466  -1.108
  714   1HD2  LEU  97          1HD2      LEU  97   5.663  -8.327   1.928
  715   2HD2  LEU  97          2HD2      LEU  97   4.154  -8.425   2.836
  716   3HD2  LEU  97          3HD2      LEU  97   4.275  -7.353   1.441
  717    H    THR  98           H        THR  98   0.119  -9.806  -0.047
  718    HA   THR  98           HA       THR  98  -1.425  -7.360  -0.736
  719    HB   THR  98           HB       THR  98  -2.439  -8.882  -2.413
  720    HG1  THR  98           1HG      THR  98  -1.144 -10.974  -2.469
  721   1HG2  THR  98          1HG2      THR  98   0.302  -9.608  -2.926
  722   2HG2  THR  98          2HG2      THR  98   0.231  -7.977  -2.260
  723   3HG2  THR  98          3HG2      THR  98  -0.680  -8.374  -3.716
  724    H    GLY  99           H        GLY  99  -1.579  -9.972   1.467
  725   1HA   GLY  99          1HA       GLY  99  -4.340 -10.539   1.584
  726   2HA   GLY  99          2HA       GLY  99  -3.268 -10.583   2.984
  727    H    CYS 100           H        CYS 100  -6.006  -9.155   1.871
  728    HA   CYS 100           HA       CYS 100  -5.576  -6.425   2.810
  729   1HB   CYS 100          1HB       CYS 100  -8.311  -7.474   2.621
  730   2HB   CYS 100          2HB       CYS 100  -7.618  -6.058   1.881
  731    H    LYS 101           H        LYS 101  -7.833  -8.949   3.945
  732    HA   LYS 101           HA       LYS 101  -7.844  -7.608   6.591
  733   1HB   LYS 101          1HB       LYS 101  -9.653  -9.140   4.913
  734   2HB   LYS 101          2HB       LYS 101  -9.638  -9.758   6.564
  735   1HG   LYS 101          1HG       LYS 101 -10.171  -7.583   7.462
  736   2HG   LYS 101          2HG       LYS 101  -9.962  -6.824   5.884
  737   1HD   LYS 101          1HD       LYS 101 -11.954  -7.689   5.049
  738   2HD   LYS 101          2HD       LYS 101 -11.954  -9.048   6.174
  739   1HE   LYS 101          1HE       LYS 101 -12.995  -7.843   7.823
  740   2HE   LYS 101          2HE       LYS 101 -12.114  -6.354   7.423
  741   1HZ   LYS 101          1HZ       LYS 101 -14.097  -7.514   5.564
  742   2HZ   LYS 101          2HZ       LYS 101 -13.492  -5.927   5.614
  743   3HZ   LYS 101          3HZ       LYS 101 -14.579  -6.462   6.804
  744    H    GLY 102           H        GLY 102  -5.695  -9.626   5.485
  745   1HA   GLY 102          1HA       GLY 102  -5.344 -10.983   8.055
  746   2HA   GLY 102          2HA       GLY 102  -5.700 -12.083   6.723
  747    H    SER 103           H        SER 103  -3.725  -9.106   6.713
  748    HA   SER 103           HA       SER 103  -1.395 -10.793   5.908
  749   1HB   SER 103          1HB       SER 103  -1.027  -9.291   4.165
  750   2HB   SER 103          2HB       SER 103  -2.771  -9.385   4.214
  751    HG   SER 103           HG       SER 103  -2.756  -7.489   5.480
  752    H    LYS 104           H        LYS 104   0.189  -8.340   5.632
  753    HA   LYS 104           HA       LYS 104   0.830  -7.874   8.512
  754   1HB   LYS 104          1HB       LYS 104   2.263  -7.475   5.869
  755   2HB   LYS 104          2HB       LYS 104   2.959  -7.046   7.430
  756   1HG   LYS 104          1HG       LYS 104   1.877  -9.816   7.060
  757   2HG   LYS 104          2HG       LYS 104   3.447  -9.420   6.359
  758   1HD   LYS 104          1HD       LYS 104   3.521  -8.327   8.941
  759   2HD   LYS 104          2HD       LYS 104   2.754  -9.904   9.138
  760   1HE   LYS 104          1HE       LYS 104   4.615 -11.043   8.145
  761   2HE   LYS 104          2HE       LYS 104   5.318  -9.521   7.563
  762   1HZ   LYS 104          1HZ       LYS 104   6.033  -8.949   9.612
  763   2HZ   LYS 104          2HZ       LYS 104   6.004 -10.627   9.880
  764   3HZ   LYS 104          3HZ       LYS 104   4.710  -9.657  10.403
  765    H    CYS 105           H        CYS 105  -0.216  -6.415   5.561
  766    HA   CYS 105           HA       CYS 105   0.274  -3.652   6.325
  767   1HB   CYS 105          1HB       CYS 105  -0.168  -5.139   4.041
  768   2HB   CYS 105          2HB       CYS 105  -1.686  -4.299   4.241
  769    H    HIS 106           H        HIS 106  -2.457  -5.904   6.503
  770    HA   HIS 106           HA       HIS 106  -4.097  -3.719   7.751
  771   1HB   HIS 106          1HB       HIS 106  -4.638  -6.000   5.902
  772   2HB   HIS 106          2HB       HIS 106  -5.919  -5.542   7.024
  773    HD1  HIS 106           HD1      HIS 106  -5.199  -2.450   7.008
  774    HD2  HIS 106           HD2      HIS 106  -5.862  -4.804   3.611
  775    HE1  HIS 106           HE1      HIS 106  -5.753  -0.849   5.133
  776    H    SER 107           H        SER 107  -3.065  -4.272   9.852
  777    HA   SER 107           HA       SER 107  -3.437  -6.963  10.956
  778   1HB   SER 107          1HB       SER 107  -2.258  -4.340  11.739
  779   2HB   SER 107          2HB       SER 107  -2.729  -5.419  13.049
  780    HG   SER 107           HG       SER 107  -0.837  -6.265  12.616
  781    HHA  HEC 201           HHA      HEC 201   6.044   8.631   5.711
  782    HHB  HEC 201           HHB      HEC 201  12.090   9.768   4.719
  783    HHC  HEC 201           HHC      HEC 201  12.540   4.660   1.041
  784    HHD  HEC 201           HHD      HEC 201   6.414   3.592   1.770
  785   1HMA  HEC 201          1HMA      HEC 201  10.338  11.832   6.524
  786   2HMA  HEC 201          2HMA      HEC 201  11.370  10.475   6.980
  787   3HMA  HEC 201          3HMA      HEC 201   9.867  10.775   7.857
  788   1HAA  HEC 201          1HAA      HEC 201   6.686   9.439   7.453
  789   2HAA  HEC 201          2HAA      HEC 201   8.031  10.392   8.071
  790   1HBA  HEC 201          1HBA      HEC 201   6.346  11.346   5.761
  791   2HBA  HEC 201          2HBA      HEC 201   5.892  11.667   7.433
  792   1HMB  HEC 201          1HMB      HEC 201  14.028   9.582   4.295
  793   2HMB  HEC 201          2HMB      HEC 201  15.129   8.204   4.298
  794   3HMB  HEC 201          3HMB      HEC 201  14.915   9.158   2.830
  795    HAB  HEC 201           HAB      HEC 201  14.387   5.398   1.192
  796   1HBB  HEC 201          1HBB      HEC 201  15.873   4.649   2.709
  797   2HBB  HEC 201          2HBB      HEC 201  15.227   5.786   3.892
  798   3HBB  HEC 201          3HBB      HEC 201  16.559   6.268   2.842
  799   1HMC  HEC 201          1HMC      HEC 201  11.513   1.678   0.558
  800   2HMC  HEC 201          2HMC      HEC 201  10.718   2.217  -0.921
  801   3HMC  HEC 201          3HMC      HEC 201  12.067   3.140  -0.258
  802    HAC  HEC 201           HAC      HEC 201   7.064   2.185   0.625
  803   1HBC  HEC 201          1HBC      HEC 201   8.230   0.094  -0.394
  804   2HBC  HEC 201          2HBC      HEC 201   8.282   0.317   1.354
  805   3HBC  HEC 201          3HBC      HEC 201   9.686   0.732   0.372
  806   1HMD  HEC 201          1HMD      HEC 201   4.585   3.257   3.716
  807   2HMD  HEC 201          2HMD      HEC 201   3.384   4.437   4.240
  808   3HMD  HEC 201          3HMD      HEC 201   3.748   4.255   2.524
  809   1HAD  HEC 201          1HAD      HEC 201   4.229   7.989   5.453
  810   2HAD  HEC 201          2HAD      HEC 201   3.133   7.051   4.448
  811   1HBD  HEC 201          1HBD      HEC 201   3.299   5.157   5.995
  812   2HBD  HEC 201          2HBD      HEC 201   4.458   6.048   6.982
  813    HHA  HEC 202           HHA      HEC 202   1.516   7.716  -9.536
  814    HHB  HEC 202           HHB      HEC 202   2.824   4.153  -4.920
  815    HHC  HEC 202           HHC      HEC 202   4.437   9.023  -1.262
  816    HHD  HEC 202           HHD      HEC 202   2.575  12.949  -5.936
  817   1HMA  HEC 202          1HMA      HEC 202   2.081   2.875  -7.456
  818   2HMA  HEC 202          2HMA      HEC 202   0.363   3.265  -7.396
  819   3HMA  HEC 202          3HMA      HEC 202   1.296   3.169  -5.904
  820   1HAA  HEC 202          1HAA      HEC 202   1.078   5.456 -10.087
  821   2HAA  HEC 202          2HAA      HEC 202   0.017   4.472  -9.113
  822   1HBA  HEC 202          1HBA      HEC 202  -1.334   6.450  -8.575
  823   2HBA  HEC 202          2HBA      HEC 202  -0.277   7.441  -9.575
  824   1HMB  HEC 202          1HMB      HEC 202   4.192   3.826  -1.394
  825   2HMB  HEC 202          2HMB      HEC 202   2.930   3.496  -2.583
  826   3HMB  HEC 202          3HMB      HEC 202   4.627   3.446  -3.060
  827    HAB  HEC 202           HAB      HEC 202   4.133   7.046   0.063
  828   1HBB  HEC 202          1HBB      HEC 202   6.374   6.933   0.297
  829   2HBB  HEC 202          2HBB      HEC 202   6.521   6.228  -1.313
  830   3HBB  HEC 202          3HBB      HEC 202   6.283   5.185   0.088
  831   1HMC  HEC 202          1HMC      HEC 202   4.899  10.965  -0.654
  832   2HMC  HEC 202          2HMC      HEC 202   5.340  12.537  -1.320
  833   3HMC  HEC 202          3HMC      HEC 202   3.749  12.301  -0.597
  834    HAC  HEC 202           HAC      HEC 202   2.620  14.042  -4.182
  835   1HBC  HEC 202          1HBC      HEC 202   4.623  15.134  -4.092
  836   2HBC  HEC 202          2HBC      HEC 202   5.328  13.901  -3.047
  837   3HBC  HEC 202          3HBC      HEC 202   4.374  15.208  -2.348
  838   1HMD  HEC 202          1HMD      HEC 202   2.793  13.551  -8.395
  839   2HMD  HEC 202          2HMD      HEC 202   1.034  13.421  -8.353
  840   3HMD  HEC 202          3HMD      HEC 202   1.917  12.987  -9.818
  841   1HAD  HEC 202          1HAD      HEC 202   1.862   9.264 -10.783
  842   2HAD  HEC 202          2HAD      HEC 202   1.112  10.845 -10.943
  843   1HBD  HEC 202          1HBD      HEC 202   3.623  11.647 -10.473
  844   2HBD  HEC 202          2HBD      HEC 202   3.976  10.067 -11.174
  845    HHA  HEC 203           HHA      HEC 203   7.036  -6.985   4.596
  846    HHB  HEC 203           HHB      HEC 203   2.690  -2.156   4.920
  847    HHC  HEC 203           HHC      HEC 203   4.701   0.005  -0.410
  848    HHD  HEC 203           HHD      HEC 203   8.951  -4.614  -0.894
  849   1HMA  HEC 203          1HMA      HEC 203   3.038  -5.122   7.564
  850   2HMA  HEC 203          2HMA      HEC 203   2.133  -4.006   6.541
  851   3HMA  HEC 203          3HMA      HEC 203   3.425  -3.401   7.577
  852   1HAA  HEC 203          1HAA      HEC 203   4.801  -6.189   7.740
  853   2HAA  HEC 203          2HAA      HEC 203   4.554  -7.399   6.488
  854   1HBA  HEC 203          1HBA      HEC 203   6.761  -7.913   6.387
  855   2HBA  HEC 203          2HBA      HEC 203   7.252  -6.223   6.491
  856   1HMB  HEC 203          1HMB      HEC 203   2.336   0.070   5.071
  857   2HMB  HEC 203          2HMB      HEC 203   1.914   1.224   3.805
  858   3HMB  HEC 203          3HMB      HEC 203   1.071  -0.322   3.906
  859    HAB  HEC 203           HAB      HEC 203   2.782   0.842   0.158
  860   1HBB  HEC 203          1HBB      HEC 203   3.318   3.306   1.010
  861   2HBB  HEC 203          2HBB      HEC 203   4.593   2.307   0.313
  862   3HBB  HEC 203          3HBB      HEC 203   4.452   2.457   2.064
  863   1HMC  HEC 203          1HMC      HEC 203   5.686   0.331  -2.119
  864   2HMC  HEC 203          2HMC      HEC 203   7.328   0.142  -2.735
  865   3HMC  HEC 203          3HMC      HEC 203   6.009  -0.787  -3.445
  866    HAC  HEC 203           HAC      HEC 203   9.199  -3.444  -2.551
  867   1HBC  HEC 203          1HBC      HEC 203   9.213  -0.836  -2.641
  868   2HBC  HEC 203          2HBC      HEC 203   8.174  -1.036  -4.048
  869   3HBC  HEC 203          3HBC      HEC 203   9.798  -1.724  -4.048
  870   1HMD  HEC 203          1HMD      HEC 203   9.957  -7.857   0.264
  871   2HMD  HEC 203          2HMD      HEC 203  10.974  -6.658   1.062
  872   3HMD  HEC 203          3HMD      HEC 203  10.160  -6.258  -0.451
  873   1HAD  HEC 203          1HAD      HEC 203  10.091  -7.861   3.266
  874   2HAD  HEC 203          2HAD      HEC 203   8.572  -8.075   4.127
  875   1HBD  HEC 203          1HBD      HEC 203   8.492  -9.060   1.361
  876   2HBD  HEC 203          2HBD      HEC 203   9.668  -9.897   2.375
  877    HHA  HEC 204           HHA      HEC 204  -6.777   2.338   3.647
  878    HHB  HEC 204           HHB      HEC 204 -10.082  -2.208   0.841
  879    HHC  HEC 204           HHC      HEC 204  -4.816  -5.878   0.915
  880    HHD  HEC 204           HHD      HEC 204  -1.500  -1.000   2.753
  881   1HMA  HEC 204          1HMA      HEC 204 -11.424  -0.771   1.378
  882   2HMA  HEC 204          2HMA      HEC 204 -11.175   0.924   0.957
  883   3HMA  HEC 204          3HMA      HEC 204 -11.689   0.488   2.587
  884   1HAA  HEC 204          1HAA      HEC 204 -10.191   2.266   4.017
  885   2HAA  HEC 204          2HAA      HEC 204  -8.621   2.981   3.652
  886   1HBA  HEC 204          1HBA      HEC 204  -9.311   3.231   1.278
  887   2HBA  HEC 204          2HBA      HEC 204 -10.888   2.569   1.685
  888   1HMB  HEC 204          1HMB      HEC 204 -10.553  -3.826  -0.374
  889   2HMB  HEC 204          2HMB      HEC 204 -10.192  -5.550  -0.288
  890   3HMB  HEC 204          3HMB      HEC 204  -9.708  -4.618  -1.704
  891    HAB  HEC 204           HAB      HEC 204  -6.459  -6.922   0.194
  892   1HBB  HEC 204          1HBB      HEC 204  -7.244  -5.771  -2.474
  893   2HBB  HEC 204          2HBB      HEC 204  -6.909  -7.492  -2.293
  894   3HBB  HEC 204          3HBB      HEC 204  -5.657  -6.306  -1.923
  895   1HMC  HEC 204          1HMC      HEC 204  -3.001  -6.536   0.859
  896   2HMC  HEC 204          2HMC      HEC 204  -1.501  -5.833   0.256
  897   3HMC  HEC 204          3HMC      HEC 204  -1.649  -6.265   1.959
  898    HAC  HEC 204           HAC      HEC 204  -0.443  -2.533   2.962
  899   1HBC  HEC 204          1HBC      HEC 204   1.428  -3.173   1.581
  900   2HBC  HEC 204          2HBC      HEC 204   0.185  -2.552   0.495
  901   3HBC  HEC 204          3HBC      HEC 204   0.432  -4.291   0.648
  902   1HMD  HEC 204          1HMD      HEC 204  -1.483   2.642   3.136
  903   2HMD  HEC 204          2HMD      HEC 204  -1.375   1.642   4.583
  904   3HMD  HEC 204          3HMD      HEC 204  -0.893   0.984   3.019
  905   1HAD  HEC 204          1HAD      HEC 204  -3.597   3.876   3.604
  906   2HAD  HEC 204          2HAD      HEC 204  -5.291   3.560   3.963
  907   1HBD  HEC 204          1HBD      HEC 204  -4.182   2.221   6.007
  908   2HBD  HEC 204          2HBD      HEC 204  -2.920   3.419   5.750
  Start of MODEL   11
    1   1H    ALA   1          1H        ALA   1  19.246  15.276   2.153
    2   2H    ALA   1          2H        ALA   1  18.829  14.084   1.016
    3   3H    ALA   1          3H        ALA   1  20.440  14.606   1.151
    4    HA   ALA   1           HA       ALA   1  20.048  12.411   2.210
    5   1HB   ALA   1          1HB       ALA   1  21.865  13.996   2.798
    6   2HB   ALA   1          2HB       ALA   1  21.317  13.097   4.212
    7   3HB   ALA   1          3HB       ALA   1  20.799  14.766   3.973
    8    HA   PRO   2           HA       PRO   2  16.004  13.181   4.305
    9   1HB   PRO   2          1HB       PRO   2  14.822  10.888   3.397
   10   2HB   PRO   2          2HB       PRO   2  14.809  12.405   2.486
   11   1HG   PRO   2          1HG       PRO   2  16.514   9.998   2.128
   12   2HG   PRO   2          2HG       PRO   2  15.812  11.073   0.910
   13   1HD   PRO   2          1HD       PRO   2  18.430  11.170   1.695
   14   2HD   PRO   2          2HD       PRO   2  17.540  12.564   1.044
   15    H    LYS   3           H        LYS   3  15.623  12.366   6.357
   16    HA   LYS   3           HA       LYS   3  17.233  10.000   7.198
   17   1HB   LYS   3          1HB       LYS   3  15.705  12.073   8.784
   18   2HB   LYS   3          2HB       LYS   3  16.818  10.873   9.435
   19   1HG   LYS   3          1HG       LYS   3  18.370  12.059   7.515
   20   2HG   LYS   3          2HG       LYS   3  17.401  13.423   8.074
   21   1HD   LYS   3          1HD       LYS   3  18.420  11.708  10.240
   22   2HD   LYS   3          2HD       LYS   3  19.679  12.526   9.315
   23   1HE   LYS   3          1HE       LYS   3  18.990  14.636   9.982
   24   2HE   LYS   3          2HE       LYS   3  17.295  14.135  10.162
   25   1HZ   LYS   3          1HZ       LYS   3  18.698  14.443  12.280
   26   2HZ   LYS   3          2HZ       LYS   3  19.404  12.956  11.858
   27   3HZ   LYS   3          3HZ       LYS   3  17.733  13.054  12.149
   28    H    ALA   4           H        ALA   4  15.783   8.442   6.285
   29    HA   ALA   4           HA       ALA   4  13.064   8.113   6.422
   30   1HB   ALA   4          1HB       ALA   4  15.199   6.534   5.873
   31   2HB   ALA   4          2HB       ALA   4  13.558   5.904   6.015
   32   3HB   ALA   4          3HB       ALA   4  14.664   5.798   7.384
   33    HA   PRO   5           HA       PRO   5  12.158   8.329  10.728
   34   1HB   PRO   5          1HB       PRO   5   9.522   7.599  10.565
   35   2HB   PRO   5          2HB       PRO   5  10.127   9.209  10.137
   36   1HG   PRO   5          1HG       PRO   5   9.266   6.995   8.382
   37   2HG   PRO   5          2HG       PRO   5   9.242   8.738   8.105
   38   1HD   PRO   5          1HD       PRO   5  11.111   6.937   7.067
   39   2HD   PRO   5          2HD       PRO   5  11.263   8.703   7.095
   40    H    ALA   6           H        ALA   6  11.491   6.887  12.482
   41    HA   ALA   6           HA       ALA   6  12.588   4.284  12.334
   42   1HB   ALA   6          1HB       ALA   6  10.563   5.529  14.218
   43   2HB   ALA   6          2HB       ALA   6  12.318   5.571  14.393
   44   3HB   ALA   6          3HB       ALA   6  11.452   4.042  14.549
   45    H    ASP   7           H        ASP   7  11.619   2.263  12.164
   46    HA   ASP   7           HA       ASP   7   9.465   1.856  10.387
   47   1HB   ASP   7          1HB       ASP   7  10.326   0.019  12.638
   48   2HB   ASP   7          2HB       ASP   7   9.702  -0.438  11.054
   49    H    GLY   8           H        GLY   8   7.460   0.511  11.194
   50   1HA   GLY   8          1HA       GLY   8   5.568   0.307  12.597
   51   2HA   GLY   8          2HA       GLY   8   6.412   1.260  13.815
   52    H    LEU   9           H        LEU   9   6.417   2.689  10.706
   53    HA   LEU   9           HA       LEU   9   4.986   5.014  11.554
   54   1HB   LEU   9          1HB       LEU   9   6.482   4.179   9.363
   55   2HB   LEU   9          2HB       LEU   9   4.871   4.433   8.686
   56    HG   LEU   9           HG       LEU   9   5.850   6.502  10.579
   57   1HD1  LEU   9          1HD1      LEU   9   7.005   6.042   7.816
   58   2HD1  LEU   9          2HD1      LEU   9   7.883   6.219   9.337
   59   3HD1  LEU   9          3HD1      LEU   9   7.064   7.609   8.623
   60   1HD2  LEU   9          1HD2      LEU   9   4.857   7.897   8.599
   61   2HD2  LEU   9          2HD2      LEU   9   3.751   6.984   9.633
   62   3HD2  LEU   9          3HD2      LEU   9   4.214   6.347   8.054
   63    H    LYS  10           H        LYS  10   2.829   5.140  11.958
   64    HA   LYS  10           HA       LYS  10   1.050   3.065  10.789
   65   1HB   LYS  10          1HB       LYS  10   1.165   4.756  13.187
   66   2HB   LYS  10          2HB       LYS  10  -0.448   4.615  12.488
   67   1HG   LYS  10          1HG       LYS  10   0.203   2.050  12.331
   68   2HG   LYS  10          2HG       LYS  10   1.305   2.482  13.641
   69   1HD   LYS  10          1HD       LYS  10  -1.533   3.417  13.813
   70   2HD   LYS  10          2HD       LYS  10  -1.187   1.723  14.161
   71   1HE   LYS  10          1HE       LYS  10   0.713   3.560  15.449
   72   2HE   LYS  10          2HE       LYS  10  -0.961   3.777  15.999
   73   1HZ   LYS  10          1HZ       LYS  10   0.516   1.902  17.026
   74   2HZ   LYS  10          2HZ       LYS  10   0.073   1.054  15.622
   75   3HZ   LYS  10          3HZ       LYS  10  -1.122   1.614  16.692
   76    H    MET  11           H        MET  11   0.195   3.614   8.862
   77    HA   MET  11           HA       MET  11  -0.366   6.432   8.164
   78   1HB   MET  11          1HB       MET  11  -1.191   5.159   6.031
   79   2HB   MET  11          2HB       MET  11   0.535   5.172   6.374
   80   1HG   MET  11          1HG       MET  11  -0.936   2.975   7.665
   81   2HG   MET  11          2HG       MET  11  -0.947   2.917   5.904
   82   1HE   MET  11          1HE       MET  11   0.792   2.362   4.453
   83   2HE   MET  11          2HE       MET  11   2.527   2.432   4.750
   84   3HE   MET  11          3HE       MET  11   1.581   3.918   4.737
   85    H    ASP  12           H        ASP  12  -2.186   7.136   9.266
   86    HA   ASP  12           HA       ASP  12  -4.568   5.317   9.319
   87   1HB   ASP  12          1HB       ASP  12  -5.232   7.078  11.113
   88   2HB   ASP  12          2HB       ASP  12  -3.950   5.937  11.495
   89    H    LYS  13           H        LYS  13  -3.556   7.349   7.182
   90    HA   LYS  13           HA       LYS  13  -5.211   9.586   6.939
   91   1HB   LYS  13          1HB       LYS  13  -4.059   7.567   5.027
   92   2HB   LYS  13          2HB       LYS  13  -4.999   8.931   4.425
   93   1HG   LYS  13          1HG       LYS  13  -2.570   9.147   6.230
   94   2HG   LYS  13          2HG       LYS  13  -2.566   9.439   4.489
   95   1HD   LYS  13          1HD       LYS  13  -4.400  11.172   4.921
   96   2HD   LYS  13          2HD       LYS  13  -3.996  11.019   6.631
   97   1HE   LYS  13          1HE       LYS  13  -1.668  11.401   4.836
   98   2HE   LYS  13          2HE       LYS  13  -2.761  12.792   4.971
   99   1HZ   LYS  13          1HZ       LYS  13  -1.323  12.985   6.798
  100   2HZ   LYS  13          2HZ       LYS  13  -1.389  11.325   7.147
  101   3HZ   LYS  13          3HZ       LYS  13  -2.738  12.312   7.446
  102    H    THR  14           H        THR  14  -6.016   6.192   6.532
  103    HA   THR  14           HA       THR  14  -8.832   6.963   5.818
  104    HB   THR  14           HB       THR  14  -8.841   4.565   4.910
  105    HG1  THR  14           1HG      THR  14  -7.124   3.578   5.672
  106   1HG2  THR  14          1HG2      THR  14  -8.680   6.474   3.421
  107   2HG2  THR  14          2HG2      THR  14  -7.553   5.232   2.875
  108   3HG2  THR  14          3HG2      THR  14  -6.958   6.637   3.760
  109    H    LYS  15           H        LYS  15 -10.337   4.960   6.494
  110    HA   LYS  15           HA       LYS  15 -10.398   4.864   9.365
  111   1HB   LYS  15          1HB       LYS  15 -11.855   3.763   7.029
  112   2HB   LYS  15          2HB       LYS  15 -12.010   2.829   8.517
  113   1HG   LYS  15          1HG       LYS  15 -13.486   4.330   9.304
  114   2HG   LYS  15          2HG       LYS  15 -12.257   5.591   9.194
  115   1HD   LYS  15          1HD       LYS  15 -12.859   6.065   6.896
  116   2HD   LYS  15          2HD       LYS  15 -13.963   4.690   6.858
  117   1HE   LYS  15          1HE       LYS  15 -15.435   5.740   8.478
  118   2HE   LYS  15          2HE       LYS  15 -14.276   7.060   8.734
  119   1HZ   LYS  15          1HZ       LYS  15 -16.087   7.546   7.083
  120   2HZ   LYS  15          2HZ       LYS  15 -15.388   6.374   6.071
  121   3HZ   LYS  15          3HZ       LYS  15 -14.508   7.763   6.502
  122    H    GLN  16           H        GLN  16  -8.878   2.880   6.936
  123    HA   GLN  16           HA       GLN  16  -8.269   0.755   8.944
  124   1HB   GLN  16          1HB       GLN  16  -8.595   0.972   6.008
  125   2HB   GLN  16          2HB       GLN  16  -7.303  -0.105   6.537
  126   1HG   GLN  16          1HG       GLN  16  -9.128  -0.999   8.212
  127   2HG   GLN  16          2HG       GLN  16 -10.254  -0.299   7.048
  128   1HE2  GLN  16          2HE2      GLN  16  -9.812  -0.997   4.667
  129   2HE2  GLN  16          1HE2      GLN  16  -9.317  -2.602   4.422
  130    HA   PRO  17           HA       PRO  17  -4.460   3.352   8.776
  131   1HB   PRO  17          1HB       PRO  17  -3.805   2.932  11.407
  132   2HB   PRO  17          2HB       PRO  17  -4.898   4.223  10.867
  133   1HG   PRO  17          1HG       PRO  17  -5.555   1.540  11.998
  134   2HG   PRO  17          2HG       PRO  17  -6.294   3.115  12.334
  135   1HD   PRO  17          1HD       PRO  17  -7.447   1.312  10.690
  136   2HD   PRO  17          2HD       PRO  17  -7.592   3.066  10.425
  137    H    VAL  18           H        VAL  18  -2.442   2.511   8.354
  138    HA   VAL  18           HA       VAL  18  -1.958  -0.363   9.045
  139    HB   VAL  18           HB       VAL  18  -1.483   1.310   6.573
  140   1HG1  VAL  18          1HG1      VAL  18   0.597   0.130   6.982
  141   2HG1  VAL  18          2HG1      VAL  18  -0.261  -0.685   5.675
  142   3HG1  VAL  18          3HG1      VAL  18  -0.270  -1.372   7.300
  143   1HG2  VAL  18          1HG2      VAL  18  -3.504   0.285   6.219
  144   2HG2  VAL  18          2HG2      VAL  18  -3.177  -0.993   7.390
  145   3HG2  VAL  18          3HG2      VAL  18  -2.484  -1.082   5.770
  146    H    VAL  19           H        VAL  19   0.312  -0.907   9.398
  147    HA   VAL  19           HA       VAL  19   1.940   1.416  10.346
  148    HB   VAL  19           HB       VAL  19   1.811  -1.539  10.993
  149   1HG1  VAL  19          1HG1      VAL  19   3.603  -0.503  12.781
  150   2HG1  VAL  19          2HG1      VAL  19   4.035   0.379  11.317
  151   3HG1  VAL  19          3HG1      VAL  19   4.059  -1.384  11.323
  152   1HG2  VAL  19          1HG2      VAL  19   0.231   0.234  12.014
  153   2HG2  VAL  19          2HG2      VAL  19   1.659   0.827  12.864
  154   3HG2  VAL  19          3HG2      VAL  19   1.093  -0.820  13.135
  155    H    PHE  20           H        PHE  20   3.509   2.007   8.839
  156    HA   PHE  20           HA       PHE  20   4.564  -0.071   6.987
  157   1HB   PHE  20          1HB       PHE  20   3.776   2.096   6.089
  158   2HB   PHE  20          2HB       PHE  20   4.946   2.942   7.101
  159    HD1  PHE  20           HD1      PHE  20   4.929  -0.001   4.771
  160    HD2  PHE  20           HD2      PHE  20   6.924   3.582   6.038
  161    HE1  PHE  20           HE1      PHE  20   6.690  -0.373   3.067
  162    HE2  PHE  20           HE2      PHE  20   8.677   3.209   4.332
  163    HZ   PHE  20           HZ       PHE  20   8.564   1.233   2.847
  164    H    ASN  21           H        ASN  21   6.431  -1.090   7.565
  165    HA   ASN  21           HA       ASN  21   8.199   0.143   9.601
  166   1HB   ASN  21          1HB       ASN  21   7.284  -2.469   8.769
  167   2HB   ASN  21          2HB       ASN  21   9.038  -2.416   8.773
  168   1HD2  ASN  21          2HD2      ASN  21   8.857  -3.921  10.704
  169   2HD2  ASN  21          1HD2      ASN  21   8.561  -3.247  12.233
  170    H    HIS  22           H        HIS  22   9.381   1.690   8.295
  171    HA   HIS  22           HA       HIS  22  10.421   1.368   5.717
  172   1HB   HIS  22          1HB       HIS  22  11.284   2.767   8.227
  173   2HB   HIS  22          2HB       HIS  22  12.381   2.768   6.848
  174    HD1  HIS  22           HD1      HIS  22   9.545   4.546   8.220
  175    HD2  HIS  22           HD2      HIS  22  10.955   3.797   4.364
  176    HE1  HIS  22           HE1      HIS  22   8.518   6.310   6.726
  177    H    SER  23           H        SER  23  11.403  -0.173   8.700
  178    HA   SER  23           HA       SER  23  14.039  -1.013   8.070
  179   1HB   SER  23          1HB       SER  23  13.528  -1.592  10.218
  180   2HB   SER  23          2HB       SER  23  11.811  -1.751   9.855
  181    HG   SER  23           HG       SER  23  13.815  -3.618   9.100
  182    H    THR  24           H        THR  24  10.887  -2.429   7.230
  183    HA   THR  24           HA       THR  24  12.079  -4.724   5.849
  184    HB   THR  24           HB       THR  24   9.266  -3.920   5.373
  185    HG1  THR  24           1HG      THR  24   8.994  -4.773   7.685
  186   1HG2  THR  24          1HG2      THR  24   8.946  -6.174   5.357
  187   2HG2  THR  24          2HG2      THR  24   9.983  -6.429   6.761
  188   3HG2  THR  24          3HG2      THR  24  10.698  -6.226   5.162
  189    H    HIS  25           H        HIS  25  11.834  -1.494   5.068
  190    HA   HIS  25           HA       HIS  25  11.604  -2.095   2.151
  191   1HB   HIS  25          1HB       HIS  25  10.807   0.332   3.781
  192   2HB   HIS  25          2HB       HIS  25  10.602   0.161   2.040
  193    HD1  HIS  25           HD1      HIS  25   9.311  -1.144   5.310
  194    HD2  HIS  25           HD2      HIS  25   8.544  -1.644   1.246
  195    HE1  HIS  25           HE1      HIS  25   7.170  -2.482   5.148
  196    H    LYS  26           H        LYS  26  13.659  -0.977   4.633
  197    HA   LYS  26           HA       LYS  26  15.160   1.096   3.473
  198   1HB   LYS  26          1HB       LYS  26  16.074  -1.334   5.053
  199   2HB   LYS  26          2HB       LYS  26  17.004   0.153   4.860
  200   1HG   LYS  26          1HG       LYS  26  14.655   1.189   5.719
  201   2HG   LYS  26          2HG       LYS  26  14.612  -0.375   6.533
  202   1HD   LYS  26          1HD       LYS  26  16.124   0.327   8.041
  203   2HD   LYS  26          2HD       LYS  26  17.258   0.736   6.753
  204   1HE   LYS  26          1HE       LYS  26  16.758   2.958   6.869
  205   2HE   LYS  26          2HE       LYS  26  15.020   2.645   7.042
  206   1HZ   LYS  26          1HZ       LYS  26  15.902   3.511   9.107
  207   2HZ   LYS  26          2HZ       LYS  26  17.085   2.292   9.152
  208   3HZ   LYS  26          3HZ       LYS  26  15.442   1.892   9.319
  209    H    ALA  27           H        ALA  27  14.996  -2.301   2.640
  210    HA   ALA  27           HA       ALA  27  17.348  -2.197   0.864
  211   1HB   ALA  27          1HB       ALA  27  16.828  -4.211   2.146
  212   2HB   ALA  27          2HB       ALA  27  16.616  -4.562   0.430
  213   3HB   ALA  27          3HB       ALA  27  15.207  -4.270   1.452
  214    H    VAL  28           H        VAL  28  14.099  -1.277   0.688
  215    HA   VAL  28           HA       VAL  28  13.631  -1.977  -2.124
  216    HB   VAL  28           HB       VAL  28  12.236  -0.322  -0.014
  217   1HG1  VAL  28          1HG1      VAL  28  10.341  -0.158  -1.614
  218   2HG1  VAL  28          2HG1      VAL  28  11.378  -0.835  -2.871
  219   3HG1  VAL  28          3HG1      VAL  28  11.762   0.731  -2.156
  220   1HG2  VAL  28          1HG2      VAL  28  10.499  -2.155  -0.391
  221   2HG2  VAL  28          2HG2      VAL  28  12.005  -2.672   0.368
  222   3HG2  VAL  28          3HG2      VAL  28  11.727  -2.988  -1.344
  223    H    LYS  29           H        LYS  29  12.897   0.057  -3.525
  224    HA   LYS  29           HA       LYS  29  15.234   1.866  -3.532
  225   1HB   LYS  29          1HB       LYS  29  13.371   0.743  -5.419
  226   2HB   LYS  29          2HB       LYS  29  13.404   2.500  -5.570
  227   1HG   LYS  29          1HG       LYS  29  15.229   2.089  -6.874
  228   2HG   LYS  29          2HG       LYS  29  16.049   2.010  -5.313
  229   1HD   LYS  29          1HD       LYS  29  16.488  -0.187  -5.575
  230   2HD   LYS  29          2HD       LYS  29  14.802  -0.532  -5.962
  231   1HE   LYS  29          1HE       LYS  29  16.300  -1.113  -7.863
  232   2HE   LYS  29          2HE       LYS  29  15.201   0.210  -8.304
  233   1HZ   LYS  29          1HZ       LYS  29  17.700   0.525  -8.738
  234   2HZ   LYS  29          2HZ       LYS  29  17.819   0.770  -7.061
  235   3HZ   LYS  29          3HZ       LYS  29  16.848   1.795  -8.007
  236    H    CYS  30           H        CYS  30  14.967   3.465  -2.072
  237    HA   CYS  30           HA       CYS  30  12.672   4.650  -1.027
  238   1HB   CYS  30          1HB       CYS  30  15.410   5.691  -1.751
  239   2HB   CYS  30          2HB       CYS  30  14.218   6.769  -1.029
  240    H    GLY  31           H        GLY  31  13.994   4.936  -4.239
  241   1HA   GLY  31          1HA       GLY  31  12.297   7.241  -4.935
  242   2HA   GLY  31          2HA       GLY  31  13.415   6.413  -6.021
  243    H    ASP  32           H        ASP  32  12.004   3.823  -4.851
  244    HA   ASP  32           HA       ASP  32  10.109   3.609  -7.075
  245   1HB   ASP  32          1HB       ASP  32  11.683   1.923  -5.486
  246   2HB   ASP  32          2HB       ASP  32  10.030   1.514  -5.048
  247    H    CYS  33           H        CYS  33  10.015   4.084  -3.587
  248    HA   CYS  33           HA       CYS  33   7.045   3.983  -3.523
  249   1HB   CYS  33          1HB       CYS  33   9.289   4.323  -1.513
  250   2HB   CYS  33          2HB       CYS  33   7.599   4.533  -1.057
  251    H    HIS  34           H        HIS  34   9.656   6.264  -2.607
  252    HA   HIS  34           HA       HIS  34   7.799   8.566  -2.813
  253   1HB   HIS  34          1HB       HIS  34  10.709   8.198  -2.018
  254   2HB   HIS  34          2HB       HIS  34   9.900   9.758  -2.031
  255    HD1  HIS  34           HD1      HIS  34   7.484   9.662  -0.551
  256    HD2  HIS  34           HD2      HIS  34  10.527   6.993   0.445
  257    HE1  HIS  34           HE1      HIS  34   7.041   8.920   1.829
  258    H    HIS  35           H        HIS  35   8.320   7.157  -5.271
  259    HA   HIS  35           HA       HIS  35  10.308   7.733  -6.990
  260   1HB   HIS  35          1HB       HIS  35   8.464   8.214  -8.694
  261   2HB   HIS  35          2HB       HIS  35   8.292   6.733  -7.771
  262    HD1  HIS  35           HD1      HIS  35   7.031  10.236  -7.913
  263    HD2  HIS  35           HD2      HIS  35   5.998   6.625  -6.141
  264    HE1  HIS  35           HE1      HIS  35   4.756  10.592  -6.871
  265    HA   PRO  36           HA       PRO  36  11.227  11.980  -7.198
  266   1HB   PRO  36          1HB       PRO  36  11.781  12.286  -9.870
  267   2HB   PRO  36          2HB       PRO  36  12.875  11.475  -8.731
  268   1HG   PRO  36          1HG       PRO  36  10.908  10.281 -10.634
  269   2HG   PRO  36          2HG       PRO  36  12.569   9.781 -10.274
  270   1HD   PRO  36          1HD       PRO  36  10.453   8.506  -9.217
  271   2HD   PRO  36          2HD       PRO  36  11.967   8.720  -8.307
  272    H    VAL  37           H        VAL  37   9.309  13.078  -6.751
  273    HA   VAL  37           HA       VAL  37   7.264  13.409  -8.869
  274    HB   VAL  37           HB       VAL  37   7.548  14.090  -5.940
  275   1HG1  VAL  37          1HG1      VAL  37   6.420  15.997  -6.970
  276   2HG1  VAL  37          2HG1      VAL  37   5.242  15.034  -6.079
  277   3HG1  VAL  37          3HG1      VAL  37   5.329  14.916  -7.836
  278   1HG2  VAL  37          1HG2      VAL  37   5.988  12.171  -7.630
  279   2HG2  VAL  37          2HG2      VAL  37   5.260  12.744  -6.129
  280   3HG2  VAL  37          3HG2      VAL  37   6.807  11.896  -6.093
  281    H    ASN  38           H        ASN  38   6.757  15.504  -9.727
  282    HA   ASN  38           HA       ASN  38   7.252  17.696 -10.470
  283   1HB   ASN  38          1HB       ASN  38   7.061  17.817  -7.889
  284   2HB   ASN  38          2HB       ASN  38   8.800  17.877  -7.894
  285   1HD2  ASN  38          2HD2      ASN  38   6.445  19.983  -7.482
  286   2HD2  ASN  38          1HD2      ASN  38   7.020  21.322  -8.353
  287    H    GLY  39           H        GLY  39  10.153  17.427  -8.523
  288   1HA   GLY  39          1HA       GLY  39  11.794  16.819 -10.919
  289   2HA   GLY  39          2HA       GLY  39  12.157  18.279  -9.992
  290    H    LYS  40           H        LYS  40  10.938  15.967  -7.891
  291    HA   LYS  40           HA       LYS  40  13.462  14.505  -7.447
  292   1HB   LYS  40          1HB       LYS  40  13.660  15.554  -5.130
  293   2HB   LYS  40          2HB       LYS  40  14.045  16.625  -6.479
  294   1HG   LYS  40          1HG       LYS  40  12.196  17.930  -6.146
  295   2HG   LYS  40          2HG       LYS  40  11.197  16.565  -5.645
  296   1HD   LYS  40          1HD       LYS  40  12.012  16.618  -3.438
  297   2HD   LYS  40          2HD       LYS  40  13.438  17.554  -3.890
  298   1HE   LYS  40          1HE       LYS  40  11.472  19.277  -4.662
  299   2HE   LYS  40          2HE       LYS  40  10.695  18.494  -3.271
  300   1HZ   LYS  40          1HZ       LYS  40  11.956  19.958  -2.121
  301   2HZ   LYS  40          2HZ       LYS  40  13.098  20.137  -3.368
  302   3HZ   LYS  40          3HZ       LYS  40  13.161  18.784  -2.342
  303    H    GLU  41           H        GLU  41  13.231  12.977  -5.585
  304    HA   GLU  41           HA       GLU  41  10.560  11.820  -5.476
  305   1HB   GLU  41          1HB       GLU  41  13.245  11.277  -4.206
  306   2HB   GLU  41          2HB       GLU  41  11.820  10.344  -3.750
  307   1HG   GLU  41          1HG       GLU  41  11.632   9.354  -5.846
  308   2HG   GLU  41          2HG       GLU  41  12.451  10.684  -6.663
  309    H    ASP  42           H        ASP  42   9.003  12.797  -4.198
  310    HA   ASP  42           HA       ASP  42   9.624  14.487  -1.943
  311   1HB   ASP  42          1HB       ASP  42   7.183  13.120  -3.051
  312   2HB   ASP  42          2HB       ASP  42   7.105  13.985  -1.515
  313    H    TYR  43           H        TYR  43  10.793  13.465  -0.334
  314    HA   TYR  43           HA       TYR  43  10.202  10.724   0.510
  315   1HB   TYR  43          1HB       TYR  43  12.014  12.913   1.579
  316   2HB   TYR  43          2HB       TYR  43  12.032  11.241   2.138
  317    HD1  TYR  43           HD1      TYR  43  13.269  13.550  -0.304
  318    HD2  TYR  43           HD2      TYR  43  12.406   9.392   0.357
  319    HE1  TYR  43           HE1      TYR  43  14.763  12.939  -2.187
  320    HE2  TYR  43           HE2      TYR  43  13.901   8.783  -1.525
  321    HH   TYR  43           HH       TYR  43  16.135  10.829  -2.832
  322    H    GLN  44           H        GLN  44   7.826  11.922   0.871
  323    HA   GLN  44           HA       GLN  44   7.687  12.390   3.831
  324   1HB   GLN  44          1HB       GLN  44   5.836  14.052   3.183
  325   2HB   GLN  44          2HB       GLN  44   7.487  14.541   2.805
  326   1HG   GLN  44          1HG       GLN  44   7.217  13.792   0.492
  327   2HG   GLN  44          2HG       GLN  44   5.594  13.202   0.851
  328   1HE2  GLN  44          2HE2      GLN  44   7.259  16.289   1.716
  329   2HE2  GLN  44          1HE2      GLN  44   6.057  17.290   1.055
  330    H    LYS  45           H        LYS  45   5.252  12.216   4.508
  331    HA   LYS  45           HA       LYS  45   4.299   9.643   4.273
  332   1HB   LYS  45          1HB       LYS  45   2.018  10.778   4.667
  333   2HB   LYS  45          2HB       LYS  45   3.299  11.122   5.827
  334   1HG   LYS  45          1HG       LYS  45   3.815  13.223   4.661
  335   2HG   LYS  45          2HG       LYS  45   2.578  12.869   3.453
  336   1HD   LYS  45          1HD       LYS  45   0.831  13.275   4.922
  337   2HD   LYS  45          2HD       LYS  45   1.792  12.864   6.343
  338   1HE   LYS  45          1HE       LYS  45   3.191  14.995   5.682
  339   2HE   LYS  45          2HE       LYS  45   1.717  15.445   4.801
  340   1HZ   LYS  45          1HZ       LYS  45   2.049  15.875   7.415
  341   2HZ   LYS  45          2HZ       LYS  45   1.313  14.345   7.455
  342   3HZ   LYS  45          3HZ       LYS  45   0.533  15.645   6.690
  343    H    CYS  46           H        CYS  46   3.239   8.451   2.746
  344    HA   CYS  46           HA       CYS  46   3.181   9.101   0.011
  345   1HB   CYS  46          1HB       CYS  46   1.441   7.279   1.695
  346   2HB   CYS  46          2HB       CYS  46   1.548   7.196  -0.059
  347    H    ALA  47           H        ALA  47   0.698   9.541   2.495
  348    HA   ALA  47           HA       ALA  47  -1.113  10.853   0.523
  349   1HB   ALA  47          1HB       ALA  47  -2.197  10.703   3.143
  350   2HB   ALA  47          2HB       ALA  47  -1.341   9.191   2.848
  351   3HB   ALA  47          3HB       ALA  47  -2.616   9.712   1.748
  352    H    THR  48           H        THR  48   1.122  12.421   1.117
  353    HA   THR  48           HA       THR  48   1.100  14.139   3.294
  354    HB   THR  48           HB       THR  48   1.505  15.216   0.524
  355    HG1  THR  48           1HG      THR  48   3.368  13.504   1.755
  356   1HG2  THR  48          1HG2      THR  48   3.692  15.389   2.422
  357   2HG2  THR  48          2HG2      THR  48   2.197  16.009   3.119
  358   3HG2  THR  48          3HG2      THR  48   2.814  16.686   1.612
  359    H    ALA  49           H        ALA  49   0.552  16.705   2.658
  360    HA   ALA  49           HA       ALA  49  -2.337  16.871   2.880
  361   1HB   ALA  49          1HB       ALA  49  -0.396  18.344   3.826
  362   2HB   ALA  49          2HB       ALA  49  -1.888  19.140   3.326
  363   3HB   ALA  49          3HB       ALA  49  -0.479  19.163   2.267
  364    H    GLY  50           H        GLY  50  -0.280  16.613   0.195
  365   1HA   GLY  50          1HA       GLY  50  -2.506  17.383  -1.612
  366   2HA   GLY  50          2HA       GLY  50  -0.944  18.172  -1.868
  367    H    CYS  51           H        CYS  51  -0.863  15.033  -0.574
  368    HA   CYS  51           HA       CYS  51   0.267  13.955  -3.093
  369   1HB   CYS  51          1HB       CYS  51   0.618  13.850  -0.177
  370   2HB   CYS  51          2HB       CYS  51   0.818  12.308  -0.943
  371    H    HIS  52           H        HIS  52  -0.312  11.248  -1.494
  372    HA   HIS  52           HA       HIS  52  -2.768  10.628  -2.949
  373   1HB   HIS  52          1HB       HIS  52  -0.996   9.146  -0.993
  374   2HB   HIS  52          2HB       HIS  52  -2.366   8.403  -1.793
  375    HD1  HIS  52           HD1      HIS  52  -2.262   8.754  -4.516
  376    HD2  HIS  52           HD2      HIS  52   1.337   8.860  -2.450
  377    HE1  HIS  52           HE1      HIS  52  -0.446   8.348  -6.241
  378    H    ASP  53           H        ASP  53  -3.566  12.649  -1.371
  379    HA   ASP  53           HA       ASP  53  -4.627  11.521   1.171
  380   1HB   ASP  53          1HB       ASP  53  -3.399  13.648   1.201
  381   2HB   ASP  53          2HB       ASP  53  -4.525  14.324   0.025
  382    H    ASN  54           H        ASN  54  -5.772  10.986  -1.672
  383    HA   ASN  54           HA       ASN  54  -8.359  12.368  -1.634
  384   1HB   ASN  54          1HB       ASN  54  -6.793  11.115  -3.512
  385   2HB   ASN  54          2HB       ASN  54  -8.030   9.895  -3.215
  386   1HD2  ASN  54          2HD2      ASN  54  -9.693  10.123  -4.699
  387   2HD2  ASN  54          1HD2      ASN  54 -10.312  11.602  -5.258
  388    H    MET  55           H        MET  55  -9.693  11.805   0.071
  389    HA   MET  55           HA       MET  55  -9.678   9.127   1.233
  390   1HB   MET  55          1HB       MET  55 -11.409  11.595   1.578
  391   2HB   MET  55          2HB       MET  55 -11.519  10.163   2.602
  392   1HG   MET  55          1HG       MET  55  -8.801  11.298   2.230
  393   2HG   MET  55          2HG       MET  55  -9.921  12.262   3.190
  394   1HE   MET  55          1HE       MET  55  -9.301   8.209   2.859
  395   2HE   MET  55          2HE       MET  55  -7.992   8.266   4.037
  396   3HE   MET  55          3HE       MET  55  -7.923   9.290   2.605
  397    H    ASP  56           H        ASP  56 -10.746   9.918  -1.683
  398    HA   ASP  56           HA       ASP  56 -13.522   8.998  -1.595
  399   1HB   ASP  56          1HB       ASP  56 -12.110  10.570  -3.245
  400   2HB   ASP  56          2HB       ASP  56 -11.872   9.039  -4.088
  401    H    LYS  57           H        LYS  57 -10.404   7.520  -1.768
  402    HA   LYS  57           HA       LYS  57  -9.738   5.280  -2.112
  403   1HB   LYS  57          1HB       LYS  57 -12.617   4.860  -1.263
  404   2HB   LYS  57          2HB       LYS  57 -11.303   3.697  -1.103
  405   1HG   LYS  57          1HG       LYS  57 -10.648   4.633   0.829
  406   2HG   LYS  57          2HG       LYS  57 -10.519   6.214   0.062
  407   1HD   LYS  57          1HD       LYS  57 -12.139   6.362   1.867
  408   2HD   LYS  57          2HD       LYS  57 -12.995   6.487   0.330
  409   1HE   LYS  57          1HE       LYS  57 -13.762   4.216   0.463
  410   2HE   LYS  57          2HE       LYS  57 -12.672   3.864   1.820
  411   1HZ   LYS  57          1HZ       LYS  57 -15.042   4.436   2.433
  412   2HZ   LYS  57          2HZ       LYS  57 -14.699   6.021   1.927
  413   3HZ   LYS  57          3HZ       LYS  57 -13.835   5.332   3.217
  414    H    LYS  58           H        LYS  58 -11.351   6.820  -4.306
  415    HA   LYS  58           HA       LYS  58 -11.801   4.411  -6.022
  416   1HB   LYS  58          1HB       LYS  58 -13.564   6.874  -5.824
  417   2HB   LYS  58          2HB       LYS  58 -13.860   5.462  -6.839
  418   1HG   LYS  58          1HG       LYS  58 -13.436   4.479  -4.220
  419   2HG   LYS  58          2HG       LYS  58 -14.530   5.854  -4.064
  420   1HD   LYS  58          1HD       LYS  58 -15.119   4.030  -6.319
  421   2HD   LYS  58          2HD       LYS  58 -15.355   3.341  -4.712
  422   1HE   LYS  58          1HE       LYS  58 -16.480   6.050  -5.475
  423   2HE   LYS  58          2HE       LYS  58 -17.392   4.543  -5.692
  424   1HZ   LYS  58          1HZ       LYS  58 -17.453   4.137  -3.458
  425   2HZ   LYS  58          2HZ       LYS  58 -17.481   5.835  -3.427
  426   3HZ   LYS  58          3HZ       LYS  58 -16.029   5.001  -3.136
  427    H    ASP  59           H        ASP  59 -10.073   7.190  -5.584
  428    HA   ASP  59           HA       ASP  59 -10.166   8.327  -8.268
  429   1HB   ASP  59          1HB       ASP  59  -9.557   9.788  -6.518
  430   2HB   ASP  59          2HB       ASP  59  -8.469   8.606  -5.791
  431    H    LYS  60           H        LYS  60  -9.501   6.924  -9.896
  432    HA   LYS  60           HA       LYS  60  -7.328   5.010  -9.529
  433   1HB   LYS  60          1HB       LYS  60  -9.293   5.853 -11.583
  434   2HB   LYS  60          2HB       LYS  60  -7.799   5.158 -12.211
  435   1HG   LYS  60          1HG       LYS  60  -9.680   3.500 -11.729
  436   2HG   LYS  60          2HG       LYS  60  -8.120   3.127 -10.998
  437   1HD   LYS  60          1HD       LYS  60  -8.905   4.271  -8.900
  438   2HD   LYS  60          2HD       LYS  60 -10.500   4.419  -9.639
  439   1HE   LYS  60          1HE       LYS  60 -10.463   1.893  -9.972
  440   2HE   LYS  60          2HE       LYS  60  -9.026   1.866  -8.930
  441   1HZ   LYS  60          1HZ       LYS  60 -10.851   1.641  -7.481
  442   2HZ   LYS  60          2HZ       LYS  60 -11.741   2.855  -8.268
  443   3HZ   LYS  60          3HZ       LYS  60 -10.376   3.264  -7.343
  444    H    SER  61           H        SER  61  -7.230   8.283  -9.765
  445    HA   SER  61           HA       SER  61  -5.149   8.615 -11.794
  446   1HB   SER  61          1HB       SER  61  -6.586  10.280  -9.755
  447   2HB   SER  61          2HB       SER  61  -5.114  10.917 -10.480
  448    HG   SER  61           HG       SER  61  -6.272  10.132 -12.527
  449    H    ALA  62           H        ALA  62  -3.352  10.312 -10.491
  450    HA   ALA  62           HA       ALA  62  -1.845   8.363  -8.812
  451   1HB   ALA  62          1HB       ALA  62  -1.207   9.929 -10.984
  452   2HB   ALA  62          2HB       ALA  62  -0.029   9.248  -9.863
  453   3HB   ALA  62          3HB       ALA  62  -0.600  10.902  -9.644
  454    H    LYS  63           H        LYS  63  -4.116  10.070  -7.780
  455    HA   LYS  63           HA       LYS  63  -2.568  11.521  -5.654
  456   1HB   LYS  63          1HB       LYS  63  -3.885  12.765  -7.632
  457   2HB   LYS  63          2HB       LYS  63  -5.252  12.488  -6.551
  458   1HG   LYS  63          1HG       LYS  63  -4.586  14.369  -5.484
  459   2HG   LYS  63          2HG       LYS  63  -3.278  13.383  -4.828
  460   1HD   LYS  63          1HD       LYS  63  -1.824  14.739  -5.888
  461   2HD   LYS  63          2HD       LYS  63  -2.437  14.101  -7.414
  462   1HE   LYS  63          1HE       LYS  63  -4.056  15.870  -7.606
  463   2HE   LYS  63          2HE       LYS  63  -3.750  16.411  -5.944
  464   1HZ   LYS  63          1HZ       LYS  63  -1.427  16.810  -6.569
  465   2HZ   LYS  63          2HZ       LYS  63  -2.493  17.766  -7.482
  466   3HZ   LYS  63          3HZ       LYS  63  -1.782  16.387  -8.173
  467    H    GLY  64           H        GLY  64  -4.601   8.984  -6.263
  468   1HA   GLY  64          1HA       GLY  64  -6.425   9.368  -4.005
  469   2HA   GLY  64          2HA       GLY  64  -6.344   7.945  -5.036
  470    H    TYR  65           H        TYR  65  -6.415   7.997  -2.142
  471    HA   TYR  65           HA       TYR  65  -3.682   7.246  -1.291
  472   1HB   TYR  65          1HB       TYR  65  -5.330   8.664   0.033
  473   2HB   TYR  65          2HB       TYR  65  -6.283   7.196   0.256
  474    HD1  TYR  65           HD1      TYR  65  -5.957   6.166   2.305
  475    HD2  TYR  65           HD2      TYR  65  -2.632   8.078   0.379
  476    HE1  TYR  65           HE1      TYR  65  -4.478   5.472   4.172
  477    HE2  TYR  65           HE2      TYR  65  -1.153   7.387   2.244
  478    HH   TYR  65           HH       TYR  65  -1.277   5.351   4.023
  479    H    TYR  66           H        TYR  66  -6.723   5.716  -2.172
  480    HA   TYR  66           HA       TYR  66  -5.791   3.104  -1.112
  481   1HB   TYR  66          1HB       TYR  66  -8.027   3.482  -0.576
  482   2HB   TYR  66          2HB       TYR  66  -8.337   4.354  -2.076
  483    HD1  TYR  66           HD1      TYR  66  -8.534   1.189  -0.399
  484    HD2  TYR  66           HD2      TYR  66  -8.286   3.039  -4.262
  485    HE1  TYR  66           HE1      TYR  66  -9.379  -0.894  -1.445
  486    HE2  TYR  66           HE2      TYR  66  -9.139   0.956  -5.317
  487    HH   TYR  66           HH       TYR  66 -10.566  -1.041  -4.548
  488    H    HIS  67           H        HIS  67  -5.525   4.904  -3.941
  489    HA   HIS  67           HA       HIS  67  -5.778   2.651  -5.835
  490   1HB   HIS  67          1HB       HIS  67  -6.473   4.773  -6.640
  491   2HB   HIS  67          2HB       HIS  67  -5.055   5.580  -5.969
  492    HD1  HIS  67           HD1      HIS  67  -5.916   2.998  -8.626
  493    HD2  HIS  67           HD2      HIS  67  -2.929   5.767  -7.746
  494    HE1  HIS  67           HE1      HIS  67  -4.291   2.935 -10.563
  495    H    ALA  68           H        ALA  68  -3.119   4.982  -5.330
  496    HA   ALA  68           HA       ALA  68  -1.042   3.496  -6.448
  497   1HB   ALA  68          1HB       ALA  68   0.379   4.870  -4.869
  498   2HB   ALA  68          2HB       ALA  68  -1.108   5.377  -4.070
  499   3HB   ALA  68          3HB       ALA  68  -0.824   5.805  -5.758
  500    H    MET  69           H        MET  69  -2.716   2.826  -3.467
  501    HA   MET  69           HA       MET  69  -0.514   1.177  -2.398
  502   1HB   MET  69          1HB       MET  69  -3.321   1.798  -1.459
  503   2HB   MET  69          2HB       MET  69  -2.113   0.930  -0.515
  504   1HG   MET  69          1HG       MET  69  -1.053   3.413  -1.601
  505   2HG   MET  69          2HG       MET  69  -2.459   3.694  -0.578
  506   1HE   MET  69          1HE       MET  69   1.625   3.442   0.354
  507   2HE   MET  69          2HE       MET  69   0.599   4.770   0.890
  508   3HE   MET  69          3HE       MET  69   0.534   4.238  -0.789
  509    H    HIS  70           H        HIS  70  -3.852   0.645  -3.599
  510    HA   HIS  70           HA       HIS  70  -3.374  -2.278  -3.442
  511   1HB   HIS  70          1HB       HIS  70  -5.830  -0.706  -4.265
  512   2HB   HIS  70          2HB       HIS  70  -5.776  -2.403  -3.785
  513    HD1  HIS  70           HD1      HIS  70  -6.007   1.014  -2.435
  514    HD2  HIS  70           HD2      HIS  70  -5.128  -2.777  -0.952
  515    HE1  HIS  70           HE1      HIS  70  -6.194   1.173   0.083
  516    H    ASP  71           H        ASP  71  -3.404   0.295  -5.764
  517    HA   ASP  71           HA       ASP  71  -3.981  -1.405  -8.078
  518   1HB   ASP  71          1HB       ASP  71  -3.021   1.432  -7.643
  519   2HB   ASP  71          2HB       ASP  71  -3.343   0.760  -9.235
  520    H    LYS  72           H        LYS  72  -2.468  -2.710  -9.003
  521    HA   LYS  72           HA       LYS  72   0.365  -2.504  -8.286
  522   1HB   LYS  72          1HB       LYS  72  -1.014  -4.255 -10.338
  523   2HB   LYS  72          2HB       LYS  72   0.510  -4.581  -9.513
  524   1HG   LYS  72          1HG       LYS  72  -0.540  -5.425  -7.701
  525   2HG   LYS  72          2HG       LYS  72  -1.673  -4.075  -7.637
  526   1HD   LYS  72          1HD       LYS  72  -2.148  -5.851  -9.919
  527   2HD   LYS  72          2HD       LYS  72  -2.313  -6.670  -8.365
  528   1HE   LYS  72          1HE       LYS  72  -4.396  -5.763  -8.262
  529   2HE   LYS  72          2HE       LYS  72  -3.596  -4.203  -7.987
  530   1HZ   LYS  72          1HZ       LYS  72  -3.759  -5.260 -10.722
  531   2HZ   LYS  72          2HZ       LYS  72  -3.695  -3.647 -10.192
  532   3HZ   LYS  72          3HZ       LYS  72  -5.138  -4.534 -10.053
  533    H    GLY  73           H        GLY  73  -1.465  -2.360 -11.352
  534   1HA   GLY  73          1HA       GLY  73   0.784  -1.508 -12.928
  535   2HA   GLY  73          2HA       GLY  73  -0.908  -1.374 -13.413
  536    H    THR  74           H        THR  74   1.214   0.118 -10.943
  537    HA   THR  74           HA       THR  74  -0.092   2.744 -11.548
  538    HB   THR  74           HB       THR  74   1.054   3.218  -9.246
  539    HG1  THR  74           1HG      THR  74   0.903   0.408  -9.098
  540   1HG2  THR  74          1HG2      THR  74  -1.316   3.073  -9.316
  541   2HG2  THR  74          2HG2      THR  74  -0.827   1.911  -8.081
  542   3HG2  THR  74          3HG2      THR  74  -1.276   1.350  -9.693
  543    H    LYS  75           H        LYS  75   1.372   4.651 -11.483
  544    HA   LYS  75           HA       LYS  75   3.497   4.731 -13.213
  545   1HB   LYS  75          1HB       LYS  75   2.313   6.512 -11.651
  546   2HB   LYS  75          2HB       LYS  75   3.688   6.202 -10.593
  547   1HG   LYS  75          1HG       LYS  75   4.112   8.104 -12.129
  548   2HG   LYS  75          2HG       LYS  75   5.242   6.779 -12.396
  549   1HD   LYS  75          1HD       LYS  75   2.965   6.278 -14.026
  550   2HD   LYS  75          2HD       LYS  75   3.416   7.966 -14.265
  551   1HE   LYS  75          1HE       LYS  75   5.479   5.748 -14.334
  552   2HE   LYS  75          2HE       LYS  75   4.607   6.275 -15.787
  553   1HZ   LYS  75          1HZ       LYS  75   6.800   7.474 -15.066
  554   2HZ   LYS  75          2HZ       LYS  75   5.760   8.306 -14.012
  555   3HZ   LYS  75          3HZ       LYS  75   5.498   8.365 -15.689
  556    H    PHE  76           H        PHE  76   3.671   3.825  -9.774
  557    HA   PHE  76           HA       PHE  76   6.401   2.676 -10.283
  558   1HB   PHE  76          1HB       PHE  76   5.366   4.065  -7.794
  559   2HB   PHE  76          2HB       PHE  76   6.998   3.458  -8.047
  560    HD1  PHE  76           HD1      PHE  76   8.433   4.502  -9.854
  561    HD2  PHE  76           HD2      PHE  76   4.642   6.136  -8.670
  562    HE1  PHE  76           HE1      PHE  76   9.009   6.646 -10.960
  563    HE2  PHE  76           HE2      PHE  76   5.217   8.278  -9.774
  564    HZ   PHE  76           HZ       PHE  76   7.395   8.527 -10.916
  565    H    LYS  77           H        LYS  77   6.920   1.127  -8.271
  566    HA   LYS  77           HA       LYS  77   4.826  -0.882  -8.243
  567   1HB   LYS  77          1HB       LYS  77   6.385  -2.031  -6.722
  568   2HB   LYS  77          2HB       LYS  77   7.218  -1.431  -8.154
  569   1HG   LYS  77          1HG       LYS  77   7.800   0.638  -6.782
  570   2HG   LYS  77          2HG       LYS  77   7.228  -0.251  -5.370
  571   1HD   LYS  77          1HD       LYS  77   9.708  -0.458  -5.744
  572   2HD   LYS  77          2HD       LYS  77   8.863  -2.003  -5.737
  573   1HE   LYS  77          1HE       LYS  77   9.126  -0.644  -8.380
  574   2HE   LYS  77          2HE       LYS  77  10.590  -1.377  -7.692
  575   1HZ   LYS  77          1HZ       LYS  77   8.186  -2.950  -7.383
  576   2HZ   LYS  77          2HZ       LYS  77   9.745  -3.432  -7.850
  577   3HZ   LYS  77          3HZ       LYS  77   8.684  -2.759  -8.993
  578    H    SER  78           H        SER  78   3.069  -0.585  -7.105
  579    HA   SER  78           HA       SER  78   2.820   1.266  -4.878
  580   1HB   SER  78          1HB       SER  78   0.483   0.022  -4.936
  581   2HB   SER  78          2HB       SER  78   0.940   1.121  -6.234
  582    HG   SER  78           HG       SER  78   0.290  -1.379  -6.474
  583    H    CYS  79           H        CYS  79   1.593   0.420  -2.856
  584    HA   CYS  79           HA       CYS  79   3.213  -1.347  -1.349
  585   1HB   CYS  79          1HB       CYS  79   0.270  -0.667  -1.054
  586   2HB   CYS  79          2HB       CYS  79   1.333  -1.223   0.237
  587    H    VAL  80           H        VAL  80  -0.128  -2.020  -2.431
  588    HA   VAL  80           HA       VAL  80   0.108  -4.883  -2.113
  589    HB   VAL  80           HB       VAL  80  -1.772  -2.986  -3.524
  590   1HG1  VAL  80          1HG1      VAL  80  -3.047  -5.476  -3.260
  591   2HG1  VAL  80          2HG1      VAL  80  -1.469  -5.828  -3.964
  592   3HG1  VAL  80          3HG1      VAL  80  -2.555  -4.689  -4.761
  593   1HG2  VAL  80          1HG2      VAL  80  -2.853  -2.969  -1.532
  594   2HG2  VAL  80          2HG2      VAL  80  -1.473  -3.831  -0.857
  595   3HG2  VAL  80          3HG2      VAL  80  -2.862  -4.731  -1.463
  596    H    GLY  81           H        GLY  81   0.740  -2.627  -4.743
  597   1HA   GLY  81          1HA       GLY  81   0.884  -4.586  -6.859
  598   2HA   GLY  81          2HA       GLY  81   1.583  -2.966  -6.914
  599    H    CYS  82           H        CYS  82   3.280  -3.146  -4.662
  600    HA   CYS  82           HA       CYS  82   5.509  -4.682  -5.800
  601   1HB   CYS  82          1HB       CYS  82   5.406  -2.369  -4.519
  602   2HB   CYS  82          2HB       CYS  82   5.468  -3.385  -3.083
  603    H    HIS  83           H        HIS  83   3.050  -5.069  -3.417
  604    HA   HIS  83           HA       HIS  83   4.356  -7.121  -1.828
  605   1HB   HIS  83          1HB       HIS  83   1.692  -5.799  -2.113
  606   2HB   HIS  83          2HB       HIS  83   1.749  -7.318  -1.239
  607    HD1  HIS  83           HD1      HIS  83   1.264  -5.942   0.994
  608    HD2  HIS  83           HD2      HIS  83   4.876  -5.042  -0.881
  609    HE1  HIS  83           HE1      HIS  83   2.657  -4.690   2.693
  610    H    LEU  84           H        LEU  84   1.628  -7.235  -4.190
  611    HA   LEU  84           HA       LEU  84   1.374 -10.038  -4.356
  612   1HB   LEU  84          1HB       LEU  84   0.422  -7.686  -5.580
  613   2HB   LEU  84          2HB       LEU  84   1.055  -8.672  -6.893
  614    HG   LEU  84           HG       LEU  84  -0.668  -9.925  -4.785
  615   1HD1  LEU  84          1HD1      LEU  84  -1.792  -8.687  -7.302
  616   2HD1  LEU  84          2HD1      LEU  84  -1.761  -7.816  -5.768
  617   3HD1  LEU  84          3HD1      LEU  84  -2.672  -9.319  -5.912
  618   1HD2  LEU  84          1HD2      LEU  84  -0.119 -11.662  -6.144
  619   2HD2  LEU  84          2HD2      LEU  84   0.433 -10.588  -7.429
  620   3HD2  LEU  84          3HD2      LEU  84  -1.283 -10.967  -7.273
  621    H    GLU  85           H        GLU  85   3.781  -7.867  -5.704
  622    HA   GLU  85           HA       GLU  85   4.885  -9.865  -7.560
  623   1HB   GLU  85          1HB       GLU  85   5.237  -7.022  -6.821
  624   2HB   GLU  85          2HB       GLU  85   6.714  -7.835  -7.338
  625   1HG   GLU  85          1HG       GLU  85   5.661  -8.535  -9.417
  626   2HG   GLU  85          2HG       GLU  85   4.112  -7.872  -8.892
  627    H    THR  86           H        THR  86   5.868  -8.320  -4.485
  628    HA   THR  86           HA       THR  86   8.324  -9.795  -4.187
  629    HB   THR  86           HB       THR  86   6.475  -8.163  -2.464
  630    HG1  THR  86           1HG      THR  86   7.946  -7.037  -3.636
  631   1HG2  THR  86          1HG2      THR  86   8.928  -9.590  -1.402
  632   2HG2  THR  86          2HG2      THR  86   7.273 -10.102  -1.074
  633   3HG2  THR  86          3HG2      THR  86   7.841  -8.534  -0.500
  634    H    ALA  87           H        ALA  87   5.101 -10.801  -4.060
  635    HA   ALA  87           HA       ALA  87   5.861 -13.236  -2.481
  636   1HB   ALA  87          1HB       ALA  87   3.160 -11.853  -2.543
  637   2HB   ALA  87          2HB       ALA  87   4.380 -11.544  -1.307
  638   3HB   ALA  87          3HB       ALA  87   3.670 -13.151  -1.462
  639    H    GLY  88           H        GLY  88   5.678 -12.562  -5.471
  640   1HA   GLY  88          1HA       GLY  88   3.363 -13.945  -6.506
  641   2HA   GLY  88          2HA       GLY  88   4.810 -13.535  -7.428
  642    H    ALA  89           H        ALA  89   6.048 -15.091  -4.868
  643    HA   ALA  89           HA       ALA  89   5.677 -17.814  -6.070
  644   1HB   ALA  89          1HB       ALA  89   7.999 -18.085  -6.174
  645   2HB   ALA  89          2HB       ALA  89   8.294 -16.870  -4.931
  646   3HB   ALA  89          3HB       ALA  89   7.833 -16.372  -6.559
  647    H    ASP  90           H        ASP  90   5.191 -15.990  -3.370
  648    HA   ASP  90           HA       ASP  90   5.622 -18.329  -1.557
  649   1HB   ASP  90          1HB       ASP  90   7.292 -16.587  -1.228
  650   2HB   ASP  90          2HB       ASP  90   6.039 -15.366  -1.094
  651    H    ALA  91           H        ALA  91   3.353 -18.789  -2.072
  652    HA   ALA  91           HA       ALA  91   1.072 -17.284  -1.913
  653   1HB   ALA  91          1HB       ALA  91  -0.001 -19.313  -1.037
  654   2HB   ALA  91          2HB       ALA  91   1.559 -19.912  -0.476
  655   3HB   ALA  91          3HB       ALA  91   1.245 -19.752  -2.204
  656    H    ALA  92           H        ALA  92   3.252 -17.934   0.750
  657    HA   ALA  92           HA       ALA  92   1.400 -17.061   2.842
  658   1HB   ALA  92          1HB       ALA  92   4.039 -18.237   2.546
  659   2HB   ALA  92          2HB       ALA  92   2.975 -18.258   3.954
  660   3HB   ALA  92          3HB       ALA  92   4.085 -16.910   3.706
  661    H    LYS  93           H        LYS  93   4.112 -15.705   1.022
  662    HA   LYS  93           HA       LYS  93   4.164 -13.152   2.365
  663   1HB   LYS  93          1HB       LYS  93   5.271 -14.505  -0.020
  664   2HB   LYS  93          2HB       LYS  93   5.196 -12.753  -0.138
  665   1HG   LYS  93          1HG       LYS  93   6.400 -12.571   2.021
  666   2HG   LYS  93          2HG       LYS  93   6.499 -14.331   2.097
  667   1HD   LYS  93          1HD       LYS  93   7.614 -14.158  -0.241
  668   2HD   LYS  93          2HD       LYS  93   7.854 -12.457   0.164
  669   1HE   LYS  93          1HE       LYS  93   8.715 -13.684   2.469
  670   2HE   LYS  93          2HE       LYS  93   9.234 -14.840   1.225
  671   1HZ   LYS  93          1HZ       LYS  93  10.086 -12.901  -0.052
  672   2HZ   LYS  93          2HZ       LYS  93  10.913 -13.174   1.407
  673   3HZ   LYS  93          3HZ       LYS  93   9.773 -11.919   1.295
  674    H    LYS  94           H        LYS  94   2.182 -14.590  -0.109
  675    HA   LYS  94           HA       LYS  94   1.204 -12.102  -1.270
  676   1HB   LYS  94          1HB       LYS  94   1.050 -14.903  -1.705
  677   2HB   LYS  94          2HB       LYS  94  -0.609 -14.329  -1.521
  678   1HG   LYS  94          1HG       LYS  94  -0.208 -12.591  -3.220
  679   2HG   LYS  94          2HG       LYS  94   1.459 -13.139  -3.395
  680   1HD   LYS  94          1HD       LYS  94  -0.918 -14.961  -3.836
  681   2HD   LYS  94          2HD       LYS  94  -0.169 -14.034  -5.137
  682   1HE   LYS  94          1HE       LYS  94   1.882 -15.215  -4.957
  683   2HE   LYS  94          2HE       LYS  94   1.470 -15.847  -3.350
  684   1HZ   LYS  94          1HZ       LYS  94  -0.251 -17.167  -4.255
  685   2HZ   LYS  94          2HZ       LYS  94   1.105 -17.437  -5.243
  686   3HZ   LYS  94          3HZ       LYS  94  -0.145 -16.415  -5.771
  687    H    LYS  95           H        LYS  95   0.183 -14.238   1.365
  688    HA   LYS  95           HA       LYS  95  -2.363 -12.856   1.792
  689   1HB   LYS  95          1HB       LYS  95  -2.643 -14.495   3.468
  690   2HB   LYS  95          2HB       LYS  95  -1.603 -15.308   2.298
  691   1HG   LYS  95          1HG       LYS  95  -0.251 -15.701   4.079
  692   2HG   LYS  95          2HG       LYS  95   0.236 -14.018   3.879
  693   1HD   LYS  95          1HD       LYS  95  -0.975 -13.306   5.690
  694   2HD   LYS  95          2HD       LYS  95  -2.251 -14.498   5.435
  695   1HE   LYS  95          1HE       LYS  95   0.190 -15.887   6.068
  696   2HE   LYS  95          2HE       LYS  95  -0.118 -14.651   7.304
  697   1HZ   LYS  95          1HZ       LYS  95  -1.481 -16.330   8.031
  698   2HZ   LYS  95          2HZ       LYS  95  -1.813 -16.902   6.467
  699   3HZ   LYS  95          3HZ       LYS  95  -2.557 -15.483   7.032
  700    H    GLU  96           H        GLU  96   0.933 -12.462   2.782
  701    HA   GLU  96           HA       GLU  96   0.245 -10.706   5.077
  702   1HB   GLU  96          1HB       GLU  96   2.624 -10.869   5.493
  703   2HB   GLU  96          2HB       GLU  96   2.057 -12.470   5.058
  704   1HG   GLU  96          1HG       GLU  96   2.878 -12.213   2.819
  705   2HG   GLU  96          2HG       GLU  96   3.284 -10.523   3.112
  706    H    LEU  97           H        LEU  97   1.850 -10.615   1.940
  707    HA   LEU  97           HA       LEU  97   2.382  -7.748   1.997
  708   1HB   LEU  97          1HB       LEU  97   2.423  -9.863  -0.161
  709   2HB   LEU  97          2HB       LEU  97   3.076  -8.236  -0.344
  710    HG   LEU  97           HG       LEU  97   4.007 -10.392   1.555
  711   1HD1  LEU  97          1HD1      LEU  97   5.508 -10.721  -0.069
  712   2HD1  LEU  97          2HD1      LEU  97   6.091  -9.075   0.180
  713   3HD1  LEU  97          3HD1      LEU  97   4.825  -9.394  -1.005
  714   1HD2  LEU  97          1HD2      LEU  97   4.248  -7.428   1.690
  715   2HD2  LEU  97          2HD2      LEU  97   5.717  -8.351   2.004
  716   3HD2  LEU  97          3HD2      LEU  97   4.280  -8.617   2.991
  717    H    THR  98           H        THR  98   0.347  -9.674  -0.234
  718    HA   THR  98           HA       THR  98  -1.233  -7.250  -0.829
  719    HB   THR  98           HB       THR  98  -2.266  -8.823  -2.501
  720    HG1  THR  98           1HG      THR  98  -2.052 -10.806  -1.758
  721   1HG2  THR  98          1HG2      THR  98   0.593  -9.259  -2.966
  722   2HG2  THR  98          2HG2      THR  98   0.218  -7.603  -2.490
  723   3HG2  THR  98          3HG2      THR  98  -0.564  -8.312  -3.902
  724    H    GLY  99           H        GLY  99  -1.522 -10.143   1.085
  725   1HA   GLY  99          1HA       GLY  99  -4.270 -10.553   1.216
  726   2HA   GLY  99          2HA       GLY  99  -3.213 -10.710   2.621
  727    H    CYS 100           H        CYS 100  -5.936  -9.222   1.724
  728    HA   CYS 100           HA       CYS 100  -5.401  -6.524   2.710
  729   1HB   CYS 100          1HB       CYS 100  -8.166  -7.516   2.718
  730   2HB   CYS 100          2HB       CYS 100  -7.505  -6.100   1.947
  731    H    LYS 101           H        LYS 101  -7.611  -9.053   3.892
  732    HA   LYS 101           HA       LYS 101  -7.265  -7.945   6.629
  733   1HB   LYS 101          1HB       LYS 101  -9.198 -10.018   5.545
  734   2HB   LYS 101          2HB       LYS 101  -9.324  -9.173   7.087
  735   1HG   LYS 101          1HG       LYS 101  -9.156  -7.583   4.545
  736   2HG   LYS 101          2HG       LYS 101 -10.695  -8.303   5.018
  737   1HD   LYS 101          1HD       LYS 101  -9.811  -7.181   7.381
  738   2HD   LYS 101          2HD       LYS 101  -9.272  -6.010   6.176
  739   1HE   LYS 101          1HE       LYS 101 -11.598  -5.542   7.001
  740   2HE   LYS 101          2HE       LYS 101 -11.556  -5.874   5.257
  741   1HZ   LYS 101          1HZ       LYS 101 -12.660  -7.780   5.524
  742   2HZ   LYS 101          2HZ       LYS 101 -13.045  -7.238   7.087
  743   3HZ   LYS 101          3HZ       LYS 101 -11.708  -8.256   6.845
  744    H    GLY 102           H        GLY 102  -5.602  -8.911   7.744
  745   1HA   GLY 102          1HA       GLY 102  -4.981 -10.940   9.025
  746   2HA   GLY 102          2HA       GLY 102  -5.403 -11.890   7.600
  747    H    SER 103           H        SER 103  -3.968  -9.293   6.291
  748    HA   SER 103           HA       SER 103  -1.445 -10.709   5.839
  749   1HB   SER 103          1HB       SER 103  -1.077  -8.807   4.312
  750   2HB   SER 103          2HB       SER 103  -2.684  -9.479   4.089
  751    HG   SER 103           HG       SER 103  -2.008  -7.000   4.732
  752    H    LYS 104           H        LYS 104   0.148  -8.295   5.596
  753    HA   LYS 104           HA       LYS 104   0.841  -7.871   8.471
  754   1HB   LYS 104          1HB       LYS 104   2.234  -7.496   5.805
  755   2HB   LYS 104          2HB       LYS 104   2.959  -7.031   7.342
  756   1HG   LYS 104          1HG       LYS 104   1.872  -9.804   7.099
  757   2HG   LYS 104          2HG       LYS 104   3.397  -9.441   6.291
  758   1HD   LYS 104          1HD       LYS 104   4.346  -8.622   8.403
  759   2HD   LYS 104          2HD       LYS 104   2.814  -8.928   9.223
  760   1HE   LYS 104          1HE       LYS 104   3.015 -11.317   8.861
  761   2HE   LYS 104          2HE       LYS 104   4.437 -11.084   7.826
  762   1HZ   LYS 104          1HZ       LYS 104   4.350 -10.012  10.579
  763   2HZ   LYS 104          2HZ       LYS 104   5.706 -10.311   9.600
  764   3HZ   LYS 104          3HZ       LYS 104   4.845 -11.607  10.282
  765    H    CYS 105           H        CYS 105  -0.199  -6.368   5.540
  766    HA   CYS 105           HA       CYS 105   0.304  -3.615   6.326
  767   1HB   CYS 105          1HB       CYS 105  -0.166  -5.113   4.040
  768   2HB   CYS 105          2HB       CYS 105  -1.651  -4.215   4.236
  769    H    HIS 106           H        HIS 106  -2.360  -5.890   6.655
  770    HA   HIS 106           HA       HIS 106  -4.049  -3.682   7.796
  771   1HB   HIS 106          1HB       HIS 106  -4.556  -6.004   5.997
  772   2HB   HIS 106          2HB       HIS 106  -5.843  -5.562   7.119
  773    HD1  HIS 106           HD1      HIS 106  -5.281  -2.473   7.093
  774    HD2  HIS 106           HD2      HIS 106  -5.726  -4.846   3.674
  775    HE1  HIS 106           HE1      HIS 106  -5.849  -0.894   5.202
  776    H    SER 107           H        SER 107  -2.648  -4.413   9.784
  777    HA   SER 107           HA       SER 107  -2.887  -6.917  11.049
  778   1HB   SER 107          1HB       SER 107  -1.607  -4.677  11.594
  779   2HB   SER 107          2HB       SER 107  -3.025  -4.332  12.581
  780    HG   SER 107           HG       SER 107  -1.273  -5.485  13.655
  781    HHA  HEC 201           HHA      HEC 201   5.936   8.588   5.632
  782    HHB  HEC 201           HHB      HEC 201  12.072   9.685   4.854
  783    HHC  HEC 201           HHC      HEC 201  12.520   4.631   1.081
  784    HHD  HEC 201           HHD      HEC 201   6.399   3.543   1.813
  785   1HMA  HEC 201          1HMA      HEC 201   9.779  10.760   7.874
  786   2HMA  HEC 201          2HMA      HEC 201  10.180  11.855   6.548
  787   3HMA  HEC 201          3HMA      HEC 201  11.283  10.546   6.975
  788   1HAA  HEC 201          1HAA      HEC 201   6.450   9.704   7.205
  789   2HAA  HEC 201          2HAA      HEC 201   7.760  10.690   7.850
  790   1HBA  HEC 201          1HBA      HEC 201   6.743  11.522   5.202
  791   2HBA  HEC 201          2HBA      HEC 201   5.609  11.715   6.539
  792   1HMB  HEC 201          1HMB      HEC 201  15.036   8.104   4.555
  793   2HMB  HEC 201          2HMB      HEC 201  15.005   8.991   3.031
  794   3HMB  HEC 201          3HMB      HEC 201  14.016   9.533   4.386
  795    HAB  HEC 201           HAB      HEC 201  14.354   5.426   1.190
  796   1HBB  HEC 201          1HBB      HEC 201  16.595   5.497   2.326
  797   2HBB  HEC 201          2HBB      HEC 201  15.324   4.792   3.324
  798   3HBB  HEC 201          3HBB      HEC 201  15.859   6.446   3.618
  799   1HMC  HEC 201          1HMC      HEC 201  12.130   3.096  -0.100
  800   2HMC  HEC 201          2HMC      HEC 201  11.386   1.601   0.465
  801   3HMC  HEC 201          3HMC      HEC 201  10.784   2.389  -0.992
  802    HAC  HEC 201           HAC      HEC 201   7.090   2.101   0.638
  803   1HBC  HEC 201          1HBC      HEC 201   8.095   0.065  -0.375
  804   2HBC  HEC 201          2HBC      HEC 201   8.692   0.358   1.257
  805   3HBC  HEC 201          3HBC      HEC 201   9.696   0.762  -0.134
  806   1HMD  HEC 201          1HMD      HEC 201   4.575   3.315   3.089
  807   2HMD  HEC 201          2HMD      HEC 201   3.761   4.006   4.492
  808   3HMD  HEC 201          3HMD      HEC 201   3.350   4.565   2.869
  809   1HAD  HEC 201          1HAD      HEC 201   4.230   7.876   5.581
  810   2HAD  HEC 201          2HAD      HEC 201   3.211   7.370   4.238
  811   1HBD  HEC 201          1HBD      HEC 201   2.683   5.301   5.288
  812   2HBD  HEC 201          2HBD      HEC 201   3.975   5.492   6.473
  813    HHA  HEC 202           HHA      HEC 202   1.487   7.733  -9.513
  814    HHB  HEC 202           HHB      HEC 202   2.797   4.103  -4.927
  815    HHC  HEC 202           HHC      HEC 202   4.475   8.917  -1.245
  816    HHD  HEC 202           HHD      HEC 202   2.676  12.916  -5.862
  817   1HMA  HEC 202          1HMA      HEC 202   2.045   2.840  -7.316
  818   2HMA  HEC 202          2HMA      HEC 202   0.344   3.263  -7.512
  819   3HMA  HEC 202          3HMA      HEC 202   1.057   3.207  -5.902
  820   1HAA  HEC 202          1HAA      HEC 202   0.936   5.447 -10.050
  821   2HAA  HEC 202          2HAA      HEC 202  -0.115   4.511  -9.023
  822   1HBA  HEC 202          1HBA      HEC 202  -1.399   6.514  -8.469
  823   2HBA  HEC 202          2HBA      HEC 202  -0.327   7.492  -9.466
  824   1HMB  HEC 202          1HMB      HEC 202   4.577   3.702  -1.610
  825   2HMB  HEC 202          2HMB      HEC 202   2.964   3.445  -2.278
  826   3HMB  HEC 202          3HMB      HEC 202   4.381   3.321  -3.321
  827    HAB  HEC 202           HAB      HEC 202   4.104   6.968   0.052
  828   1HBB  HEC 202          1HBB      HEC 202   6.280   5.138   0.095
  829   2HBB  HEC 202          2HBB      HEC 202   6.344   6.890   0.286
  830   3HBB  HEC 202          3HBB      HEC 202   6.501   6.170  -1.317
  831   1HMC  HEC 202          1HMC      HEC 202   3.914  12.098  -0.511
  832   2HMC  HEC 202          2HMC      HEC 202   5.109  10.812  -0.679
  833   3HMC  HEC 202          3HMC      HEC 202   5.459  12.426  -1.295
  834    HAC  HEC 202           HAC      HEC 202   2.846  14.023  -4.093
  835   1HBC  HEC 202          1HBC      HEC 202   5.023  14.162  -1.980
  836   2HBC  HEC 202          2HBC      HEC 202   4.469  15.452  -3.047
  837   3HBC  HEC 202          3HBC      HEC 202   5.401  14.105  -3.701
  838   1HMD  HEC 202          1HMD      HEC 202   1.328  13.529  -8.105
  839   2HMD  HEC 202          2HMD      HEC 202   1.751  12.983  -9.729
  840   3HMD  HEC 202          3HMD      HEC 202   3.020  13.440  -8.593
  841   1HAD  HEC 202          1HAD      HEC 202   1.843   9.274 -10.739
  842   2HAD  HEC 202          2HAD      HEC 202   1.054  10.839 -10.863
  843   1HBD  HEC 202          1HBD      HEC 202   3.958  10.960 -10.369
  844   2HBD  HEC 202          2HBD      HEC 202   3.501  10.259 -11.921
  845    HHA  HEC 203           HHA      HEC 203   7.145  -6.899   4.616
  846    HHB  HEC 203           HHB      HEC 203   2.766  -2.103   4.883
  847    HHC  HEC 203           HHC      HEC 203   4.675  -0.047  -0.520
  848    HHD  HEC 203           HHD      HEC 203   8.942  -4.663  -0.970
  849   1HMA  HEC 203          1HMA      HEC 203   2.939  -5.121   7.406
  850   2HMA  HEC 203          2HMA      HEC 203   2.250  -3.763   6.517
  851   3HMA  HEC 203          3HMA      HEC 203   3.573  -3.493   7.650
  852   1HAA  HEC 203          1HAA      HEC 203   4.792  -6.187   7.690
  853   2HAA  HEC 203          2HAA      HEC 203   4.558  -7.371   6.410
  854   1HBA  HEC 203          1HBA      HEC 203   6.786  -7.853   6.263
  855   2HBA  HEC 203          2HBA      HEC 203   7.271  -6.188   6.589
  856   1HMB  HEC 203          1HMB      HEC 203   1.374  -0.524   4.307
  857   2HMB  HEC 203          2HMB      HEC 203   2.618   0.578   4.895
  858   3HMB  HEC 203          3HMB      HEC 203   1.623   1.029   3.511
  859    HAB  HEC 203           HAB      HEC 203   2.810   0.806   0.050
  860   1HBB  HEC 203          1HBB      HEC 203   3.060   3.158   1.746
  861   2HBB  HEC 203          2HBB      HEC 203   3.780   2.851   0.167
  862   3HBB  HEC 203          3HBB      HEC 203   4.595   2.297   1.631
  863   1HMC  HEC 203          1HMC      HEC 203   5.656   0.238  -2.277
  864   2HMC  HEC 203          2HMC      HEC 203   7.334   0.107  -2.803
  865   3HMC  HEC 203          3HMC      HEC 203   6.089  -0.876  -3.574
  866    HAC  HEC 203           HAC      HEC 203   9.210  -3.517  -2.593
  867   1HBC  HEC 203          1HBC      HEC 203   9.811  -1.825  -4.131
  868   2HBC  HEC 203          2HBC      HEC 203   9.258  -0.926  -2.719
  869   3HBC  HEC 203          3HBC      HEC 203   8.198  -1.116  -4.111
  870   1HMD  HEC 203          1HMD      HEC 203  10.203  -6.254  -0.483
  871   2HMD  HEC 203          2HMD      HEC 203   9.941  -7.871   0.173
  872   3HMD  HEC 203          3HMD      HEC 203  10.983  -6.732   1.025
  873   1HAD  HEC 203          1HAD      HEC 203  10.005  -7.797   3.475
  874   2HAD  HEC 203          2HAD      HEC 203   8.375  -8.289   3.909
  875   1HBD  HEC 203          1HBD      HEC 203   8.535 -10.041   2.517
  876   2HBD  HEC 203          2HBD      HEC 203   8.773  -8.941   1.158
  877    HHA  HEC 204           HHA      HEC 204  -6.727   2.241   3.879
  878    HHB  HEC 204           HHB      HEC 204  -9.988  -2.011   0.744
  879    HHC  HEC 204           HHC      HEC 204  -4.793  -5.900   0.917
  880    HHD  HEC 204           HHD      HEC 204  -1.441  -0.983   2.706
  881   1HMA  HEC 204          1HMA      HEC 204 -10.983   1.023   0.866
  882   2HMA  HEC 204          2HMA      HEC 204 -11.636   0.554   2.437
  883   3HMA  HEC 204          3HMA      HEC 204 -11.302  -0.676   1.219
  884   1HAA  HEC 204          1HAA      HEC 204 -10.025   2.114   4.329
  885   2HAA  HEC 204          2HAA      HEC 204  -8.520   2.894   3.852
  886   1HBA  HEC 204          1HBA      HEC 204  -9.428   3.432   1.665
  887   2HBA  HEC 204          2HBA      HEC 204 -10.880   2.497   2.002
  888   1HMB  HEC 204          1HMB      HEC 204 -10.515  -3.798  -0.324
  889   2HMB  HEC 204          2HMB      HEC 204 -10.187  -5.523  -0.152
  890   3HMB  HEC 204          3HMB      HEC 204  -9.702  -4.674  -1.622
  891    HAB  HEC 204           HAB      HEC 204  -6.445  -6.943   0.209
  892   1HBB  HEC 204          1HBB      HEC 204  -7.265  -5.733  -2.420
  893   2HBB  HEC 204          2HBB      HEC 204  -6.966  -7.466  -2.280
  894   3HBB  HEC 204          3HBB      HEC 204  -5.680  -6.316  -1.912
  895   1HMC  HEC 204          1HMC      HEC 204  -1.500  -6.184   2.252
  896   2HMC  HEC 204          2HMC      HEC 204  -3.022  -6.655   1.497
  897   3HMC  HEC 204          3HMC      HEC 204  -1.673  -6.113   0.499
  898    HAC  HEC 204           HAC      HEC 204  -0.380  -2.512   2.948
  899   1HBC  HEC 204          1HBC      HEC 204   1.447  -3.175   1.516
  900   2HBC  HEC 204          2HBC      HEC 204   0.154  -2.604   0.461
  901   3HBC  HEC 204          3HBC      HEC 204   0.431  -4.334   0.658
  902   1HMD  HEC 204          1HMD      HEC 204  -0.867   1.099   3.023
  903   2HMD  HEC 204          2HMD      HEC 204  -1.493   2.639   3.610
  904   3HMD  HEC 204          3HMD      HEC 204  -1.276   1.293   4.728
  905   1HAD  HEC 204          1HAD      HEC 204  -3.593   3.832   3.691
  906   2HAD  HEC 204          2HAD      HEC 204  -5.259   3.494   4.151
  907   1HBD  HEC 204          1HBD      HEC 204  -4.078   2.255   6.182
  908   2HBD  HEC 204          2HBD      HEC 204  -2.777   3.382   5.803
  Start of MODEL   12
    1   1H    ALA   1          1H        ALA   1  20.945  14.776   3.449
    2   2H    ALA   1          2H        ALA   1  19.657  15.482   2.594
    3   3H    ALA   1          3H        ALA   1  21.021  14.905   1.759
    4    HA   ALA   1           HA       ALA   1  19.417  13.244   1.422
    5   1HB   ALA   1          1HB       ALA   1  21.055  12.477   3.858
    6   2HB   ALA   1          2HB       ALA   1  21.727  12.613   2.233
    7   3HB   ALA   1          3HB       ALA   1  20.493  11.401   2.578
    8    HA   PRO   2           HA       PRO   2  15.979  13.348   4.180
    9   1HB   PRO   2          1HB       PRO   2  14.706  11.081   3.327
   10   2HB   PRO   2          2HB       PRO   2  14.707  12.592   2.403
   11   1HG   PRO   2          1HG       PRO   2  16.336  10.137   2.015
   12   2HG   PRO   2          2HG       PRO   2  15.622  11.218   0.810
   13   1HD   PRO   2          1HD       PRO   2  18.264  11.257   1.507
   14   2HD   PRO   2          2HD       PRO   2  17.388  12.668   0.874
   15    H    LYS   3           H        LYS   3  15.710  12.590   6.267
   16    HA   LYS   3           HA       LYS   3  17.289  10.205   7.080
   17   1HB   LYS   3          1HB       LYS   3  15.780  12.308   8.645
   18   2HB   LYS   3          2HB       LYS   3  16.830  11.072   9.333
   19   1HG   LYS   3          1HG       LYS   3  18.459  12.196   7.424
   20   2HG   LYS   3          2HG       LYS   3  17.543  13.594   7.992
   21   1HD   LYS   3          1HD       LYS   3  18.272  12.024  10.269
   22   2HD   LYS   3          2HD       LYS   3  19.717  12.276   9.289
   23   1HE   LYS   3          1HE       LYS   3  19.534  14.642   9.421
   24   2HE   LYS   3          2HE       LYS   3  17.848  14.560   9.971
   25   1HZ   LYS   3          1HZ       LYS   3  20.314  13.952  11.449
   26   2HZ   LYS   3          2HZ       LYS   3  18.898  13.099  11.840
   27   3HZ   LYS   3          3HZ       LYS   3  18.934  14.793  11.964
   28    H    ALA   4           H        ALA   4  15.828   8.645   6.166
   29    HA   ALA   4           HA       ALA   4  13.111   8.303   6.355
   30   1HB   ALA   4          1HB       ALA   4  15.271   6.738   5.778
   31   2HB   ALA   4          2HB       ALA   4  13.621   6.120   5.876
   32   3HB   ALA   4          3HB       ALA   4  14.703   5.971   7.261
   33    HA   PRO   5           HA       PRO   5  12.301   8.471  10.683
   34   1HB   PRO   5          1HB       PRO   5   9.670   7.714  10.576
   35   2HB   PRO   5          2HB       PRO   5  10.246   9.334  10.151
   36   1HG   PRO   5          1HG       PRO   5   9.372   7.126   8.392
   37   2HG   PRO   5          2HG       PRO   5   9.314   8.873   8.137
   38   1HD   PRO   5          1HD       PRO   5  11.183   7.119   7.025
   39   2HD   PRO   5          2HD       PRO   5  11.315   8.888   7.087
   40    H    ALA   6           H        ALA   6  11.670   6.994  12.438
   41    HA   ALA   6           HA       ALA   6  12.839   4.446  12.310
   42   1HB   ALA   6          1HB       ALA   6  10.530   5.211  14.104
   43   2HB   ALA   6          2HB       ALA   6  12.129   5.930  14.290
   44   3HB   ALA   6          3HB       ALA   6  11.916   4.191  14.490
   45    H    ASP   7           H        ASP   7  11.521   2.390  12.828
   46    HA   ASP   7           HA       ASP   7   9.647   1.913  10.626
   47   1HB   ASP   7          1HB       ASP   7  10.485   0.057  12.863
   48   2HB   ASP   7          2HB       ASP   7  10.003  -0.369  11.224
   49    H    GLY   8           H        GLY   8   7.544   0.858  11.093
   50   1HA   GLY   8          1HA       GLY   8   5.662   0.394  12.511
   51   2HA   GLY   8          2HA       GLY   8   6.424   1.340  13.787
   52    H    LEU   9           H        LEU   9   6.507   2.840  10.710
   53    HA   LEU   9           HA       LEU   9   5.012   5.120  11.536
   54   1HB   LEU   9          1HB       LEU   9   6.535   4.312   9.352
   55   2HB   LEU   9          2HB       LEU   9   4.925   4.542   8.666
   56    HG   LEU   9           HG       LEU   9   5.891   6.621  10.564
   57   1HD1  LEU   9          1HD1      LEU   9   7.893   6.540   9.341
   58   2HD1  LEU   9          2HD1      LEU   9   6.950   7.717   8.426
   59   3HD1  LEU   9          3HD1      LEU   9   7.076   6.052   7.855
   60   1HD2  LEU   9          1HD2      LEU   9   4.077   6.359   8.211
   61   2HD2  LEU   9          2HD2      LEU   9   4.868   7.922   8.438
   62   3HD2  LEU   9          3HD2      LEU   9   3.844   7.253   9.714
   63    H    LYS  10           H        LYS  10   2.848   5.232  11.899
   64    HA   LYS  10           HA       LYS  10   1.115   3.121  10.715
   65   1HB   LYS  10          1HB       LYS  10   1.221   4.734  13.152
   66   2HB   LYS  10          2HB       LYS  10  -0.395   4.657  12.446
   67   1HG   LYS  10          1HG       LYS  10   0.142   2.092  12.209
   68   2HG   LYS  10          2HG       LYS  10   1.322   2.423  13.478
   69   1HD   LYS  10          1HD       LYS  10  -0.405   3.288  14.945
   70   2HD   LYS  10          2HD       LYS  10  -1.609   3.171  13.660
   71   1HE   LYS  10          1HE       LYS  10  -1.617   0.798  13.722
   72   2HE   LYS  10          2HE       LYS  10  -0.089   0.737  14.622
   73   1HZ   LYS  10          1HZ       LYS  10  -2.224   2.306  15.818
   74   2HZ   LYS  10          2HZ       LYS  10  -1.088   1.280  16.555
   75   3HZ   LYS  10          3HZ       LYS  10  -2.468   0.628  15.809
   76    H    MET  11           H        MET  11   0.212   3.667   8.816
   77    HA   MET  11           HA       MET  11  -0.383   6.483   8.135
   78   1HB   MET  11          1HB       MET  11  -1.200   5.224   6.001
   79   2HB   MET  11          2HB       MET  11   0.526   5.214   6.343
   80   1HG   MET  11          1HG       MET  11  -0.970   3.032   7.625
   81   2HG   MET  11          2HG       MET  11  -0.986   2.980   5.865
   82   1HE   MET  11          1HE       MET  11   1.210   2.575   4.342
   83   2HE   MET  11          2HE       MET  11   2.734   3.229   4.933
   84   3HE   MET  11          3HE       MET  11   1.304   4.255   4.887
   85    H    ASP  12           H        ASP  12  -2.190   7.147   9.291
   86    HA   ASP  12           HA       ASP  12  -4.551   5.299   9.348
   87   1HB   ASP  12          1HB       ASP  12  -5.213   7.028  11.173
   88   2HB   ASP  12          2HB       ASP  12  -3.911   5.898  11.521
   89    H    LYS  13           H        LYS  13  -3.607   7.374   7.220
   90    HA   LYS  13           HA       LYS  13  -5.306   9.586   7.041
   91   1HB   LYS  13          1HB       LYS  13  -4.158   7.618   5.074
   92   2HB   LYS  13          2HB       LYS  13  -5.124   8.981   4.515
   93   1HG   LYS  13          1HG       LYS  13  -2.670   9.195   6.287
   94   2HG   LYS  13          2HG       LYS  13  -2.690   9.510   4.549
   95   1HD   LYS  13          1HD       LYS  13  -4.629  11.169   5.132
   96   2HD   LYS  13          2HD       LYS  13  -3.973  11.086   6.766
   97   1HE   LYS  13          1HE       LYS  13  -1.786  11.412   4.928
   98   2HE   LYS  13          2HE       LYS  13  -3.004  12.663   4.606
   99   1HZ   LYS  13          1HZ       LYS  13  -1.722  11.997   7.195
  100   2HZ   LYS  13          2HZ       LYS  13  -3.138  12.930   7.092
  101   3HZ   LYS  13          3HZ       LYS  13  -1.700  13.482   6.376
  102    H    THR  14           H        THR  14  -6.053   6.184   6.576
  103    HA   THR  14           HA       THR  14  -8.901   6.908   5.960
  104    HB   THR  14           HB       THR  14  -8.876   4.538   4.976
  105    HG1  THR  14           1HG      THR  14  -7.014   3.780   5.927
  106   1HG2  THR  14          1HG2      THR  14  -7.119   6.728   3.850
  107   2HG2  THR  14          2HG2      THR  14  -8.838   6.488   3.544
  108   3HG2  THR  14          3HG2      THR  14  -7.662   5.326   2.926
  109    H    LYS  15           H        LYS  15 -10.439   5.082   6.714
  110    HA   LYS  15           HA       LYS  15 -10.353   4.810   9.544
  111   1HB   LYS  15          1HB       LYS  15 -11.920   3.849   7.239
  112   2HB   LYS  15          2HB       LYS  15 -11.972   2.772   8.635
  113   1HG   LYS  15          1HG       LYS  15 -13.356   4.173   9.723
  114   2HG   LYS  15          2HG       LYS  15 -12.219   5.505   9.518
  115   1HD   LYS  15          1HD       LYS  15 -13.109   5.963   7.284
  116   2HD   LYS  15          2HD       LYS  15 -14.202   4.586   7.417
  117   1HE   LYS  15          1HE       LYS  15 -14.382   6.507   9.661
  118   2HE   LYS  15          2HE       LYS  15 -14.919   7.135   8.091
  119   1HZ   LYS  15          1HZ       LYS  15 -16.578   5.776   9.496
  120   2HZ   LYS  15          2HZ       LYS  15 -15.693   4.426   8.966
  121   3HZ   LYS  15          3HZ       LYS  15 -16.456   5.442   7.837
  122    H    GLN  16           H        GLN  16  -8.864   2.940   7.021
  123    HA   GLN  16           HA       GLN  16  -8.218   0.733   8.930
  124   1HB   GLN  16          1HB       GLN  16  -8.200   1.072   5.924
  125   2HB   GLN  16          2HB       GLN  16  -7.443  -0.318   6.706
  126   1HG   GLN  16          1HG       GLN  16  -9.550  -0.959   7.729
  127   2HG   GLN  16          2HG       GLN  16 -10.331   0.503   7.124
  128   1HE2  GLN  16          2HE2      GLN  16  -8.162  -1.895   5.514
  129   2HE2  GLN  16          1HE2      GLN  16  -9.233  -2.222   4.238
  130    HA   PRO  17           HA       PRO  17  -4.437   3.377   8.765
  131   1HB   PRO  17          1HB       PRO  17  -3.762   2.959  11.390
  132   2HB   PRO  17          2HB       PRO  17  -4.870   4.241  10.861
  133   1HG   PRO  17          1HG       PRO  17  -5.492   1.554  11.997
  134   2HG   PRO  17          2HG       PRO  17  -6.249   3.120  12.330
  135   1HD   PRO  17          1HD       PRO  17  -7.378   1.290  10.695
  136   2HD   PRO  17          2HD       PRO  17  -7.564   3.040  10.441
  137    H    VAL  18           H        VAL  18  -2.475   2.517   8.216
  138    HA   VAL  18           HA       VAL  18  -1.922  -0.335   8.952
  139    HB   VAL  18           HB       VAL  18  -1.455   1.345   6.480
  140   1HG1  VAL  18          1HG1      VAL  18  -0.108  -0.475   5.577
  141   2HG1  VAL  18          2HG1      VAL  18  -0.300  -1.396   7.069
  142   3HG1  VAL  18          3HG1      VAL  18   0.624   0.106   7.072
  143   1HG2  VAL  18          1HG2      VAL  18  -3.400   0.279   5.982
  144   2HG2  VAL  18          2HG2      VAL  18  -3.212  -0.863   7.312
  145   3HG2  VAL  18          3HG2      VAL  18  -2.400  -1.159   5.775
  146    H    VAL  19           H        VAL  19   0.381  -0.839   9.241
  147    HA   VAL  19           HA       VAL  19   1.958   1.514  10.209
  148    HB   VAL  19           HB       VAL  19   2.016  -1.449  10.866
  149   1HG1  VAL  19          1HG1      VAL  19   3.461   0.661  12.437
  150   2HG1  VAL  19          2HG1      VAL  19   4.210   0.018  10.975
  151   3HG1  VAL  19          3HG1      VAL  19   3.803  -1.064  12.307
  152   1HG2  VAL  19          1HG2      VAL  19   1.427   0.673  12.874
  153   2HG2  VAL  19          2HG2      VAL  19   0.766  -0.955  12.734
  154   3HG2  VAL  19          3HG2      VAL  19   0.171   0.330  11.684
  155    H    PHE  20           H        PHE  20   3.629   2.079   8.819
  156    HA   PHE  20           HA       PHE  20   4.680  -0.006   6.957
  157   1HB   PHE  20          1HB       PHE  20   3.860   2.136   6.021
  158   2HB   PHE  20          2HB       PHE  20   5.013   3.015   7.022
  159    HD1  PHE  20           HD1      PHE  20   5.037   0.052   4.717
  160    HD2  PHE  20           HD2      PHE  20   6.998   3.658   5.973
  161    HE1  PHE  20           HE1      PHE  20   6.805  -0.315   3.020
  162    HE2  PHE  20           HE2      PHE  20   8.760   3.291   4.274
  163    HZ   PHE  20           HZ       PHE  20   8.668   1.304   2.799
  164    H    ASN  21           H        ASN  21   6.531  -1.012   7.622
  165    HA   ASN  21           HA       ASN  21   8.306   0.330   9.578
  166   1HB   ASN  21          1HB       ASN  21   7.418  -2.330   8.885
  167   2HB   ASN  21          2HB       ASN  21   9.172  -2.255   8.848
  168   1HD2  ASN  21          2HD2      ASN  21   6.580  -0.892  10.965
  169   2HD2  ASN  21          1HD2      ASN  21   7.348  -1.313  12.419
  170    H    HIS  22           H        HIS  22   9.497   1.815   8.270
  171    HA   HIS  22           HA       HIS  22  10.461   1.487   5.669
  172   1HB   HIS  22          1HB       HIS  22  11.411   2.874   8.153
  173   2HB   HIS  22          2HB       HIS  22  12.459   2.878   6.736
  174    HD1  HIS  22           HD1      HIS  22   9.606   4.601   8.192
  175    HD2  HIS  22           HD2      HIS  22  11.005   3.951   4.316
  176    HE1  HIS  22           HE1      HIS  22   8.534   6.372   6.740
  177    H    SER  23           H        SER  23  11.708   0.093   8.675
  178    HA   SER  23           HA       SER  23  14.243  -0.825   7.857
  179   1HB   SER  23          1HB       SER  23  13.839  -1.304  10.067
  180   2HB   SER  23          2HB       SER  23  12.122  -1.583   9.790
  181    HG   SER  23           HG       SER  23  14.268  -3.330   9.133
  182    H    THR  24           H        THR  24  11.042  -2.328   7.378
  183    HA   THR  24           HA       THR  24  12.052  -4.653   5.965
  184    HB   THR  24           HB       THR  24   9.378  -4.169   5.252
  185    HG1  THR  24           1HG      THR  24   9.010  -2.549   6.594
  186   1HG2  THR  24          1HG2      THR  24   9.210  -5.625   7.565
  187   2HG2  THR  24          2HG2      THR  24  10.904  -5.854   7.127
  188   3HG2  THR  24          3HG2      THR  24   9.632  -6.301   5.991
  189    H    HIS  25           H        HIS  25  11.870  -1.405   5.111
  190    HA   HIS  25           HA       HIS  25  11.724  -2.075   2.203
  191   1HB   HIS  25          1HB       HIS  25  10.883   0.402   3.735
  192   2HB   HIS  25          2HB       HIS  25  10.692   0.149   2.003
  193    HD1  HIS  25           HD1      HIS  25   9.388  -1.019   5.322
  194    HD2  HIS  25           HD2      HIS  25   8.644  -1.690   1.278
  195    HE1  HIS  25           HE1      HIS  25   7.254  -2.376   5.204
  196    H    LYS  26           H        LYS  26  13.676  -0.867   4.728
  197    HA   LYS  26           HA       LYS  26  15.213   1.189   3.625
  198   1HB   LYS  26          1HB       LYS  26  16.964   0.355   5.104
  199   2HB   LYS  26          2HB       LYS  26  15.405   0.098   5.889
  200   1HG   LYS  26          1HG       LYS  26  15.404  -2.243   4.965
  201   2HG   LYS  26          2HG       LYS  26  17.050  -1.962   4.396
  202   1HD   LYS  26          1HD       LYS  26  17.301  -1.154   6.972
  203   2HD   LYS  26          2HD       LYS  26  16.052  -2.386   7.157
  204   1HE   LYS  26          1HE       LYS  26  17.909  -3.557   5.415
  205   2HE   LYS  26          2HE       LYS  26  18.896  -2.741   6.643
  206   1HZ   LYS  26          1HZ       LYS  26  16.879  -4.843   6.983
  207   2HZ   LYS  26          2HZ       LYS  26  17.056  -3.693   8.220
  208   3HZ   LYS  26          3HZ       LYS  26  18.376  -4.655   7.755
  209    H    ALA  27           H        ALA  27  14.999  -2.149   2.642
  210    HA   ALA  27           HA       ALA  27  17.428  -1.988   0.948
  211   1HB   ALA  27          1HB       ALA  27  16.947  -4.363   0.592
  212   2HB   ALA  27          2HB       ALA  27  15.360  -4.177   1.340
  213   3HB   ALA  27          3HB       ALA  27  16.820  -3.998   2.314
  214    H    VAL  28           H        VAL  28  14.164  -1.159   0.717
  215    HA   VAL  28           HA       VAL  28  13.745  -1.911  -2.087
  216    HB   VAL  28           HB       VAL  28  12.289  -0.206  -0.051
  217   1HG1  VAL  28          1HG1      VAL  28  11.756   0.724  -2.214
  218   2HG1  VAL  28          2HG1      VAL  28  10.391  -0.267  -1.700
  219   3HG1  VAL  28          3HG1      VAL  28  11.526  -0.886  -2.900
  220   1HG2  VAL  28          1HG2      VAL  28  10.907  -2.054   0.272
  221   2HG2  VAL  28          2HG2      VAL  28  12.455  -2.841  -0.032
  222   3HG2  VAL  28          3HG2      VAL  28  11.259  -2.719  -1.323
  223    H    LYS  29           H        LYS  29  12.996   0.084  -3.538
  224    HA   LYS  29           HA       LYS  29  15.310   1.913  -3.579
  225   1HB   LYS  29          1HB       LYS  29  13.414   0.781  -5.424
  226   2HB   LYS  29          2HB       LYS  29  13.430   2.539  -5.578
  227   1HG   LYS  29          1HG       LYS  29  15.223   2.133  -6.928
  228   2HG   LYS  29          2HG       LYS  29  16.081   2.079  -5.387
  229   1HD   LYS  29          1HD       LYS  29  16.262  -0.226  -5.409
  230   2HD   LYS  29          2HD       LYS  29  14.788  -0.437  -6.355
  231   1HE   LYS  29          1HE       LYS  29  16.675  -0.984  -7.791
  232   2HE   LYS  29          2HE       LYS  29  16.034   0.583  -8.329
  233   1HZ   LYS  29          1HZ       LYS  29  17.680   1.736  -7.133
  234   2HZ   LYS  29          2HZ       LYS  29  18.513   0.489  -7.932
  235   3HZ   LYS  29          3HZ       LYS  29  18.158   0.352  -6.276
  236    H    CYS  30           H        CYS  30  15.077   3.526  -2.127
  237    HA   CYS  30           HA       CYS  30  12.796   4.706  -1.038
  238   1HB   CYS  30          1HB       CYS  30  15.550   5.668  -1.752
  239   2HB   CYS  30          2HB       CYS  30  14.378   6.839  -1.150
  240    H    GLY  31           H        GLY  31  14.048   4.969  -4.274
  241   1HA   GLY  31          1HA       GLY  31  12.335   7.278  -4.939
  242   2HA   GLY  31          2HA       GLY  31  13.446   6.462  -6.043
  243    H    ASP  32           H        ASP  32  12.033   3.883  -4.790
  244    HA   ASP  32           HA       ASP  32  10.151   3.613  -7.022
  245   1HB   ASP  32          1HB       ASP  32  11.716   1.952  -5.428
  246   2HB   ASP  32          2HB       ASP  32  10.077   1.592  -4.897
  247    H    CYS  33           H        CYS  33  10.028   4.115  -3.528
  248    HA   CYS  33           HA       CYS  33   7.059   4.084  -3.512
  249   1HB   CYS  33          1HB       CYS  33   9.311   4.279  -1.510
  250   2HB   CYS  33          2HB       CYS  33   7.679   4.741  -1.031
  251    H    HIS  34           H        HIS  34   9.673   6.337  -2.519
  252    HA   HIS  34           HA       HIS  34   7.867   8.664  -2.824
  253   1HB   HIS  34          1HB       HIS  34  10.766   8.277  -1.994
  254   2HB   HIS  34          2HB       HIS  34   9.970   9.841  -2.040
  255    HD1  HIS  34           HD1      HIS  34   7.562   9.820  -0.564
  256    HD2  HIS  34           HD2      HIS  34  10.535   7.087   0.473
  257    HE1  HIS  34           HE1      HIS  34   7.081   9.098   1.817
  258    H    HIS  35           H        HIS  35   8.242   7.303  -5.254
  259    HA   HIS  35           HA       HIS  35  10.288   7.716  -6.975
  260   1HB   HIS  35          1HB       HIS  35   8.440   8.323  -8.675
  261   2HB   HIS  35          2HB       HIS  35   8.264   6.815  -7.798
  262    HD1  HIS  35           HD1      HIS  35   6.981  10.298  -7.926
  263    HD2  HIS  35           HD2      HIS  35   6.027   6.715  -6.049
  264    HE1  HIS  35           HE1      HIS  35   4.716  10.645  -6.862
  265    HA   PRO  36           HA       PRO  36  11.438  11.889  -7.299
  266   1HB   PRO  36          1HB       PRO  36  11.923  12.143  -9.987
  267   2HB   PRO  36          2HB       PRO  36  12.995  11.264  -8.879
  268   1HG   PRO  36          1HG       PRO  36  10.901  10.203 -10.721
  269   2HG   PRO  36          2HG       PRO  36  12.529   9.585 -10.392
  270   1HD   PRO  36          1HD       PRO  36  10.332   8.487  -9.283
  271   2HD   PRO  36          2HD       PRO  36  11.889   8.558  -8.426
  272    H    VAL  37           H        VAL  37   9.715  13.221  -6.839
  273    HA   VAL  37           HA       VAL  37   7.714  13.770  -8.993
  274    HB   VAL  37           HB       VAL  37   7.795  14.051  -5.986
  275   1HG1  VAL  37          1HG1      VAL  37   6.829  16.129  -6.864
  276   2HG1  VAL  37          2HG1      VAL  37   5.563  15.131  -6.149
  277   3HG1  VAL  37          3HG1      VAL  37   5.745  15.203  -7.902
  278   1HG2  VAL  37          1HG2      VAL  37   5.895  12.680  -7.916
  279   2HG2  VAL  37          2HG2      VAL  37   5.746  12.670  -6.158
  280   3HG2  VAL  37          3HG2      VAL  37   7.119  11.878  -6.932
  281    H    ASN  38           H        ASN  38   7.289  16.031  -9.498
  282    HA   ASN  38           HA       ASN  38   8.058  18.226  -9.998
  283   1HB   ASN  38          1HB       ASN  38   7.370  18.066  -7.518
  284   2HB   ASN  38          2HB       ASN  38   9.083  18.062  -7.171
  285   1HD2  ASN  38          2HD2      ASN  38   6.651  20.187  -7.100
  286   2HD2  ASN  38          1HD2      ASN  38   7.432  21.596  -7.636
  287    H    GLY  39           H        GLY  39  10.082  15.840 -10.158
  288   1HA   GLY  39          1HA       GLY  39  12.281  15.942 -11.117
  289   2HA   GLY  39          2HA       GLY  39  12.465  17.569 -10.455
  290    H    LYS  40           H        LYS  40  11.151  16.147  -7.919
  291    HA   LYS  40           HA       LYS  40  13.683  14.854  -6.950
  292   1HB   LYS  40          1HB       LYS  40  13.631  16.250  -4.986
  293   2HB   LYS  40          2HB       LYS  40  13.448  17.321  -6.375
  294   1HG   LYS  40          1HG       LYS  40  10.912  17.044  -6.039
  295   2HG   LYS  40          2HG       LYS  40  11.316  16.368  -4.460
  296   1HD   LYS  40          1HD       LYS  40  12.635  18.446  -3.971
  297   2HD   LYS  40          2HD       LYS  40  12.041  19.125  -5.488
  298   1HE   LYS  40          1HE       LYS  40   9.680  18.703  -4.633
  299   2HE   LYS  40          2HE       LYS  40  10.409  18.346  -3.054
  300   1HZ   LYS  40          1HZ       LYS  40  11.424  20.469  -2.992
  301   2HZ   LYS  40          2HZ       LYS  40   9.799  20.737  -3.411
  302   3HZ   LYS  40          3HZ       LYS  40  11.010  20.805  -4.601
  303    H    GLU  41           H        GLU  41  13.323  13.135  -5.500
  304    HA   GLU  41           HA       GLU  41  10.698  11.928  -5.440
  305   1HB   GLU  41          1HB       GLU  41  13.331  11.452  -4.032
  306   2HB   GLU  41          2HB       GLU  41  11.917  10.451  -3.706
  307   1HG   GLU  41          1HG       GLU  41  11.913   9.527  -5.841
  308   2HG   GLU  41          2HG       GLU  41  12.728  10.918  -6.556
  309    H    ASP  42           H        ASP  42   9.060  12.830  -4.218
  310    HA   ASP  42           HA       ASP  42   9.561  14.476  -1.886
  311   1HB   ASP  42          1HB       ASP  42   7.130  13.105  -3.046
  312   2HB   ASP  42          2HB       ASP  42   7.058  14.177  -1.648
  313    H    TYR  43           H        TYR  43  10.666  13.326  -0.298
  314    HA   TYR  43           HA       TYR  43   9.928  10.597   0.442
  315   1HB   TYR  43          1HB       TYR  43  11.683  12.640   1.847
  316   2HB   TYR  43          2HB       TYR  43  11.721  10.891   2.076
  317    HD1  TYR  43           HD1      TYR  43  12.682  13.680  -0.088
  318    HD2  TYR  43           HD2      TYR  43  12.558   9.400   0.274
  319    HE1  TYR  43           HE1      TYR  43  14.282  13.474  -1.969
  320    HE2  TYR  43           HE2      TYR  43  14.158   9.196  -1.607
  321    HH   TYR  43           HH       TYR  43  16.060  10.929  -2.598
  322    H    GLN  44           H        GLN  44   7.581  11.914   0.684
  323    HA   GLN  44           HA       GLN  44   7.305  12.491   3.618
  324   1HB   GLN  44          1HB       GLN  44   5.549  13.536   1.386
  325   2HB   GLN  44          2HB       GLN  44   5.702  14.161   3.028
  326   1HG   GLN  44          1HG       GLN  44   8.114  14.090   1.233
  327   2HG   GLN  44          2HG       GLN  44   6.936  15.391   1.067
  328   1HE2  GLN  44          2HE2      GLN  44   6.569  16.789   2.988
  329   2HE2  GLN  44          1HE2      GLN  44   7.756  16.903   4.195
  330    H    LYS  45           H        LYS  45   5.069  11.988   4.441
  331    HA   LYS  45           HA       LYS  45   4.291   9.347   4.199
  332   1HB   LYS  45          1HB       LYS  45   2.923  11.924   4.857
  333   2HB   LYS  45          2HB       LYS  45   1.930  10.474   4.722
  334   1HG   LYS  45          1HG       LYS  45   2.943   9.440   6.533
  335   2HG   LYS  45          2HG       LYS  45   4.452  10.332   6.329
  336   1HD   LYS  45          1HD       LYS  45   3.446  12.356   7.194
  337   2HD   LYS  45          2HD       LYS  45   1.851  11.603   7.228
  338   1HE   LYS  45          1HE       LYS  45   2.664   9.965   8.908
  339   2HE   LYS  45          2HE       LYS  45   4.250  10.761   8.896
  340   1HZ   LYS  45          1HZ       LYS  45   2.293  11.506  10.525
  341   2HZ   LYS  45          2HZ       LYS  45   1.928  12.491   9.190
  342   3HZ   LYS  45          3HZ       LYS  45   3.454  12.590   9.931
  343    H    CYS  46           H        CYS  46   3.376   8.147   2.594
  344    HA   CYS  46           HA       CYS  46   3.055   8.796  -0.039
  345   1HB   CYS  46          1HB       CYS  46   1.260   7.062   1.666
  346   2HB   CYS  46          2HB       CYS  46   1.392   6.948  -0.083
  347    H    ALA  47           H        ALA  47   0.560   9.279   2.454
  348    HA   ALA  47           HA       ALA  47  -1.185  10.669   0.497
  349   1HB   ALA  47          1HB       ALA  47  -1.434   9.146   2.919
  350   2HB   ALA  47          2HB       ALA  47  -2.706   9.662   1.811
  351   3HB   ALA  47          3HB       ALA  47  -2.210  10.712   3.137
  352    H    THR  48           H        THR  48   1.103  12.165   0.878
  353    HA   THR  48           HA       THR  48   1.321  13.955   2.972
  354    HB   THR  48           HB       THR  48   1.535  15.128   0.277
  355    HG1  THR  48           1HG      THR  48   2.931  12.763   0.976
  356   1HG2  THR  48          1HG2      THR  48   2.645  15.866   2.474
  357   2HG2  THR  48          2HG2      THR  48   3.685  15.766   1.052
  358   3HG2  THR  48          3HG2      THR  48   3.715  14.480   2.260
  359    H    ALA  49           H        ALA  49   0.591  16.259   3.033
  360    HA   ALA  49           HA       ALA  49  -2.271  16.476   2.968
  361   1HB   ALA  49          1HB       ALA  49  -0.124  17.816   4.059
  362   2HB   ALA  49          2HB       ALA  49  -1.795  18.374   4.121
  363   3HB   ALA  49          3HB       ALA  49  -0.713  18.965   2.861
  364    H    GLY  50           H        GLY  50  -2.125  15.650   0.556
  365   1HA   GLY  50          1HA       GLY  50  -3.387  16.930  -1.308
  366   2HA   GLY  50          2HA       GLY  50  -1.974  17.988  -1.296
  367    H    CYS  51           H        CYS  51  -1.709  14.540  -0.765
  368    HA   CYS  51           HA       CYS  51  -0.419  14.262  -3.452
  369   1HB   CYS  51          1HB       CYS  51   0.661  14.186  -0.888
  370   2HB   CYS  51          2HB       CYS  51   0.504  12.489  -1.313
  371    H    HIS  52           H        HIS  52  -1.051  11.790  -0.986
  372    HA   HIS  52           HA       HIS  52  -2.923  10.448  -2.901
  373   1HB   HIS  52          1HB       HIS  52  -0.917   9.466  -0.874
  374   2HB   HIS  52          2HB       HIS  52  -2.163   8.412  -1.490
  375    HD1  HIS  52           HD1      HIS  52  -2.253   8.864  -4.346
  376    HD2  HIS  52           HD2      HIS  52   1.378   8.966  -2.334
  377    HE1  HIS  52           HE1      HIS  52  -0.462   8.407  -6.090
  378    H    ASP  53           H        ASP  53  -3.704  12.521  -1.013
  379    HA   ASP  53           HA       ASP  53  -4.914  11.089   1.279
  380   1HB   ASP  53          1HB       ASP  53  -3.697  13.281   1.454
  381   2HB   ASP  53          2HB       ASP  53  -4.979  14.012   0.488
  382    H    ASN  54           H        ASN  54  -5.977  10.662  -1.545
  383    HA   ASN  54           HA       ASN  54  -8.548  12.081  -1.586
  384   1HB   ASN  54          1HB       ASN  54  -6.937  10.837  -3.427
  385   2HB   ASN  54          2HB       ASN  54  -8.181   9.617  -3.179
  386   1HD2  ASN  54          2HD2      ASN  54  -9.740   9.861  -4.785
  387   2HD2  ASN  54          1HD2      ASN  54 -10.366  11.347  -5.317
  388    H    MET  55           H        MET  55  -9.893  11.514   0.122
  389    HA   MET  55           HA       MET  55  -9.955   8.805   1.205
  390   1HB   MET  55          1HB       MET  55 -11.647  11.291   1.611
  391   2HB   MET  55          2HB       MET  55 -11.759   9.841   2.607
  392   1HG   MET  55          1HG       MET  55  -9.229  11.466   2.217
  393   2HG   MET  55          2HG       MET  55 -10.289  11.583   3.622
  394   1HE   MET  55          1HE       MET  55  -7.870   8.338   1.891
  395   2HE   MET  55          2HE       MET  55  -6.830   9.432   2.798
  396   3HE   MET  55          3HE       MET  55  -7.924  10.078   1.576
  397    H    ASP  56           H        ASP  56 -10.711   9.126  -1.677
  398    HA   ASP  56           HA       ASP  56 -13.609   8.426  -1.620
  399   1HB   ASP  56          1HB       ASP  56 -12.176  10.100  -3.204
  400   2HB   ASP  56          2HB       ASP  56 -12.052   8.616  -4.148
  401    H    LYS  57           H        LYS  57 -10.517   7.001  -1.697
  402    HA   LYS  57           HA       LYS  57  -9.760   4.828  -2.245
  403   1HB   LYS  57          1HB       LYS  57 -12.618   4.155  -1.519
  404   2HB   LYS  57          2HB       LYS  57 -11.183   3.172  -1.246
  405   1HG   LYS  57          1HG       LYS  57 -10.511   4.416   0.571
  406   2HG   LYS  57          2HG       LYS  57 -11.227   5.904  -0.046
  407   1HD   LYS  57          1HD       LYS  57 -13.457   4.365   0.304
  408   2HD   LYS  57          2HD       LYS  57 -12.438   3.788   1.624
  409   1HE   LYS  57          1HE       LYS  57 -12.197   6.022   2.518
  410   2HE   LYS  57          2HE       LYS  57 -12.981   6.729   1.092
  411   1HZ   LYS  57          1HZ       LYS  57 -14.890   5.158   1.645
  412   2HZ   LYS  57          2HZ       LYS  57 -14.702   6.525   2.636
  413   3HZ   LYS  57          3HZ       LYS  57 -14.174   5.002   3.175
  414    H    LYS  58           H        LYS  58 -11.257   6.441  -4.389
  415    HA   LYS  58           HA       LYS  58 -11.846   4.114  -6.182
  416   1HB   LYS  58          1HB       LYS  58 -13.788   5.285  -6.993
  417   2HB   LYS  58          2HB       LYS  58 -13.867   5.338  -5.231
  418   1HG   LYS  58          1HG       LYS  58 -14.190   7.573  -5.594
  419   2HG   LYS  58          2HG       LYS  58 -12.429   7.586  -5.696
  420   1HD   LYS  58          1HD       LYS  58 -13.064   8.694  -7.665
  421   2HD   LYS  58          2HD       LYS  58 -12.809   7.038  -8.218
  422   1HE   LYS  58          1HE       LYS  58 -15.223   6.585  -8.058
  423   2HE   LYS  58          2HE       LYS  58 -15.501   8.231  -7.455
  424   1HZ   LYS  58          1HZ       LYS  58 -14.163   7.584 -10.028
  425   2HZ   LYS  58          2HZ       LYS  58 -14.562   9.133  -9.454
  426   3HZ   LYS  58          3HZ       LYS  58 -15.790   8.042  -9.888
  427    H    ASP  59           H        ASP  59 -10.506   7.326  -5.755
  428    HA   ASP  59           HA       ASP  59 -10.130   8.148  -8.433
  429   1HB   ASP  59          1HB       ASP  59  -9.659   9.641  -6.641
  430   2HB   ASP  59          2HB       ASP  59  -8.574   8.488  -5.864
  431    H    LYS  60           H        LYS  60  -9.405   6.596  -9.909
  432    HA   LYS  60           HA       LYS  60  -7.224   4.748  -9.262
  433   1HB   LYS  60          1HB       LYS  60  -9.099   5.350 -11.502
  434   2HB   LYS  60          2HB       LYS  60  -7.601   4.519 -11.923
  435   1HG   LYS  60          1HG       LYS  60  -9.522   3.615  -9.758
  436   2HG   LYS  60          2HG       LYS  60  -9.446   2.932 -11.382
  437   1HD   LYS  60          1HD       LYS  60  -6.794   2.904 -10.493
  438   2HD   LYS  60          2HD       LYS  60  -7.737   2.405  -9.088
  439   1HE   LYS  60          1HE       LYS  60  -8.004   0.356 -10.009
  440   2HE   LYS  60          2HE       LYS  60  -8.815   1.092 -11.405
  441   1HZ   LYS  60          1HZ       LYS  60  -6.951   0.248 -12.407
  442   2HZ   LYS  60          2HZ       LYS  60  -5.972   0.453 -11.034
  443   3HZ   LYS  60          3HZ       LYS  60  -6.384   1.793 -11.994
  444    H    SER  61           H        SER  61  -7.102   7.951  -9.705
  445    HA   SER  61           HA       SER  61  -5.011   8.132 -11.765
  446   1HB   SER  61          1HB       SER  61  -6.820   9.840 -10.286
  447   2HB   SER  61          2HB       SER  61  -5.188  10.497 -10.230
  448    HG   SER  61           HG       SER  61  -5.464  11.067 -12.223
  449    H    ALA  62           H        ALA  62  -3.366  10.076 -10.471
  450    HA   ALA  62           HA       ALA  62  -1.779   8.289  -8.692
  451   1HB   ALA  62          1HB       ALA  62  -0.022   9.231  -9.781
  452   2HB   ALA  62          2HB       ALA  62  -0.635  10.860  -9.504
  453   3HB   ALA  62          3HB       ALA  62  -1.216   9.921 -10.879
  454    H    LYS  63           H        LYS  63  -4.207   9.918  -7.815
  455    HA   LYS  63           HA       LYS  63  -2.815  11.508  -5.685
  456   1HB   LYS  63          1HB       LYS  63  -4.277  12.505  -7.771
  457   2HB   LYS  63          2HB       LYS  63  -5.526  12.323  -6.539
  458   1HG   LYS  63          1HG       LYS  63  -3.129  13.437  -5.367
  459   2HG   LYS  63          2HG       LYS  63  -3.638  14.409  -6.749
  460   1HD   LYS  63          1HD       LYS  63  -5.923  13.611  -5.146
  461   2HD   LYS  63          2HD       LYS  63  -4.736  14.474  -4.168
  462   1HE   LYS  63          1HE       LYS  63  -4.944  15.836  -6.678
  463   2HE   LYS  63          2HE       LYS  63  -6.583  15.586  -6.045
  464   1HZ   LYS  63          1HZ       LYS  63  -4.311  16.568  -4.405
  465   2HZ   LYS  63          2HZ       LYS  63  -5.945  16.483  -3.949
  466   3HZ   LYS  63          3HZ       LYS  63  -5.448  17.592  -5.137
  467    H    GLY  64           H        GLY  64  -4.724   8.849  -6.288
  468   1HA   GLY  64          1HA       GLY  64  -6.581   9.177  -4.052
  469   2HA   GLY  64          2HA       GLY  64  -6.415   7.741  -5.053
  470    H    TYR  65           H        TYR  65  -6.489   7.957  -2.124
  471    HA   TYR  65           HA       TYR  65  -3.753   7.349  -1.214
  472   1HB   TYR  65          1HB       TYR  65  -5.553   8.609   0.081
  473   2HB   TYR  65          2HB       TYR  65  -6.394   7.067   0.245
  474    HD1  TYR  65           HD1      TYR  65  -6.111   6.234   2.399
  475    HD2  TYR  65           HD2      TYR  65  -2.763   7.996   0.377
  476    HE1  TYR  65           HE1      TYR  65  -4.635   5.588   4.283
  477    HE2  TYR  65           HE2      TYR  65  -1.285   7.355   2.260
  478    HH   TYR  65           HH       TYR  65  -1.407   5.433   4.111
  479    H    TYR  66           H        TYR  66  -6.625   5.601  -2.222
  480    HA   TYR  66           HA       TYR  66  -5.589   3.061  -1.095
  481   1HB   TYR  66          1HB       TYR  66  -7.871   3.343  -0.687
  482   2HB   TYR  66          2HB       TYR  66  -8.145   4.153  -2.227
  483    HD1  TYR  66           HD1      TYR  66  -8.537   1.125  -0.459
  484    HD2  TYR  66           HD2      TYR  66  -7.653   2.686  -4.358
  485    HE1  TYR  66           HE1      TYR  66  -9.236  -1.028  -1.475
  486    HE2  TYR  66           HE2      TYR  66  -8.356   0.531  -5.382
  487    HH   TYR  66           HH       TYR  66 -10.191  -1.632  -4.024
  488    H    HIS  67           H        HIS  67  -6.171   4.680  -4.193
  489    HA   HIS  67           HA       HIS  67  -5.834   2.467  -5.951
  490   1HB   HIS  67          1HB       HIS  67  -6.621   4.520  -6.828
  491   2HB   HIS  67          2HB       HIS  67  -5.307   5.435  -6.088
  492    HD1  HIS  67           HD1      HIS  67  -5.865   2.835  -8.803
  493    HD2  HIS  67           HD2      HIS  67  -3.074   5.736  -7.727
  494    HE1  HIS  67           HE1      HIS  67  -4.130   2.875 -10.643
  495    H    ALA  68           H        ALA  68  -3.337   4.966  -5.485
  496    HA   ALA  68           HA       ALA  68  -1.136   3.634  -6.490
  497   1HB   ALA  68          1HB       ALA  68  -0.170   4.990  -4.254
  498   2HB   ALA  68          2HB       ALA  68  -1.710   5.782  -4.594
  499   3HB   ALA  68          3HB       ALA  68  -0.469   5.698  -5.843
  500    H    MET  69           H        MET  69  -2.789   2.868  -3.491
  501    HA   MET  69           HA       MET  69  -0.503   1.291  -2.484
  502   1HB   MET  69          1HB       MET  69  -3.297   1.847  -1.472
  503   2HB   MET  69          2HB       MET  69  -2.060   0.978  -0.565
  504   1HG   MET  69          1HG       MET  69  -1.024   3.470  -1.635
  505   2HG   MET  69          2HG       MET  69  -2.431   3.748  -0.612
  506   1HE   MET  69          1HE       MET  69   1.587   3.584   0.128
  507   2HE   MET  69          2HE       MET  69   0.676   4.750   1.085
  508   3HE   MET  69          3HE       MET  69   0.343   4.584  -0.637
  509    H    HIS  70           H        HIS  70  -3.857   0.650  -3.578
  510    HA   HIS  70           HA       HIS  70  -3.307  -2.251  -3.404
  511   1HB   HIS  70          1HB       HIS  70  -5.787  -0.732  -4.254
  512   2HB   HIS  70          2HB       HIS  70  -5.708  -2.424  -3.761
  513    HD1  HIS  70           HD1      HIS  70  -5.985   1.000  -2.437
  514    HD2  HIS  70           HD2      HIS  70  -5.063  -2.766  -0.922
  515    HE1  HIS  70           HE1      HIS  70  -6.160   1.184   0.080
  516    H    ASP  71           H        ASP  71  -3.408   0.279  -5.786
  517    HA   ASP  71           HA       ASP  71  -3.916  -1.485  -8.065
  518   1HB   ASP  71          1HB       ASP  71  -3.097   1.388  -7.630
  519   2HB   ASP  71          2HB       ASP  71  -3.227   0.699  -9.243
  520    H    LYS  72           H        LYS  72  -2.359  -2.773  -8.955
  521    HA   LYS  72           HA       LYS  72   0.467  -2.443  -8.229
  522   1HB   LYS  72          1HB       LYS  72   0.693  -4.569  -9.359
  523   2HB   LYS  72          2HB       LYS  72  -0.813  -4.620  -8.443
  524   1HG   LYS  72          1HG       LYS  72  -2.028  -3.911 -10.527
  525   2HG   LYS  72          2HG       LYS  72  -0.510  -4.077 -11.409
  526   1HD   LYS  72          1HD       LYS  72  -0.403  -6.420 -10.988
  527   2HD   LYS  72          2HD       LYS  72  -1.668  -6.332  -9.762
  528   1HE   LYS  72          1HE       LYS  72  -3.363  -5.895 -11.410
  529   2HE   LYS  72          2HE       LYS  72  -2.147  -5.636 -12.678
  530   1HZ   LYS  72          1HZ       LYS  72  -1.420  -7.888 -12.468
  531   2HZ   LYS  72          2HZ       LYS  72  -3.105  -7.910 -12.685
  532   3HZ   LYS  72          3HZ       LYS  72  -2.441  -8.161 -11.142
  533    H    GLY  73           H        GLY  73  -1.513  -2.210 -11.179
  534   1HA   GLY  73          1HA       GLY  73   0.725  -1.503 -12.883
  535   2HA   GLY  73          2HA       GLY  73  -0.981  -1.336 -13.304
  536    H    THR  74           H        THR  74   1.192   0.121 -10.860
  537    HA   THR  74           HA       THR  74  -0.049   2.775 -11.467
  538    HB   THR  74           HB       THR  74   1.176   3.235  -9.204
  539    HG1  THR  74           1HG      THR  74   2.342   1.578  -8.675
  540   1HG2  THR  74          1HG2      THR  74  -1.211   1.428  -9.583
  541   2HG2  THR  74          2HG2      THR  74  -1.193   3.145  -9.182
  542   3HG2  THR  74          3HG2      THR  74  -0.695   1.953  -7.980
  543    H    LYS  75           H        LYS  75   1.479   4.654 -11.396
  544    HA   LYS  75           HA       LYS  75   3.541   4.711 -13.206
  545   1HB   LYS  75          1HB       LYS  75   2.521   6.551 -11.689
  546   2HB   LYS  75          2HB       LYS  75   3.742   6.075 -10.509
  547   1HG   LYS  75          1HG       LYS  75   5.519   6.752 -11.882
  548   2HG   LYS  75          2HG       LYS  75   4.527   6.700 -13.338
  549   1HD   LYS  75          1HD       LYS  75   3.355   8.684 -12.740
  550   2HD   LYS  75          2HD       LYS  75   3.965   8.630 -11.087
  551   1HE   LYS  75          1HE       LYS  75   5.408  10.220 -11.997
  552   2HE   LYS  75          2HE       LYS  75   6.326   8.744 -12.357
  553   1HZ   LYS  75          1HZ       LYS  75   4.692  10.394 -14.142
  554   2HZ   LYS  75          2HZ       LYS  75   4.707   8.717 -14.412
  555   3HZ   LYS  75          3HZ       LYS  75   6.158   9.600 -14.450
  556    H    PHE  76           H        PHE  76   3.907   3.964  -9.742
  557    HA   PHE  76           HA       PHE  76   6.525   2.620 -10.352
  558   1HB   PHE  76          1HB       PHE  76   5.584   4.037  -7.842
  559   2HB   PHE  76          2HB       PHE  76   7.190   3.372  -8.119
  560    HD1  PHE  76           HD1      PHE  76   8.533   4.304 -10.126
  561    HD2  PHE  76           HD2      PHE  76   5.015   6.188  -8.539
  562    HE1  PHE  76           HE1      PHE  76   9.153   6.423 -11.259
  563    HE2  PHE  76           HE2      PHE  76   5.636   8.303  -9.667
  564    HZ   PHE  76           HZ       PHE  76   7.696   8.414 -11.024
  565    H    LYS  77           H        LYS  77   7.018   1.066  -8.306
  566    HA   LYS  77           HA       LYS  77   4.843  -0.867  -8.267
  567   1HB   LYS  77          1HB       LYS  77   6.385  -2.105  -6.817
  568   2HB   LYS  77          2HB       LYS  77   7.232  -1.490  -8.233
  569   1HG   LYS  77          1HG       LYS  77   7.775   0.560  -6.725
  570   2HG   LYS  77          2HG       LYS  77   7.350  -0.511  -5.391
  571   1HD   LYS  77          1HD       LYS  77   9.543  -0.876  -7.442
  572   2HD   LYS  77          2HD       LYS  77   9.708  -0.767  -5.689
  573   1HE   LYS  77          1HE       LYS  77   9.483  -3.012  -5.519
  574   2HE   LYS  77          2HE       LYS  77   7.911  -2.932  -6.337
  575   1HZ   LYS  77          1HZ       LYS  77   9.356  -2.534  -8.426
  576   2HZ   LYS  77          2HZ       LYS  77   9.170  -4.119  -7.843
  577   3HZ   LYS  77          3HZ       LYS  77  10.593  -3.251  -7.513
  578    H    SER  78           H        SER  78   3.131  -0.523  -7.069
  579    HA   SER  78           HA       SER  78   3.012   1.343  -4.843
  580   1HB   SER  78          1HB       SER  78   0.626   0.203  -4.837
  581   2HB   SER  78          2HB       SER  78   1.098   1.272  -6.156
  582    HG   SER  78           HG       SER  78   0.541  -0.467  -7.260
  583    H    CYS  79           H        CYS  79   1.676   0.486  -2.844
  584    HA   CYS  79           HA       CYS  79   3.288  -1.261  -1.297
  585   1HB   CYS  79          1HB       CYS  79   0.343  -0.564  -1.070
  586   2HB   CYS  79          2HB       CYS  79   1.359  -1.149   0.244
  587    H    VAL  80           H        VAL  80  -0.042  -1.957  -2.389
  588    HA   VAL  80           HA       VAL  80   0.237  -4.821  -2.086
  589    HB   VAL  80           HB       VAL  80  -1.699  -2.943  -3.442
  590   1HG1  VAL  80          1HG1      VAL  80  -1.368  -5.792  -3.879
  591   2HG1  VAL  80          2HG1      VAL  80  -2.454  -4.659  -4.686
  592   3HG1  VAL  80          3HG1      VAL  80  -2.948  -5.435  -3.180
  593   1HG2  VAL  80          1HG2      VAL  80  -3.193  -3.766  -1.605
  594   2HG2  VAL  80          2HG2      VAL  80  -1.743  -2.974  -0.990
  595   3HG2  VAL  80          3HG2      VAL  80  -1.853  -4.734  -0.991
  596    H    GLY  81           H        GLY  81   0.862  -2.535  -4.672
  597   1HA   GLY  81          1HA       GLY  81   0.923  -4.425  -6.849
  598   2HA   GLY  81          2HA       GLY  81   1.681  -2.832  -6.856
  599    H    CYS  82           H        CYS  82   3.415  -3.130  -4.659
  600    HA   CYS  82           HA       CYS  82   5.562  -4.720  -5.870
  601   1HB   CYS  82          1HB       CYS  82   5.740  -2.483  -4.629
  602   2HB   CYS  82          2HB       CYS  82   5.448  -3.386  -3.146
  603    H    HIS  83           H        HIS  83   3.262  -4.972  -3.264
  604    HA   HIS  83           HA       HIS  83   4.435  -7.160  -1.831
  605   1HB   HIS  83          1HB       HIS  83   1.798  -5.774  -2.099
  606   2HB   HIS  83          2HB       HIS  83   1.836  -7.299  -1.236
  607    HD1  HIS  83           HD1      HIS  83   1.418  -6.024   1.043
  608    HD2  HIS  83           HD2      HIS  83   4.957  -4.981  -0.900
  609    HE1  HIS  83           HE1      HIS  83   2.824  -4.786   2.740
  610    H    LEU  84           H        LEU  84   1.686  -7.149  -4.177
  611    HA   LEU  84           HA       LEU  84   1.341  -9.919  -4.431
  612   1HB   LEU  84          1HB       LEU  84   0.499  -7.523  -5.616
  613   2HB   LEU  84          2HB       LEU  84   1.165  -8.468  -6.944
  614    HG   LEU  84           HG       LEU  84  -0.692  -9.730  -4.950
  615   1HD1  LEU  84          1HD1      LEU  84  -2.604  -9.085  -6.205
  616   2HD1  LEU  84          2HD1      LEU  84  -1.620  -8.467  -7.532
  617   3HD1  LEU  84          3HD1      LEU  84  -1.676  -7.601  -5.997
  618   1HD2  LEU  84          1HD2      LEU  84   0.235 -11.376  -6.327
  619   2HD2  LEU  84          2HD2      LEU  84   0.322 -10.300  -7.721
  620   3HD2  LEU  84          3HD2      LEU  84  -1.230 -10.965  -7.217
  621    H    GLU  85           H        GLU  85   3.817  -7.809  -5.796
  622    HA   GLU  85           HA       GLU  85   4.912  -9.916  -7.542
  623   1HB   GLU  85          1HB       GLU  85   5.738  -7.095  -6.787
  624   2HB   GLU  85          2HB       GLU  85   6.604  -8.081  -7.967
  625   1HG   GLU  85          1HG       GLU  85   3.657  -7.398  -8.158
  626   2HG   GLU  85          2HG       GLU  85   4.933  -6.532  -9.014
  627    H    THR  86           H        THR  86   5.992  -8.085  -4.652
  628    HA   THR  86           HA       THR  86   8.445  -9.460  -4.236
  629    HB   THR  86           HB       THR  86   6.475  -7.910  -2.580
  630    HG1  THR  86           1HG      THR  86   8.269  -6.555  -2.431
  631   1HG2  THR  86          1HG2      THR  86   8.961  -9.214  -1.439
  632   2HG2  THR  86          2HG2      THR  86   7.317  -9.768  -1.124
  633   3HG2  THR  86          3HG2      THR  86   7.829  -8.170  -0.579
  634    H    ALA  87           H        ALA  87   5.208 -10.550  -3.928
  635    HA   ALA  87           HA       ALA  87   5.886 -12.713  -2.015
  636   1HB   ALA  87          1HB       ALA  87   3.469 -11.417  -3.176
  637   2HB   ALA  87          2HB       ALA  87   3.770 -11.944  -1.520
  638   3HB   ALA  87          3HB       ALA  87   3.310 -13.122  -2.750
  639    H    GLY  88           H        GLY  88   5.070 -12.219  -5.414
  640   1HA   GLY  88          1HA       GLY  88   5.222 -13.657  -7.259
  641   2HA   GLY  88          2HA       GLY  88   6.427 -14.543  -6.323
  642    H    ALA  89           H        ALA  89   5.777 -16.652  -6.576
  643    HA   ALA  89           HA       ALA  89   2.915 -17.371  -6.361
  644   1HB   ALA  89          1HB       ALA  89   5.217 -19.282  -6.576
  645   2HB   ALA  89          2HB       ALA  89   4.818 -18.254  -7.951
  646   3HB   ALA  89          3HB       ALA  89   3.621 -19.383  -7.317
  647    H    ASP  90           H        ASP  90   3.755 -16.317  -3.947
  648    HA   ASP  90           HA       ASP  90   4.107 -18.734  -2.216
  649   1HB   ASP  90          1HB       ASP  90   6.025 -17.222  -2.208
  650   2HB   ASP  90          2HB       ASP  90   4.977 -15.851  -1.854
  651    H    ALA  91           H        ALA  91   1.750 -18.889  -2.309
  652    HA   ALA  91           HA       ALA  91  -0.256 -17.119  -1.753
  653   1HB   ALA  91          1HB       ALA  91   0.335 -19.918  -0.856
  654   2HB   ALA  91          2HB       ALA  91  -0.913 -19.342  -1.962
  655   3HB   ALA  91          3HB       ALA  91  -1.105 -19.120  -0.224
  656    H    ALA  92           H        ALA  92   2.241 -18.129   0.506
  657    HA   ALA  92           HA       ALA  92   0.972 -17.012   2.882
  658   1HB   ALA  92          1HB       ALA  92   3.925 -17.268   2.708
  659   2HB   ALA  92          2HB       ALA  92   3.022 -18.741   2.350
  660   3HB   ALA  92          3HB       ALA  92   2.814 -17.934   3.905
  661    H    LYS  93           H        LYS  93   3.428 -15.977   0.556
  662    HA   LYS  93           HA       LYS  93   3.838 -13.362   1.776
  663   1HB   LYS  93          1HB       LYS  93   4.727 -14.970  -0.548
  664   2HB   LYS  93          2HB       LYS  93   4.845 -13.226  -0.742
  665   1HG   LYS  93          1HG       LYS  93   6.046 -13.157   1.482
  666   2HG   LYS  93          2HG       LYS  93   6.075 -14.921   1.442
  667   1HD   LYS  93          1HD       LYS  93   7.359 -14.906  -0.621
  668   2HD   LYS  93          2HD       LYS  93   7.225 -13.151  -0.734
  669   1HE   LYS  93          1HE       LYS  93   8.801 -12.788   0.919
  670   2HE   LYS  93          2HE       LYS  93   8.393 -14.287   1.778
  671   1HZ   LYS  93          1HZ       LYS  93  10.481 -14.586   0.651
  672   2HZ   LYS  93          2HZ       LYS  93   9.814 -14.066  -0.823
  673   3HZ   LYS  93          3HZ       LYS  93   9.305 -15.530  -0.126
  674    H    LYS  94           H        LYS  94   1.708 -14.778  -0.616
  675    HA   LYS  94           HA       LYS  94   0.891 -12.250  -1.838
  676   1HB   LYS  94          1HB       LYS  94   0.509 -15.092  -2.156
  677   2HB   LYS  94          2HB       LYS  94  -1.063 -14.289  -2.172
  678   1HG   LYS  94          1HG       LYS  94   0.452 -12.595  -3.722
  679   2HG   LYS  94          2HG       LYS  94   1.119 -14.173  -4.146
  680   1HD   LYS  94          1HD       LYS  94  -1.634 -14.607  -4.084
  681   2HD   LYS  94          2HD       LYS  94  -1.471 -13.018  -4.833
  682   1HE   LYS  94          1HE       LYS  94  -0.006 -13.884  -6.545
  683   2HE   LYS  94          2HE       LYS  94   0.125 -15.447  -5.715
  684   1HZ   LYS  94          1HZ       LYS  94  -1.595 -15.267  -7.571
  685   2HZ   LYS  94          2HZ       LYS  94  -2.497 -14.316  -6.490
  686   3HZ   LYS  94          3HZ       LYS  94  -2.115 -15.924  -6.096
  687    H    LYS  95           H        LYS  95   0.430 -13.475   1.206
  688    HA   LYS  95           HA       LYS  95  -2.289 -12.227   1.479
  689   1HB   LYS  95          1HB       LYS  95  -2.720 -14.216   2.512
  690   2HB   LYS  95          2HB       LYS  95  -1.022 -14.681   2.424
  691   1HG   LYS  95          1HG       LYS  95  -0.512 -13.596   4.483
  692   2HG   LYS  95          2HG       LYS  95  -2.049 -12.728   4.491
  693   1HD   LYS  95          1HD       LYS  95  -2.955 -15.281   4.381
  694   2HD   LYS  95          2HD       LYS  95  -1.454 -15.527   5.276
  695   1HE   LYS  95          1HE       LYS  95  -2.170 -13.662   6.833
  696   2HE   LYS  95          2HE       LYS  95  -3.747 -13.679   6.016
  697   1HZ   LYS  95          1HZ       LYS  95  -4.003 -15.991   6.521
  698   2HZ   LYS  95          2HZ       LYS  95  -3.649 -15.176   7.970
  699   3HZ   LYS  95          3HZ       LYS  95  -2.444 -16.080   7.184
  700    H    GLU  96           H        GLU  96   0.728 -12.844   3.212
  701    HA   GLU  96           HA       GLU  96   0.683 -10.838   5.155
  702   1HB   GLU  96          1HB       GLU  96   2.486 -12.618   3.741
  703   2HB   GLU  96          2HB       GLU  96   3.293 -11.114   4.149
  704   1HG   GLU  96          1HG       GLU  96   2.192 -11.471   6.500
  705   2HG   GLU  96          2HG       GLU  96   2.031 -13.144   5.961
  706    H    LEU  97           H        LEU  97   1.815 -10.691   1.786
  707    HA   LEU  97           HA       LEU  97   2.470  -7.832   1.951
  708   1HB   LEU  97          1HB       LEU  97   2.382  -9.754  -0.379
  709   2HB   LEU  97          2HB       LEU  97   3.265  -8.227  -0.301
  710    HG   LEU  97           HG       LEU  97   3.795 -10.764   1.246
  711   1HD1  LEU  97          1HD1      LEU  97   6.141 -10.150   0.379
  712   2HD1  LEU  97          2HD1      LEU  97   5.309  -9.002  -0.670
  713   3HD1  LEU  97          3HD1      LEU  97   4.967 -10.726  -0.804
  714   1HD2  LEU  97          1HD2      LEU  97   5.546  -9.387   2.447
  715   2HD2  LEU  97          2HD2      LEU  97   3.886  -8.996   2.896
  716   3HD2  LEU  97          3HD2      LEU  97   4.771  -7.945   1.791
  717    H    THR  98           H        THR  98   0.409  -9.647  -0.346
  718    HA   THR  98           HA       THR  98  -1.160  -7.196  -0.816
  719    HB   THR  98           HB       THR  98  -2.244  -8.729  -2.523
  720    HG1  THR  98           1HG      THR  98  -1.873 -10.700  -1.601
  721   1HG2  THR  98          1HG2      THR  98  -0.584  -8.179  -3.977
  722   2HG2  THR  98          2HG2      THR  98   0.652  -8.992  -3.016
  723   3HG2  THR  98          3HG2      THR  98   0.124  -7.368  -2.581
  724    H    GLY  99           H        GLY  99  -1.443 -10.061   1.096
  725   1HA   GLY  99          1HA       GLY  99  -4.211 -10.483   1.176
  726   2HA   GLY  99          2HA       GLY  99  -3.161 -10.679   2.581
  727    H    CYS 100           H        CYS 100  -5.870  -9.173   1.737
  728    HA   CYS 100           HA       CYS 100  -5.336  -6.481   2.738
  729   1HB   CYS 100          1HB       CYS 100  -8.095  -7.468   2.796
  730   2HB   CYS 100          2HB       CYS 100  -7.445  -6.067   1.990
  731    H    LYS 101           H        LYS 101  -7.520  -9.027   3.931
  732    HA   LYS 101           HA       LYS 101  -7.137  -7.940   6.670
  733   1HB   LYS 101          1HB       LYS 101  -9.127  -9.469   7.103
  734   2HB   LYS 101          2HB       LYS 101  -9.417  -8.190   5.924
  735   1HG   LYS 101          1HG       LYS 101  -9.657  -9.658   4.207
  736   2HG   LYS 101          2HG       LYS 101  -8.328 -10.674   4.769
  737   1HD   LYS 101          1HD       LYS 101  -9.779 -11.647   6.498
  738   2HD   LYS 101          2HD       LYS 101 -11.110 -10.613   5.976
  739   1HE   LYS 101          1HE       LYS 101 -11.032 -11.672   3.722
  740   2HE   LYS 101          2HE       LYS 101  -9.751 -12.757   4.302
  741   1HZ   LYS 101          1HZ       LYS 101 -12.509 -12.499   5.370
  742   2HZ   LYS 101          2HZ       LYS 101 -11.274 -13.355   6.162
  743   3HZ   LYS 101          3HZ       LYS 101 -11.819 -13.863   4.635
  744    H    GLY 102           H        GLY 102  -5.517  -8.918   7.824
  745   1HA   GLY 102          1HA       GLY 102  -4.843 -10.950   9.052
  746   2HA   GLY 102          2HA       GLY 102  -5.263 -11.888   7.618
  747    H    SER 103           H        SER 103  -3.880  -9.287   6.299
  748    HA   SER 103           HA       SER 103  -1.341 -10.655   5.821
  749   1HB   SER 103          1HB       SER 103  -1.004  -8.722   4.320
  750   2HB   SER 103          2HB       SER 103  -2.602  -9.419   4.097
  751    HG   SER 103           HG       SER 103  -3.190  -7.415   4.442
  752    H    LYS 104           H        LYS 104   0.229  -8.233   5.599
  753    HA   LYS 104           HA       LYS 104   0.933  -7.832   8.474
  754   1HB   LYS 104          1HB       LYS 104   2.321  -7.445   5.807
  755   2HB   LYS 104          2HB       LYS 104   3.046  -6.978   7.345
  756   1HG   LYS 104          1HG       LYS 104   2.005  -9.682   7.487
  757   2HG   LYS 104          2HG       LYS 104   3.150  -9.521   6.155
  758   1HD   LYS 104          1HD       LYS 104   4.918  -8.996   7.553
  759   2HD   LYS 104          2HD       LYS 104   3.870  -8.295   8.787
  760   1HE   LYS 104          1HE       LYS 104   3.065 -10.562   9.391
  761   2HE   LYS 104          2HE       LYS 104   4.148 -11.260   8.171
  762   1HZ   LYS 104          1HZ       LYS 104   5.371 -11.274  10.166
  763   2HZ   LYS 104          2HZ       LYS 104   4.878  -9.704  10.586
  764   3HZ   LYS 104          3HZ       LYS 104   5.963  -9.941   9.300
  765    H    CYS 105           H        CYS 105  -0.113  -6.303   5.556
  766    HA   CYS 105           HA       CYS 105   0.381  -3.558   6.377
  767   1HB   CYS 105          1HB       CYS 105  -0.065  -5.015   4.070
  768   2HB   CYS 105          2HB       CYS 105  -1.569  -4.149   4.274
  769    H    HIS 106           H        HIS 106  -2.260  -5.849   6.694
  770    HA   HIS 106           HA       HIS 106  -3.964  -3.667   7.863
  771   1HB   HIS 106          1HB       HIS 106  -4.469  -5.970   6.032
  772   2HB   HIS 106          2HB       HIS 106  -5.760  -5.521   7.148
  773    HD1  HIS 106           HD1      HIS 106  -5.128  -2.427   7.120
  774    HD2  HIS 106           HD2      HIS 106  -5.655  -4.805   3.716
  775    HE1  HIS 106           HE1      HIS 106  -5.693  -0.847   5.230
  776    H    SER 107           H        SER 107  -2.401  -4.589   9.755
  777    HA   SER 107           HA       SER 107  -2.945  -7.124  10.945
  778   1HB   SER 107          1HB       SER 107  -1.099  -5.379  11.381
  779   2HB   SER 107          2HB       SER 107  -2.273  -4.563  12.408
  780    HG   SER 107           HG       SER 107  -0.803  -6.218  13.380
  781    HHA  HEC 201           HHA      HEC 201   5.978   8.682   5.704
  782    HHB  HEC 201           HHB      HEC 201  12.074   9.826   4.812
  783    HHC  HEC 201           HHC      HEC 201  12.535   4.807   1.045
  784    HHD  HEC 201           HHD      HEC 201   6.403   3.668   1.803
  785   1HMA  HEC 201          1HMA      HEC 201  11.288  10.723   6.933
  786   2HMA  HEC 201          2HMA      HEC 201   9.811  10.822   7.898
  787   3HMA  HEC 201          3HMA      HEC 201  10.101  11.985   6.603
  788   1HAA  HEC 201          1HAA      HEC 201   6.456   9.883   7.214
  789   2HAA  HEC 201          2HAA      HEC 201   7.752  10.934   7.778
  790   1HBA  HEC 201          1HBA      HEC 201   6.658  11.539   5.088
  791   2HBA  HEC 201          2HBA      HEC 201   5.587  11.858   6.454
  792   1HMB  HEC 201          1HMB      HEC 201  13.991   9.662   4.424
  793   2HMB  HEC 201          2HMB      HEC 201  15.071   8.270   4.485
  794   3HMB  HEC 201          3HMB      HEC 201  14.941   9.221   3.005
  795    HAB  HEC 201           HAB      HEC 201  14.385   5.568   1.207
  796   1HBB  HEC 201          1HBB      HEC 201  15.276   4.902   3.363
  797   2HBB  HEC 201          2HBB      HEC 201  15.818   6.548   3.694
  798   3HBB  HEC 201          3HBB      HEC 201  16.591   5.604   2.419
  799   1HMC  HEC 201          1HMC      HEC 201  11.743   3.234  -0.641
  800   2HMC  HEC 201          2HMC      HEC 201  11.922   2.138   0.729
  801   3HMC  HEC 201          3HMC      HEC 201  10.672   1.843  -0.480
  802    HAC  HEC 201           HAC      HEC 201   7.053   2.307   0.654
  803   1HBC  HEC 201          1HBC      HEC 201   9.619   0.776   0.626
  804   2HBC  HEC 201          2HBC      HEC 201   8.297   0.199  -0.390
  805   3HBC  HEC 201          3HBC      HEC 201   8.068   0.351   1.351
  806   1HMD  HEC 201          1HMD      HEC 201   4.349   3.519   4.081
  807   2HMD  HEC 201          2HMD      HEC 201   3.189   4.789   3.685
  808   3HMD  HEC 201          3HMD      HEC 201   4.120   4.021   2.404
  809   1HAD  HEC 201          1HAD      HEC 201   4.169   7.964   5.557
  810   2HAD  HEC 201          2HAD      HEC 201   3.165   7.353   4.246
  811   1HBD  HEC 201          1HBD      HEC 201   2.783   5.283   5.381
  812   2HBD  HEC 201          2HBD      HEC 201   4.040   5.628   6.569
  813    HHA  HEC 202           HHA      HEC 202   1.558   7.771  -9.426
  814    HHB  HEC 202           HHB      HEC 202   2.845   4.197  -4.823
  815    HHC  HEC 202           HHC      HEC 202   4.359   9.003  -1.114
  816    HHD  HEC 202           HHD      HEC 202   2.828  12.997  -5.708
  817   1HMA  HEC 202          1HMA      HEC 202   1.227   3.238  -5.798
  818   2HMA  HEC 202          2HMA      HEC 202   2.096   2.921  -7.298
  819   3HMA  HEC 202          3HMA      HEC 202   0.379   3.317  -7.340
  820   1HAA  HEC 202          1HAA      HEC 202   1.071   5.503  -9.975
  821   2HAA  HEC 202          2HAA      HEC 202   0.018   4.519  -8.995
  822   1HBA  HEC 202          1HBA      HEC 202  -1.345   6.493  -8.460
  823   2HBA  HEC 202          2HBA      HEC 202  -0.289   7.485  -9.464
  824   1HMB  HEC 202          1HMB      HEC 202   2.939   3.532  -2.442
  825   2HMB  HEC 202          2HMB      HEC 202   4.603   3.470  -3.026
  826   3HMB  HEC 202          3HMB      HEC 202   4.275   3.836  -1.331
  827    HAB  HEC 202           HAB      HEC 202   4.125   7.080   0.178
  828   1HBB  HEC 202          1HBB      HEC 202   6.524   6.363  -1.044
  829   2HBB  HEC 202          2HBB      HEC 202   6.169   4.995   0.012
  830   3HBB  HEC 202          3HBB      HEC 202   6.290   6.621   0.685
  831   1HMC  HEC 202          1HMC      HEC 202   5.493  12.723  -1.350
  832   2HMC  HEC 202          2HMC      HEC 202   4.075  12.151  -0.470
  833   3HMC  HEC 202          3HMC      HEC 202   5.420  11.054  -0.782
  834    HAC  HEC 202           HAC      HEC 202   2.591  14.052  -3.628
  835   1HBC  HEC 202          1HBC      HEC 202   5.369  14.569  -2.597
  836   2HBC  HEC 202          2HBC      HEC 202   4.097  14.049  -1.493
  837   3HBC  HEC 202          3HBC      HEC 202   3.918  15.549  -2.403
  838   1HMD  HEC 202          1HMD      HEC 202   1.098  13.476  -8.269
  839   2HMD  HEC 202          2HMD      HEC 202   2.017  13.021  -9.705
  840   3HMD  HEC 202          3HMD      HEC 202   2.859  13.579  -8.259
  841   1HAD  HEC 202          1HAD      HEC 202   1.923   9.284 -10.647
  842   2HAD  HEC 202          2HAD      HEC 202   1.093  10.824 -10.824
  843   1HBD  HEC 202          1HBD      HEC 202   3.349  11.947 -10.584
  844   2HBD  HEC 202          2HBD      HEC 202   4.070  10.342 -10.690
  845    HHA  HEC 203           HHA      HEC 203   7.169  -6.912   4.676
  846    HHB  HEC 203           HHB      HEC 203   2.864  -2.055   4.895
  847    HHC  HEC 203           HHC      HEC 203   4.819  -0.075  -0.526
  848    HHD  HEC 203           HHD      HEC 203   9.116  -4.660  -0.858
  849   1HMA  HEC 203          1HMA      HEC 203   2.262  -3.857   6.491
  850   2HMA  HEC 203          2HMA      HEC 203   3.551  -3.375   7.595
  851   3HMA  HEC 203          3HMA      HEC 203   3.074  -5.069   7.484
  852   1HAA  HEC 203          1HAA      HEC 203   4.853  -6.135   7.730
  853   2HAA  HEC 203          2HAA      HEC 203   4.652  -7.334   6.459
  854   1HBA  HEC 203          1HBA      HEC 203   6.876  -7.812   6.382
  855   2HBA  HEC 203          2HBA      HEC 203   7.345  -6.127   6.610
  856   1HMB  HEC 203          1HMB      HEC 203   1.247   0.274   3.492
  857   2HMB  HEC 203          2HMB      HEC 203   2.151  -0.293   4.896
  858   3HMB  HEC 203          3HMB      HEC 203   2.527   1.273   4.179
  859    HAB  HEC 203           HAB      HEC 203   2.880   0.776   0.033
  860   1HBB  HEC 203          1HBB      HEC 203   4.642   2.273   0.056
  861   2HBB  HEC 203          2HBB      HEC 203   4.646   2.401   1.816
  862   3HBB  HEC 203          3HBB      HEC 203   3.434   3.272   0.869
  863   1HMC  HEC 203          1HMC      HEC 203   5.704   0.105  -2.310
  864   2HMC  HEC 203          2HMC      HEC 203   7.429   0.160  -2.679
  865   3HMC  HEC 203          3HMC      HEC 203   6.372  -0.934  -3.571
  866    HAC  HEC 203           HAC      HEC 203   9.351  -3.616  -2.502
  867   1HBC  HEC 203          1HBC      HEC 203   8.370  -1.502  -4.365
  868   2HBC  HEC 203          2HBC      HEC 203  10.022  -2.015  -4.030
  869   3HBC  HEC 203          3HBC      HEC 203   9.181  -0.954  -2.900
  870   1HMD  HEC 203          1HMD      HEC 203  10.066  -7.881   0.290
  871   2HMD  HEC 203          2HMD      HEC 203  11.111  -6.743   1.141
  872   3HMD  HEC 203          3HMD      HEC 203  10.332  -6.266  -0.369
  873   1HAD  HEC 203          1HAD      HEC 203  10.181  -8.055   3.128
  874   2HAD  HEC 203          2HAD      HEC 203   8.861  -7.924   4.285
  875   1HBD  HEC 203          1HBD      HEC 203   7.621  -9.084   2.112
  876   2HBD  HEC 203          2HBD      HEC 203   9.225  -9.815   2.070
  877    HHA  HEC 204           HHA      HEC 204  -6.718   2.278   3.867
  878    HHB  HEC 204           HHB      HEC 204  -9.943  -2.196   0.890
  879    HHC  HEC 204           HHC      HEC 204  -4.671  -5.861   0.940
  880    HHD  HEC 204           HHD      HEC 204  -1.378  -0.892   2.757
  881   1HMA  HEC 204          1HMA      HEC 204 -11.317  -0.824   1.478
  882   2HMA  HEC 204          2HMA      HEC 204 -11.066   0.867   1.043
  883   3HMA  HEC 204          3HMA      HEC 204 -11.592   0.443   2.673
  884   1HAA  HEC 204          1HAA      HEC 204 -10.071   2.112   4.272
  885   2HAA  HEC 204          2HAA      HEC 204  -8.542   2.887   3.856
  886   1HBA  HEC 204          1HBA      HEC 204  -9.350   3.252   1.551
  887   2HBA  HEC 204          2HBA      HEC 204 -10.867   2.464   1.963
  888   1HMB  HEC 204          1HMB      HEC 204 -10.080  -5.544  -0.121
  889   2HMB  HEC 204          2HMB      HEC 204  -9.552  -4.727  -1.592
  890   3HMB  HEC 204          3HMB      HEC 204 -10.390  -3.821  -0.332
  891    HAB  HEC 204           HAB      HEC 204  -6.299  -6.939   0.268
  892   1HBB  HEC 204          1HBB      HEC 204  -5.573  -6.321  -1.876
  893   2HBB  HEC 204          2HBB      HEC 204  -7.181  -5.786  -2.370
  894   3HBB  HEC 204          3HBB      HEC 204  -6.836  -7.508  -2.203
  895   1HMC  HEC 204          1HMC      HEC 204  -1.429  -5.898   0.433
  896   2HMC  HEC 204          2HMC      HEC 204  -1.427  -6.145   2.179
  897   3HMC  HEC 204          3HMC      HEC 204  -2.861  -6.544   1.232
  898    HAC  HEC 204           HAC      HEC 204  -0.276  -2.386   2.943
  899   1HBC  HEC 204          1HBC      HEC 204   0.354  -2.684   0.496
  900   2HBC  HEC 204          2HBC      HEC 204   0.548  -4.404   0.828
  901   3HBC  HEC 204          3HBC      HEC 204   1.579  -3.227   1.642
  902   1HMD  HEC 204          1HMD      HEC 204  -1.157   1.227   4.615
  903   2HMD  HEC 204          2HMD      HEC 204  -0.883   1.427   2.884
  904   3HMD  HEC 204          3HMD      HEC 204  -1.542   2.760   3.833
  905   1HAD  HEC 204          1HAD      HEC 204  -3.609   3.920   3.714
  906   2HAD  HEC 204          2HAD      HEC 204  -5.270   3.547   4.163
  907   1HBD  HEC 204          1HBD      HEC 204  -4.056   2.288   6.174
  908   2HBD  HEC 204          2HBD      HEC 204  -2.795   3.468   5.823
  Start of MODEL   13
    1   1H    ALA   1          1H        ALA   1  19.823  15.469   2.270
    2   2H    ALA   1          2H        ALA   1  21.202  14.658   1.699
    3   3H    ALA   1          3H        ALA   1  20.767  14.551   3.337
    4    HA   ALA   1           HA       ALA   1  19.199  13.453   1.057
    5   1HB   ALA   1          1HB       ALA   1  21.381  12.522   2.809
    6   2HB   ALA   1          2HB       ALA   1  20.857  11.899   1.245
    7   3HB   ALA   1          3HB       ALA   1  20.014  11.413   2.716
    8    HA   PRO   2           HA       PRO   2  15.855  13.384   3.907
    9   1HB   PRO   2          1HB       PRO   2  14.541  11.129   3.084
   10   2HB   PRO   2          2HB       PRO   2  14.529  12.642   2.165
   11   1HG   PRO   2          1HG       PRO   2  16.126  10.176   1.725
   12   2HG   PRO   2          2HG       PRO   2  15.389  11.267   0.543
   13   1HD   PRO   2          1HD       PRO   2  18.050  11.280   1.167
   14   2HD   PRO   2          2HD       PRO   2  17.168  12.702   0.564
   15    H    LYS   3           H        LYS   3  15.680  12.650   6.007
   16    HA   LYS   3           HA       LYS   3  17.245  10.246   6.779
   17   1HB   LYS   3          1HB       LYS   3  15.742  12.287   8.428
   18   2HB   LYS   3          2HB       LYS   3  16.916  11.116   9.022
   19   1HG   LYS   3          1HG       LYS   3  18.145  12.543   6.885
   20   2HG   LYS   3          2HG       LYS   3  17.412  13.732   7.963
   21   1HD   LYS   3          1HD       LYS   3  18.923  11.481   9.215
   22   2HD   LYS   3          2HD       LYS   3  19.856  12.751   8.422
   23   1HE   LYS   3          1HE       LYS   3  19.445  14.210  10.112
   24   2HE   LYS   3          2HE       LYS   3  17.708  13.847  10.082
   25   1HZ   LYS   3          1HZ       LYS   3  19.522  11.772  11.059
   26   2HZ   LYS   3          2HZ       LYS   3  17.932  12.133  11.539
   27   3HZ   LYS   3          3HZ       LYS   3  19.226  13.089  12.085
   28    H    ALA   4           H        ALA   4  15.759   8.696   5.887
   29    HA   ALA   4           HA       ALA   4  13.040   8.370   6.142
   30   1HB   ALA   4          1HB       ALA   4  13.559   6.240   5.528
   31   2HB   ALA   4          2HB       ALA   4  14.547   5.981   6.966
   32   3HB   ALA   4          3HB       ALA   4  15.235   6.790   5.558
   33    HA   PRO   5           HA       PRO   5  12.358   8.470  10.495
   34   1HB   PRO   5          1HB       PRO   5   9.725   7.716  10.454
   35   2HB   PRO   5          2HB       PRO   5  10.286   9.342  10.033
   36   1HG   PRO   5          1HG       PRO   5   9.370   7.151   8.273
   37   2HG   PRO   5          2HG       PRO   5   9.290   8.901   8.046
   38   1HD   PRO   5          1HD       PRO   5  11.135   7.188   6.843
   39   2HD   PRO   5          2HD       PRO   5  11.265   8.954   6.945
   40    H    ALA   6           H        ALA   6  11.737   6.957  12.240
   41    HA   ALA   6           HA       ALA   6  12.898   4.398  12.006
   42   1HB   ALA   6          1HB       ALA   6  10.924   5.689  13.891
   43   2HB   ALA   6          2HB       ALA   6  12.642   5.385  14.147
   44   3HB   ALA   6          3HB       ALA   6  11.499   4.043  14.158
   45    H    ASP   7           H        ASP   7  11.419   2.404  12.734
   46    HA   ASP   7           HA       ASP   7   9.516   1.958  10.529
   47   1HB   ASP   7          1HB       ASP   7  10.328   0.098  12.771
   48   2HB   ASP   7          2HB       ASP   7   9.802  -0.324  11.146
   49    H    GLY   8           H        GLY   8   7.376   1.026  11.051
   50   1HA   GLY   8          1HA       GLY   8   5.543   0.621  12.573
   51   2HA   GLY   8          2HA       GLY   8   6.360   1.619  13.773
   52    H    LEU   9           H        LEU   9   6.361   2.961  10.624
   53    HA   LEU   9           HA       LEU   9   4.897   5.289  11.397
   54   1HB   LEU   9          1HB       LEU   9   6.387   4.370   9.215
   55   2HB   LEU   9          2HB       LEU   9   4.778   4.666   8.552
   56    HG   LEU   9           HG       LEU   9   5.794   6.730  10.416
   57   1HD1  LEU   9          1HD1      LEU   9   6.981   7.700   8.240
   58   2HD1  LEU   9          2HD1      LEU   9   7.149   5.987   7.849
   59   3HD1  LEU   9          3HD1      LEU   9   7.849   6.626   9.337
   60   1HD2  LEU   9          1HD2      LEU   9   4.784   8.203   8.681
   61   2HD2  LEU   9          2HD2      LEU   9   3.646   6.975   9.249
   62   3HD2  LEU   9          3HD2      LEU   9   4.455   6.781   7.692
   63    H    LYS  10           H        LYS  10   2.738   5.415  11.778
   64    HA   LYS  10           HA       LYS  10   0.979   3.284  10.678
   65   1HB   LYS  10          1HB       LYS  10   1.019   5.135  12.986
   66   2HB   LYS  10          2HB       LYS  10  -0.573   4.782  12.313
   67   1HG   LYS  10          1HG       LYS  10   0.173   2.302  12.374
   68   2HG   LYS  10          2HG       LYS  10   1.439   2.859  13.472
   69   1HD   LYS  10          1HD       LYS  10  -0.214   3.757  15.011
   70   2HD   LYS  10          2HD       LYS  10  -1.519   3.379  13.884
   71   1HE   LYS  10          1HE       LYS  10  -0.700   0.926  14.046
   72   2HE   LYS  10          2HE       LYS  10   0.177   1.464  15.493
   73   1HZ   LYS  10          1HZ       LYS  10  -1.750   2.044  16.566
   74   2HZ   LYS  10          2HZ       LYS  10  -2.291   0.693  15.688
   75   3HZ   LYS  10          3HZ       LYS  10  -2.628   2.262  15.131
   76    H    MET  11           H        MET  11   0.234   3.800   8.681
   77    HA   MET  11           HA       MET  11  -0.407   6.582   7.930
   78   1HB   MET  11          1HB       MET  11  -1.181   5.267   5.810
   79   2HB   MET  11          2HB       MET  11   0.541   5.288   6.182
   80   1HG   MET  11          1HG       MET  11  -0.914   3.113   7.506
   81   2HG   MET  11          2HG       MET  11  -0.965   3.023   5.749
   82   1HE   MET  11          1HE       MET  11   1.557   4.023   4.521
   83   2HE   MET  11          2HE       MET  11   0.745   2.481   4.262
   84   3HE   MET  11          3HE       MET  11   2.487   2.518   4.528
   85    H    ASP  12           H        ASP  12  -2.190   7.169   9.211
   86    HA   ASP  12           HA       ASP  12  -4.568   5.359   9.188
   87   1HB   ASP  12          1HB       ASP  12  -5.279   7.093  10.967
   88   2HB   ASP  12          2HB       ASP  12  -3.939   6.023  11.357
   89    H    LYS  13           H        LYS  13  -3.619   7.272   6.981
   90    HA   LYS  13           HA       LYS  13  -5.229   9.535   6.672
   91   1HB   LYS  13          1HB       LYS  13  -4.294   7.373   4.776
   92   2HB   LYS  13          2HB       LYS  13  -5.073   8.845   4.209
   93   1HG   LYS  13          1HG       LYS  13  -2.605   8.786   5.969
   94   2HG   LYS  13          2HG       LYS  13  -2.571   8.999   4.218
   95   1HD   LYS  13          1HD       LYS  13  -3.928  11.035   4.416
   96   2HD   LYS  13          2HD       LYS  13  -4.025  10.815   6.163
   97   1HE   LYS  13          1HE       LYS  13  -1.616  11.109   6.391
   98   2HE   LYS  13          2HE       LYS  13  -1.428  11.182   4.627
   99   1HZ   LYS  13          1HZ       LYS  13  -1.577  13.410   5.414
  100   2HZ   LYS  13          2HZ       LYS  13  -2.948  13.060   6.354
  101   3HZ   LYS  13          3HZ       LYS  13  -3.052  13.052   4.658
  102    H    THR  14           H        THR  14  -6.085   6.141   6.374
  103    HA   THR  14           HA       THR  14  -8.928   6.918   5.785
  104    HB   THR  14           HB       THR  14  -9.017   4.545   4.883
  105    HG1  THR  14           1HG      THR  14  -7.364   3.436   5.562
  106   1HG2  THR  14          1HG2      THR  14  -6.828   6.028   3.474
  107   2HG2  THR  14          2HG2      THR  14  -8.421   6.773   3.607
  108   3HG2  THR  14          3HG2      THR  14  -8.241   5.215   2.801
  109    H    LYS  15           H        LYS  15 -10.419   4.952   6.579
  110    HA   LYS  15           HA       LYS  15 -10.341   4.910   9.447
  111   1HB   LYS  15          1HB       LYS  15 -11.914   3.796   7.210
  112   2HB   LYS  15          2HB       LYS  15 -11.961   2.822   8.680
  113   1HG   LYS  15          1HG       LYS  15 -13.388   4.281   9.621
  114   2HG   LYS  15          2HG       LYS  15 -12.211   5.579   9.416
  115   1HD   LYS  15          1HD       LYS  15 -12.995   5.850   7.053
  116   2HD   LYS  15          2HD       LYS  15 -14.253   4.658   7.376
  117   1HE   LYS  15          1HE       LYS  15 -15.216   6.082   9.120
  118   2HE   LYS  15          2HE       LYS  15 -13.906   7.261   8.908
  119   1HZ   LYS  15          1HZ       LYS  15 -14.564   7.677   6.696
  120   2HZ   LYS  15          2HZ       LYS  15 -15.996   7.725   7.609
  121   3HZ   LYS  15          3HZ       LYS  15 -15.628   6.357   6.671
  122    H    GLN  16           H        GLN  16  -8.889   2.893   7.008
  123    HA   GLN  16           HA       GLN  16  -8.194   0.810   9.035
  124   1HB   GLN  16          1HB       GLN  16  -8.468   0.982   6.057
  125   2HB   GLN  16          2HB       GLN  16  -7.347  -0.211   6.716
  126   1HG   GLN  16          1HG       GLN  16  -9.538  -0.564   8.331
  127   2HG   GLN  16          2HG       GLN  16 -10.294  -0.165   6.788
  128   1HE2  GLN  16          2HE2      GLN  16  -8.221  -1.313   5.085
  129   2HE2  GLN  16          1HE2      GLN  16  -8.294  -2.999   5.269
  130    HA   PRO  17           HA       PRO  17  -4.426   3.453   8.673
  131   1HB   PRO  17          1HB       PRO  17  -3.683   3.112  11.293
  132   2HB   PRO  17          2HB       PRO  17  -4.811   4.375  10.756
  133   1HG   PRO  17          1HG       PRO  17  -5.396   1.712  11.971
  134   2HG   PRO  17          2HG       PRO  17  -6.143   3.286  12.295
  135   1HD   PRO  17          1HD       PRO  17  -7.330   1.438  10.735
  136   2HD   PRO  17          2HD       PRO  17  -7.497   3.183  10.428
  137    H    VAL  18           H        VAL  18  -2.386   2.638   8.252
  138    HA   VAL  18           HA       VAL  18  -1.870  -0.225   8.969
  139    HB   VAL  18           HB       VAL  18  -1.426   1.426   6.478
  140   1HG1  VAL  18          1HG1      VAL  18  -0.224  -1.280   7.135
  141   2HG1  VAL  18          2HG1      VAL  18   0.672   0.234   7.002
  142   3HG1  VAL  18          3HG1      VAL  18  -0.115  -0.453   5.582
  143   1HG2  VAL  18          1HG2      VAL  18  -2.384  -1.005   5.720
  144   2HG2  VAL  18          2HG2      VAL  18  -3.422   0.363   6.125
  145   3HG2  VAL  18          3HG2      VAL  18  -3.089  -0.880   7.333
  146    H    VAL  19           H        VAL  19   0.313  -0.732   9.524
  147    HA   VAL  19           HA       VAL  19   1.965   1.609  10.352
  148    HB   VAL  19           HB       VAL  19   1.813  -1.323  11.081
  149   1HG1  VAL  19          1HG1      VAL  19   4.039   0.614  11.417
  150   2HG1  VAL  19          2HG1      VAL  19   4.081  -1.147  11.345
  151   3HG1  VAL  19          3HG1      VAL  19   3.616  -0.336  12.840
  152   1HG2  VAL  19          1HG2      VAL  19   1.122  -0.526  13.212
  153   2HG2  VAL  19          2HG2      VAL  19   0.248   0.475  12.053
  154   3HG2  VAL  19          3HG2      VAL  19   1.678   1.110  12.867
  155    H    PHE  20           H        PHE  20   3.477   2.168   8.771
  156    HA   PHE  20           HA       PHE  20   4.564   0.044   7.003
  157   1HB   PHE  20          1HB       PHE  20   3.783   2.192   6.053
  158   2HB   PHE  20          2HB       PHE  20   4.950   3.058   7.050
  159    HD1  PHE  20           HD1      PHE  20   4.920   0.088   4.758
  160    HD2  PHE  20           HD2      PHE  20   6.955   3.654   6.009
  161    HE1  PHE  20           HE1      PHE  20   6.683  -0.320   3.064
  162    HE2  PHE  20           HE2      PHE  20   8.710   3.246   4.313
  163    HZ   PHE  20           HZ       PHE  20   8.578   1.260   2.841
  164    H    ASN  21           H        ASN  21   6.400  -0.984   7.655
  165    HA   ASN  21           HA       ASN  21   8.198   0.323   9.616
  166   1HB   ASN  21          1HB       ASN  21   7.252  -2.315   8.924
  167   2HB   ASN  21          2HB       ASN  21   9.007  -2.281   8.882
  168   1HD2  ASN  21          2HD2      ASN  21   8.884  -3.687  10.883
  169   2HD2  ASN  21          1HD2      ASN  21   8.621  -2.945  12.387
  170    H    HIS  22           H        HIS  22   9.409   1.790   8.277
  171    HA   HIS  22           HA       HIS  22  10.377   1.408   5.684
  172   1HB   HIS  22          1HB       HIS  22  11.344   2.813   8.152
  173   2HB   HIS  22          2HB       HIS  22  12.397   2.776   6.740
  174    HD1  HIS  22           HD1      HIS  22   9.602   4.596   8.169
  175    HD2  HIS  22           HD2      HIS  22  10.951   3.831   4.295
  176    HE1  HIS  22           HE1      HIS  22   8.562   6.362   6.687
  177    H    SER  23           H        SER  23  11.599   0.067   8.723
  178    HA   SER  23           HA       SER  23  14.120  -0.909   7.991
  179   1HB   SER  23          1HB       SER  23  11.995  -1.495   9.906
  180   2HB   SER  23          2HB       SER  23  12.898  -2.942   9.474
  181    HG   SER  23           HG       SER  23  13.851  -0.499  10.540
  182    H    THR  24           H        THR  24  10.923  -2.359   7.356
  183    HA   THR  24           HA       THR  24  12.021  -4.666   5.948
  184    HB   THR  24           HB       THR  24   9.262  -4.039   5.348
  185    HG1  THR  24           1HG      THR  24   8.677  -4.100   7.657
  186   1HG2  THR  24          1HG2      THR  24  10.899  -6.196   6.298
  187   2HG2  THR  24          2HG2      THR  24   9.271  -6.267   5.624
  188   3HG2  THR  24          3HG2      THR  24   9.498  -6.032   7.357
  189    H    HIS  25           H        HIS  25  11.919  -1.463   5.128
  190    HA   HIS  25           HA       HIS  25  11.621  -2.082   2.220
  191   1HB   HIS  25          1HB       HIS  25  10.854   0.358   3.846
  192   2HB   HIS  25          2HB       HIS  25  10.668   0.204   2.103
  193    HD1  HIS  25           HD1      HIS  25   9.293  -1.061   5.347
  194    HD2  HIS  25           HD2      HIS  25   8.606  -1.599   1.273
  195    HE1  HIS  25           HE1      HIS  25   7.136  -2.371   5.155
  196    H    LYS  26           H        LYS  26  13.688  -0.941   4.688
  197    HA   LYS  26           HA       LYS  26  15.218   1.100   3.539
  198   1HB   LYS  26          1HB       LYS  26  16.125  -1.370   5.060
  199   2HB   LYS  26          2HB       LYS  26  17.063   0.114   4.890
  200   1HG   LYS  26          1HG       LYS  26  15.066   1.334   5.912
  201   2HG   LYS  26          2HG       LYS  26  14.431  -0.258   6.328
  202   1HD   LYS  26          1HD       LYS  26  16.179  -0.714   7.819
  203   2HD   LYS  26          2HD       LYS  26  17.248   0.478   7.079
  204   1HE   LYS  26          1HE       LYS  26  15.424   2.207   7.864
  205   2HE   LYS  26          2HE       LYS  26  14.975   0.919   9.000
  206   1HZ   LYS  26          1HZ       LYS  26  17.744   1.916   8.587
  207   2HZ   LYS  26          2HZ       LYS  26  17.244   0.764   9.730
  208   3HZ   LYS  26          3HZ       LYS  26  16.744   2.381   9.875
  209    H    ALA  27           H        ALA  27  15.046  -2.297   2.665
  210    HA   ALA  27           HA       ALA  27  17.380  -2.166   0.871
  211   1HB   ALA  27          1HB       ALA  27  15.248  -4.239   1.478
  212   2HB   ALA  27          2HB       ALA  27  16.894  -4.200   2.110
  213   3HB   ALA  27          3HB       ALA  27  16.614  -4.526   0.400
  214    H    VAL  28           H        VAL  28  14.210  -1.110   0.693
  215    HA   VAL  28           HA       VAL  28  13.707  -1.840  -2.119
  216    HB   VAL  28           HB       VAL  28  12.325  -0.182  -0.006
  217   1HG1  VAL  28          1HG1      VAL  28  11.472  -0.672  -2.867
  218   2HG1  VAL  28          2HG1      VAL  28  11.869   0.886  -2.144
  219   3HG1  VAL  28          3HG1      VAL  28  10.437   0.008  -1.613
  220   1HG2  VAL  28          1HG2      VAL  28  10.703  -1.963  -0.015
  221   2HG2  VAL  28          2HG2      VAL  28  12.296  -2.714   0.088
  222   3HG2  VAL  28          3HG2      VAL  28  11.431  -2.687  -1.450
  223    H    LYS  29           H        LYS  29  13.007   0.178  -3.526
  224    HA   LYS  29           HA       LYS  29  15.335   2.003  -3.505
  225   1HB   LYS  29          1HB       LYS  29  13.560   0.824  -5.427
  226   2HB   LYS  29          2HB       LYS  29  13.521   2.581  -5.589
  227   1HG   LYS  29          1HG       LYS  29  15.341   2.003  -6.943
  228   2HG   LYS  29          2HG       LYS  29  16.112   2.417  -5.410
  229   1HD   LYS  29          1HD       LYS  29  15.448  -0.290  -5.155
  230   2HD   LYS  29          2HD       LYS  29  16.057  -0.135  -6.804
  231   1HE   LYS  29          1HE       LYS  29  18.145   0.763  -6.056
  232   2HE   LYS  29          2HE       LYS  29  17.520   1.029  -4.416
  233   1HZ   LYS  29          1HZ       LYS  29  17.045  -1.434  -4.394
  234   2HZ   LYS  29          2HZ       LYS  29  18.686  -1.000  -4.321
  235   3HZ   LYS  29          3HZ       LYS  29  18.015  -1.556  -5.780
  236    H    CYS  30           H        CYS  30  15.027   3.619  -2.087
  237    HA   CYS  30           HA       CYS  30  12.704   4.786  -1.087
  238   1HB   CYS  30          1HB       CYS  30  15.427   5.884  -1.802
  239   2HB   CYS  30          2HB       CYS  30  14.210   6.909  -1.042
  240    H    GLY  31           H        GLY  31  14.061   5.060  -4.286
  241   1HA   GLY  31          1HA       GLY  31  12.349   7.346  -5.016
  242   2HA   GLY  31          2HA       GLY  31  13.483   6.520  -6.087
  243    H    ASP  32           H        ASP  32  12.090   3.934  -4.894
  244    HA   ASP  32           HA       ASP  32  10.214   3.669  -7.127
  245   1HB   ASP  32          1HB       ASP  32  11.798   2.017  -5.519
  246   2HB   ASP  32          2HB       ASP  32  10.149   1.606  -5.059
  247    H    CYS  33           H        CYS  33  10.070   4.041  -3.607
  248    HA   CYS  33           HA       CYS  33   7.108   3.983  -3.596
  249   1HB   CYS  33          1HB       CYS  33   9.367   4.137  -1.611
  250   2HB   CYS  33          2HB       CYS  33   7.761   4.651  -1.104
  251    H    HIS  34           H        HIS  34   9.707   6.270  -2.653
  252    HA   HIS  34           HA       HIS  34   7.838   8.563  -2.887
  253   1HB   HIS  34          1HB       HIS  34  10.731   8.210  -2.030
  254   2HB   HIS  34          2HB       HIS  34   9.916   9.765  -2.063
  255    HD1  HIS  34           HD1      HIS  34   7.446   9.628  -0.652
  256    HD2  HIS  34           HD2      HIS  34  10.521   7.037   0.443
  257    HE1  HIS  34           HE1      HIS  34   6.952   8.886   1.718
  258    H    HIS  35           H        HIS  35   8.282   7.256  -5.344
  259    HA   HIS  35           HA       HIS  35  10.318   7.749  -7.047
  260   1HB   HIS  35          1HB       HIS  35   8.466   8.399  -8.732
  261   2HB   HIS  35          2HB       HIS  35   8.297   6.864  -7.902
  262    HD1  HIS  35           HD1      HIS  35   6.988  10.337  -7.934
  263    HD2  HIS  35           HD2      HIS  35   6.076   6.704  -6.133
  264    HE1  HIS  35           HE1      HIS  35   4.733  10.644  -6.837
  265    HA   PRO  36           HA       PRO  36  11.456  11.937  -7.187
  266   1HB   PRO  36          1HB       PRO  36  12.011  12.273  -9.854
  267   2HB   PRO  36          2HB       PRO  36  13.063  11.375  -8.739
  268   1HG   PRO  36          1HG       PRO  36  11.027  10.340 -10.664
  269   2HG   PRO  36          2HG       PRO  36  12.656   9.734 -10.313
  270   1HD   PRO  36          1HD       PRO  36  10.458   8.571  -9.287
  271   2HD   PRO  36          2HD       PRO  36  11.988   8.657  -8.381
  272    H    VAL  37           H        VAL  37   9.742  13.267  -6.744
  273    HA   VAL  37           HA       VAL  37   7.797  13.881  -8.939
  274    HB   VAL  37           HB       VAL  37   7.674  14.266  -5.932
  275   1HG1  VAL  37          1HG1      VAL  37   5.144  14.255  -7.351
  276   2HG1  VAL  37          2HG1      VAL  37   6.204  15.519  -7.973
  277   3HG1  VAL  37          3HG1      VAL  37   5.799  15.474  -6.258
  278   1HG2  VAL  37          1HG2      VAL  37   6.447  12.290  -5.801
  279   2HG2  VAL  37          2HG2      VAL  37   7.603  11.881  -7.068
  280   3HG2  VAL  37          3HG2      VAL  37   5.961  12.361  -7.495
  281    H    ASN  38           H        ASN  38   7.297  16.176  -9.257
  282    HA   ASN  38           HA       ASN  38   8.002  18.427  -9.551
  283   1HB   ASN  38          1HB       ASN  38   7.359  18.023  -7.085
  284   2HB   ASN  38          2HB       ASN  38   9.076  18.031  -6.766
  285   1HD2  ASN  38          2HD2      ASN  38   6.580  20.077  -6.488
  286   2HD2  ASN  38          1HD2      ASN  38   7.324  21.549  -6.891
  287    H    GLY  39           H        GLY  39  10.090  16.084  -9.892
  288   1HA   GLY  39          1HA       GLY  39  12.268  16.333 -10.888
  289   2HA   GLY  39          2HA       GLY  39  12.424  17.898 -10.082
  290    H    LYS  40           H        LYS  40  11.170  16.216  -7.675
  291    HA   LYS  40           HA       LYS  40  13.694  14.814  -6.878
  292   1HB   LYS  40          1HB       LYS  40  13.407  16.075  -4.644
  293   2HB   LYS  40          2HB       LYS  40  14.008  17.008  -6.015
  294   1HG   LYS  40          1HG       LYS  40  11.642  17.723  -6.480
  295   2HG   LYS  40          2HG       LYS  40  11.162  16.930  -4.980
  296   1HD   LYS  40          1HD       LYS  40  13.203  18.407  -4.036
  297   2HD   LYS  40          2HD       LYS  40  12.715  19.436  -5.383
  298   1HE   LYS  40          1HE       LYS  40  10.376  19.417  -4.536
  299   2HE   LYS  40          2HE       LYS  40  10.907  18.443  -3.150
  300   1HZ   LYS  40          1HZ       LYS  40  12.129  21.041  -3.908
  301   2HZ   LYS  40          2HZ       LYS  40  12.422  20.140  -2.497
  302   3HZ   LYS  40          3HZ       LYS  40  10.915  20.888  -2.734
  303    H    GLU  41           H        GLU  41  13.305  13.032  -5.537
  304    HA   GLU  41           HA       GLU  41  10.667  11.921  -5.387
  305   1HB   GLU  41          1HB       GLU  41  13.305  11.388  -4.012
  306   2HB   GLU  41          2HB       GLU  41  11.877  10.410  -3.676
  307   1HG   GLU  41          1HG       GLU  41  11.789   9.569  -5.870
  308   2HG   GLU  41          2HG       GLU  41  12.768  10.885  -6.516
  309    H    ASP  42           H        ASP  42   9.067  12.879  -4.147
  310    HA   ASP  42           HA       ASP  42   9.573  14.548  -1.864
  311   1HB   ASP  42          1HB       ASP  42   7.198  13.052  -2.964
  312   2HB   ASP  42          2HB       ASP  42   7.080  13.996  -1.479
  313    H    TYR  43           H        TYR  43  10.790  13.552  -0.271
  314    HA   TYR  43           HA       TYR  43  10.257  10.802   0.593
  315   1HB   TYR  43          1HB       TYR  43  12.011  13.015   1.718
  316   2HB   TYR  43          2HB       TYR  43  12.108  11.309   2.156
  317    HD1  TYR  43           HD1      TYR  43  13.377  13.811   0.004
  318    HD2  TYR  43           HD2      TYR  43  12.371   9.636   0.116
  319    HE1  TYR  43           HE1      TYR  43  14.872  13.400  -1.932
  320    HE2  TYR  43           HE2      TYR  43  13.866   9.225  -1.819
  321    HH   TYR  43           HH       TYR  43  15.135  11.743  -3.728
  322    H    GLN  44           H        GLN  44   7.860  11.846   0.980
  323    HA   GLN  44           HA       GLN  44   7.717  12.377   3.922
  324   1HB   GLN  44          1HB       GLN  44   5.988  14.108   3.390
  325   2HB   GLN  44          2HB       GLN  44   7.574  14.511   2.731
  326   1HG   GLN  44          1HG       GLN  44   6.713  13.241   0.603
  327   2HG   GLN  44          2HG       GLN  44   5.119  13.548   1.290
  328   1HE2  GLN  44          2HE2      GLN  44   8.097  15.586   1.242
  329   2HE2  GLN  44          1HE2      GLN  44   7.347  16.919   0.506
  330    H    LYS  45           H        LYS  45   5.253  12.246   4.564
  331    HA   LYS  45           HA       LYS  45   4.292   9.673   4.359
  332   1HB   LYS  45          1HB       LYS  45   2.006  10.837   4.678
  333   2HB   LYS  45          2HB       LYS  45   3.259  11.165   5.870
  334   1HG   LYS  45          1HG       LYS  45   3.857  13.241   4.651
  335   2HG   LYS  45          2HG       LYS  45   2.565  12.919   3.495
  336   1HD   LYS  45          1HD       LYS  45   1.809  14.507   5.217
  337   2HD   LYS  45          2HD       LYS  45   0.911  12.993   5.332
  338   1HE   LYS  45          1HE       LYS  45   1.594  12.755   7.476
  339   2HE   LYS  45          2HE       LYS  45   3.287  12.774   6.942
  340   1HZ   LYS  45          1HZ       LYS  45   3.218  14.693   8.166
  341   2HZ   LYS  45          2HZ       LYS  45   1.587  15.007   7.807
  342   3HZ   LYS  45          3HZ       LYS  45   2.789  15.305   6.643
  343    H    CYS  46           H        CYS  46   3.324   8.449   2.810
  344    HA   CYS  46           HA       CYS  46   3.302   9.060   0.074
  345   1HB   CYS  46          1HB       CYS  46   1.563   7.240   1.756
  346   2HB   CYS  46          2HB       CYS  46   1.678   7.137   0.003
  347    H    ALA  47           H        ALA  47   0.749   9.509   2.488
  348    HA   ALA  47           HA       ALA  47  -0.970  10.838   0.433
  349   1HB   ALA  47          1HB       ALA  47  -2.283   9.264   1.460
  350   2HB   ALA  47          2HB       ALA  47  -2.512  10.568   2.624
  351   3HB   ALA  47          3HB       ALA  47  -1.332   9.297   2.943
  352    H    THR  48           H        THR  48   1.080  12.470   1.150
  353    HA   THR  48           HA       THR  48   0.982  14.044   3.437
  354    HB   THR  48           HB       THR  48   1.331  15.320   0.750
  355    HG1  THR  48           1HG      THR  48   3.244  13.560   1.839
  356   1HG2  THR  48          1HG2      THR  48   2.337  16.803   2.110
  357   2HG2  THR  48          2HG2      THR  48   3.596  15.597   2.381
  358   3HG2  THR  48          3HG2      THR  48   2.223  15.701   3.483
  359    H    ALA  49           H        ALA  49   0.347  16.625   2.903
  360    HA   ALA  49           HA       ALA  49  -2.532  16.701   3.191
  361   1HB   ALA  49          1HB       ALA  49  -1.006  18.259   4.299
  362   2HB   ALA  49          2HB       ALA  49  -2.084  19.164   3.236
  363   3HB   ALA  49          3HB       ALA  49  -0.423  18.837   2.739
  364    H    GLY  50           H        GLY  50  -0.564  16.496   0.445
  365   1HA   GLY  50          1HA       GLY  50  -2.855  17.201  -1.296
  366   2HA   GLY  50          2HA       GLY  50  -1.348  18.082  -1.572
  367    H    CYS  51           H        CYS  51  -1.035  14.921  -0.355
  368    HA   CYS  51           HA       CYS  51   0.086  13.980  -2.930
  369   1HB   CYS  51          1HB       CYS  51   0.544  13.835  -0.054
  370   2HB   CYS  51          2HB       CYS  51   0.690  12.277  -0.799
  371    H    HIS  52           H        HIS  52  -0.371  11.194  -1.392
  372    HA   HIS  52           HA       HIS  52  -2.804  10.519  -2.866
  373   1HB   HIS  52          1HB       HIS  52  -0.999   9.039  -0.937
  374   2HB   HIS  52          2HB       HIS  52  -2.336   8.284  -1.779
  375    HD1  HIS  52           HD1      HIS  52  -2.206   8.666  -4.479
  376    HD2  HIS  52           HD2      HIS  52   1.361   8.886  -2.369
  377    HE1  HIS  52           HE1      HIS  52  -0.357   8.340  -6.183
  378    H    ASP  53           H        ASP  53  -3.551  12.508  -1.125
  379    HA   ASP  53           HA       ASP  53  -4.596  11.246   1.347
  380   1HB   ASP  53          1HB       ASP  53  -5.111  13.590   1.926
  381   2HB   ASP  53          2HB       ASP  53  -3.439  13.434   1.382
  382    H    ASN  54           H        ASN  54  -5.737  10.840  -1.552
  383    HA   ASN  54           HA       ASN  54  -8.405  12.051  -1.358
  384   1HB   ASN  54          1HB       ASN  54  -6.744  10.782  -3.300
  385   2HB   ASN  54          2HB       ASN  54  -8.242   9.864  -3.212
  386   1HD2  ASN  54          2HD2      ASN  54  -9.724  10.639  -4.701
  387   2HD2  ASN  54          1HD2      ASN  54  -9.932  12.270  -5.121
  388    H    MET  55           H        MET  55  -9.477  11.241   0.470
  389    HA   MET  55           HA       MET  55  -9.359   8.421   1.210
  390   1HB   MET  55          1HB       MET  55 -11.184  10.672   2.114
  391   2HB   MET  55          2HB       MET  55 -10.856   9.176   2.987
  392   1HG   MET  55          1HG       MET  55  -8.789  11.277   2.282
  393   2HG   MET  55          2HG       MET  55  -9.503  11.045   3.878
  394   1HE   MET  55          1HE       MET  55  -6.566   8.697   1.480
  395   2HE   MET  55          2HE       MET  55  -6.004  10.151   2.303
  396   3HE   MET  55          3HE       MET  55  -7.387  10.242   1.216
  397    H    ASP  56           H        ASP  56 -10.565   9.346  -1.494
  398    HA   ASP  56           HA       ASP  56 -13.399   8.647  -1.298
  399   1HB   ASP  56          1HB       ASP  56 -12.242  10.228  -2.947
  400   2HB   ASP  56          2HB       ASP  56 -11.613   8.785  -3.743
  401    H    LYS  57           H        LYS  57 -10.408   6.952  -1.622
  402    HA   LYS  57           HA       LYS  57  -9.941   4.651  -1.901
  403   1HB   LYS  57          1HB       LYS  57 -12.906   4.458  -1.308
  404   2HB   LYS  57          2HB       LYS  57 -11.705   3.194  -1.058
  405   1HG   LYS  57          1HG       LYS  57 -11.226   4.028   0.970
  406   2HG   LYS  57          2HG       LYS  57 -10.812   5.584   0.251
  407   1HD   LYS  57          1HD       LYS  57 -12.598   5.969   1.828
  408   2HD   LYS  57          2HD       LYS  57 -13.279   6.122   0.209
  409   1HE   LYS  57          1HE       LYS  57 -13.524   3.392   0.799
  410   2HE   LYS  57          2HE       LYS  57 -13.973   4.221   2.303
  411   1HZ   LYS  57          1HZ       LYS  57 -15.438   5.661   1.065
  412   2HZ   LYS  57          2HZ       LYS  57 -15.853   4.044   0.749
  413   3HZ   LYS  57          3HZ       LYS  57 -14.979   4.940  -0.401
  414    H    LYS  58           H        LYS  58 -11.356   6.428  -4.108
  415    HA   LYS  58           HA       LYS  58 -11.879   4.127  -5.958
  416   1HB   LYS  58          1HB       LYS  58 -13.369   6.768  -5.807
  417   2HB   LYS  58          2HB       LYS  58 -13.755   5.409  -6.862
  418   1HG   LYS  58          1HG       LYS  58 -13.612   4.349  -4.246
  419   2HG   LYS  58          2HG       LYS  58 -14.543   5.842  -4.121
  420   1HD   LYS  58          1HD       LYS  58 -16.321   4.760  -4.971
  421   2HD   LYS  58          2HD       LYS  58 -15.428   4.544  -6.477
  422   1HE   LYS  58          1HE       LYS  58 -14.612   2.407  -5.817
  423   2HE   LYS  58          2HE       LYS  58 -15.056   2.677  -4.120
  424   1HZ   LYS  58          1HZ       LYS  58 -17.358   2.732  -4.710
  425   2HZ   LYS  58          2HZ       LYS  58 -16.693   1.307  -5.353
  426   3HZ   LYS  58          3HZ       LYS  58 -17.000   2.636  -6.365
  427    H    ASP  59           H        ASP  59 -10.406   7.232  -5.402
  428    HA   ASP  59           HA       ASP  59 -10.012   8.200  -8.029
  429   1HB   ASP  59          1HB       ASP  59  -9.418   9.538  -6.151
  430   2HB   ASP  59          2HB       ASP  59  -8.389   8.273  -5.478
  431    H    LYS  60           H        LYS  60  -9.351   6.797  -9.650
  432    HA   LYS  60           HA       LYS  60  -7.235   4.798  -9.130
  433   1HB   LYS  60          1HB       LYS  60  -9.429   5.256 -10.966
  434   2HB   LYS  60          2HB       LYS  60  -7.950   4.910 -11.862
  435   1HG   LYS  60          1HG       LYS  60  -8.721   3.220  -9.492
  436   2HG   LYS  60          2HG       LYS  60  -9.426   2.908 -11.080
  437   1HD   LYS  60          1HD       LYS  60  -6.529   3.304 -11.198
  438   2HD   LYS  60          2HD       LYS  60  -6.986   1.938 -10.180
  439   1HE   LYS  60          1HE       LYS  60  -7.565   0.695 -11.986
  440   2HE   LYS  60          2HE       LYS  60  -8.551   2.014 -12.648
  441   1HZ   LYS  60          1HZ       LYS  60  -6.738   1.726 -14.125
  442   2HZ   LYS  60          2HZ       LYS  60  -5.611   1.675 -12.856
  443   3HZ   LYS  60          3HZ       LYS  60  -6.404   3.128 -13.234
  444    H    SER  61           H        SER  61  -6.824   7.876  -9.267
  445    HA   SER  61           HA       SER  61  -4.957   8.052 -11.579
  446   1HB   SER  61          1HB       SER  61  -6.754   9.778 -10.236
  447   2HB   SER  61          2HB       SER  61  -5.139  10.400  -9.903
  448    HG   SER  61           HG       SER  61  -6.279  11.056 -11.940
  449    H    ALA  62           H        ALA  62  -3.251  10.019 -10.358
  450    HA   ALA  62           HA       ALA  62  -1.577   8.223  -8.666
  451   1HB   ALA  62          1HB       ALA  62  -0.425  10.771  -9.462
  452   2HB   ALA  62          2HB       ALA  62  -1.145   9.946 -10.844
  453   3HB   ALA  62          3HB       ALA  62   0.093   9.139  -9.884
  454    H    LYS  63           H        LYS  63  -3.968   9.822  -7.662
  455    HA   LYS  63           HA       LYS  63  -2.505  11.338  -5.527
  456   1HB   LYS  63          1HB       LYS  63  -3.867  12.479  -7.597
  457   2HB   LYS  63          2HB       LYS  63  -5.161  12.313  -6.408
  458   1HG   LYS  63          1HG       LYS  63  -4.245  13.863  -5.005
  459   2HG   LYS  63          2HG       LYS  63  -2.595  13.341  -5.346
  460   1HD   LYS  63          1HD       LYS  63  -2.771  14.447  -7.591
  461   2HD   LYS  63          2HD       LYS  63  -4.343  15.083  -7.104
  462   1HE   LYS  63          1HE       LYS  63  -3.325  16.305  -5.246
  463   2HE   LYS  63          2HE       LYS  63  -1.740  15.603  -5.624
  464   1HZ   LYS  63          1HZ       LYS  63  -1.709  16.647  -7.718
  465   2HZ   LYS  63          2HZ       LYS  63  -2.207  17.854  -6.631
  466   3HZ   LYS  63          3HZ       LYS  63  -3.346  17.082  -7.627
  467    H    GLY  64           H        GLY  64  -4.462   8.760  -6.161
  468   1HA   GLY  64          1HA       GLY  64  -6.176   9.172  -3.760
  469   2HA   GLY  64          2HA       GLY  64  -6.471   7.974  -5.013
  470    H    TYR  65           H        TYR  65  -5.677   8.137  -1.911
  471    HA   TYR  65           HA       TYR  65  -3.338   6.652  -1.446
  472   1HB   TYR  65          1HB       TYR  65  -5.462   7.663  -0.026
  473   2HB   TYR  65          2HB       TYR  65  -5.732   5.930   0.140
  474    HD1  TYR  65           HD1      TYR  65  -5.179   5.732   2.476
  475    HD2  TYR  65           HD2      TYR  65  -2.396   7.503  -0.271
  476    HE1  TYR  65           HE1      TYR  65  -3.405   5.632   4.205
  477    HE2  TYR  65           HE2      TYR  65  -0.624   7.400   1.453
  478    HH   TYR  65           HH       TYR  65  -0.309   7.185   3.752
  479    H    TYR  66           H        TYR  66  -6.629   5.255  -1.534
  480    HA   TYR  66           HA       TYR  66  -6.165   2.569  -1.578
  481   1HB   TYR  66          1HB       TYR  66  -8.245   4.189  -2.026
  482   2HB   TYR  66          2HB       TYR  66  -7.968   3.665  -3.685
  483    HD1  TYR  66           HD1      TYR  66  -8.065   1.249  -4.273
  484    HD2  TYR  66           HD2      TYR  66  -9.081   2.694  -0.362
  485    HE1  TYR  66           HE1      TYR  66  -9.197  -0.902  -3.779
  486    HE2  TYR  66           HE2      TYR  66 -10.218   0.542   0.133
  487    HH   TYR  66           HH       TYR  66 -11.188  -1.578  -2.077
  488    H    HIS  67           H        HIS  67  -6.539   4.260  -4.704
  489    HA   HIS  67           HA       HIS  67  -5.713   2.353  -6.465
  490   1HB   HIS  67          1HB       HIS  67  -6.365   4.549  -7.181
  491   2HB   HIS  67          2HB       HIS  67  -4.992   5.287  -6.352
  492    HD1  HIS  67           HD1      HIS  67  -5.544   2.638  -9.037
  493    HD2  HIS  67           HD2      HIS  67  -2.832   5.639  -8.040
  494    HE1  HIS  67           HE1      HIS  67  -3.754   2.602 -10.821
  495    H    ALA  68           H        ALA  68  -3.224   4.755  -5.740
  496    HA   ALA  68           HA       ALA  68  -0.988   3.277  -6.446
  497   1HB   ALA  68          1HB       ALA  68  -1.323   5.236  -4.150
  498   2HB   ALA  68          2HB       ALA  68  -1.023   5.659  -5.837
  499   3HB   ALA  68          3HB       ALA  68   0.215   4.815  -4.905
  500    H    MET  69           H        MET  69  -2.928   2.870  -3.538
  501    HA   MET  69           HA       MET  69  -0.852   1.286  -2.179
  502   1HB   MET  69          1HB       MET  69  -3.727   1.992  -1.567
  503   2HB   MET  69          2HB       MET  69  -2.647   1.160  -0.453
  504   1HG   MET  69          1HG       MET  69  -1.465   3.582  -1.601
  505   2HG   MET  69          2HG       MET  69  -2.918   3.903  -0.658
  506   1HE   MET  69          1HE       MET  69   0.301   4.062  -0.858
  507   2HE   MET  69          2HE       MET  69   1.162   3.532   0.586
  508   3HE   MET  69          3HE       MET  69   0.158   4.979   0.649
  509    H    HIS  70           H        HIS  70  -3.858   0.639  -3.978
  510    HA   HIS  70           HA       HIS  70  -3.422  -2.270  -3.420
  511   1HB   HIS  70          1HB       HIS  70  -5.904  -0.787  -4.337
  512   2HB   HIS  70          2HB       HIS  70  -5.824  -2.474  -3.827
  513    HD1  HIS  70           HD1      HIS  70  -5.968   0.997  -2.514
  514    HD2  HIS  70           HD2      HIS  70  -5.337  -2.829  -0.992
  515    HE1  HIS  70           HE1      HIS  70  -6.161   1.191   0.002
  516    H    ASP  71           H        ASP  71  -3.151   0.086  -5.871
  517    HA   ASP  71           HA       ASP  71  -3.799  -1.729  -8.103
  518   1HB   ASP  71          1HB       ASP  71  -2.802   1.098  -7.764
  519   2HB   ASP  71          2HB       ASP  71  -2.884   0.344  -9.355
  520    H    LYS  72           H        LYS  72  -2.200  -2.401  -9.680
  521    HA   LYS  72           HA       LYS  72   0.558  -2.634  -8.536
  522   1HB   LYS  72          1HB       LYS  72   0.664  -4.711  -9.813
  523   2HB   LYS  72          2HB       LYS  72  -0.834  -4.699  -8.880
  524   1HG   LYS  72          1HG       LYS  72  -1.999  -3.778 -10.922
  525   2HG   LYS  72          2HG       LYS  72  -0.509  -4.059 -11.823
  526   1HD   LYS  72          1HD       LYS  72  -0.605  -6.463 -11.161
  527   2HD   LYS  72          2HD       LYS  72  -2.155  -6.155 -10.379
  528   1HE   LYS  72          1HE       LYS  72  -3.197  -5.581 -12.476
  529   2HE   LYS  72          2HE       LYS  72  -1.631  -5.571 -13.312
  530   1HZ   LYS  72          1HZ       LYS  72  -1.357  -7.872 -12.939
  531   2HZ   LYS  72          2HZ       LYS  72  -2.946  -7.692 -13.515
  532   3HZ   LYS  72          3HZ       LYS  72  -2.662  -7.940 -11.858
  533    H    GLY  73           H        GLY  73  -1.232  -2.159 -11.582
  534   1HA   GLY  73          1HA       GLY  73   1.184  -1.454 -13.064
  535   2HA   GLY  73          2HA       GLY  73  -0.472  -1.317 -13.661
  536    H    THR  74           H        THR  74   1.502   0.150 -11.066
  537    HA   THR  74           HA       THR  74   0.186   2.771 -11.651
  538    HB   THR  74           HB       THR  74   1.323   3.185  -9.316
  539    HG1  THR  74           1HG      THR  74   1.410   1.075  -8.233
  540   1HG2  THR  74          1HG2      THR  74  -0.606   1.929  -8.216
  541   2HG2  THR  74          2HG2      THR  74  -1.022   1.346  -9.829
  542   3HG2  THR  74          3HG2      THR  74  -1.061   3.074  -9.479
  543    H    LYS  75           H        LYS  75   1.601   4.702 -11.569
  544    HA   LYS  75           HA       LYS  75   3.760   4.837 -13.254
  545   1HB   LYS  75          1HB       LYS  75   2.498   6.562 -11.645
  546   2HB   LYS  75          2HB       LYS  75   3.932   6.318 -10.651
  547   1HG   LYS  75          1HG       LYS  75   4.141   8.238 -12.256
  548   2HG   LYS  75          2HG       LYS  75   5.381   7.004 -12.472
  549   1HD   LYS  75          1HD       LYS  75   3.030   6.369 -14.043
  550   2HD   LYS  75          2HD       LYS  75   3.624   7.984 -14.436
  551   1HE   LYS  75          1HE       LYS  75   5.790   6.019 -14.151
  552   2HE   LYS  75          2HE       LYS  75   4.664   5.638 -15.468
  553   1HZ   LYS  75          1HZ       LYS  75   6.129   7.159 -16.422
  554   2HZ   LYS  75          2HZ       LYS  75   6.204   8.123 -15.024
  555   3HZ   LYS  75          3HZ       LYS  75   4.802   8.121 -15.984
  556    H    PHE  76           H        PHE  76   3.805   3.753  -9.889
  557    HA   PHE  76           HA       PHE  76   6.572   2.679 -10.313
  558   1HB   PHE  76          1HB       PHE  76   5.533   4.160  -7.881
  559   2HB   PHE  76          2HB       PHE  76   7.160   3.523  -8.093
  560    HD1  PHE  76           HD1      PHE  76   8.577   4.448 -10.019
  561    HD2  PHE  76           HD2      PHE  76   4.899   6.250  -8.728
  562    HE1  PHE  76           HE1      PHE  76   9.194   6.548 -11.185
  563    HE2  PHE  76           HE2      PHE  76   5.515   8.348  -9.891
  564    HZ   PHE  76           HZ       PHE  76   7.656   8.491 -11.116
  565    H    LYS  77           H        LYS  77   7.086   1.134  -8.339
  566    HA   LYS  77           HA       LYS  77   4.971  -0.832  -8.211
  567   1HB   LYS  77          1HB       LYS  77   6.520  -1.926  -6.620
  568   2HB   LYS  77          2HB       LYS  77   7.342  -1.422  -8.094
  569   1HG   LYS  77          1HG       LYS  77   8.007   0.697  -6.871
  570   2HG   LYS  77          2HG       LYS  77   7.388  -0.049  -5.398
  571   1HD   LYS  77          1HD       LYS  77   9.857  -0.387  -5.709
  572   2HD   LYS  77          2HD       LYS  77   8.955  -1.897  -5.615
  573   1HE   LYS  77          1HE       LYS  77   9.027  -2.186  -8.013
  574   2HE   LYS  77          2HE       LYS  77   9.716  -0.566  -8.236
  575   1HZ   LYS  77          1HZ       LYS  77  10.975  -2.694  -6.590
  576   2HZ   LYS  77          2HZ       LYS  77  11.645  -1.189  -7.004
  577   3HZ   LYS  77          3HZ       LYS  77  11.406  -2.371  -8.198
  578    H    SER  78           H        SER  78   3.212  -0.474  -7.091
  579    HA   SER  78           HA       SER  78   2.981   1.460  -4.934
  580   1HB   SER  78          1HB       SER  78   0.664  -0.055  -5.040
  581   2HB   SER  78          2HB       SER  78   0.988   1.381  -6.003
  582    HG   SER  78           HG       SER  78   0.437  -0.403  -7.311
  583    H    CYS  79           H        CYS  79   1.535   0.590  -2.980
  584    HA   CYS  79           HA       CYS  79   3.176  -1.050  -1.319
  585   1HB   CYS  79          1HB       CYS  79   0.253  -0.248  -1.222
  586   2HB   CYS  79          2HB       CYS  79   1.115  -0.974   0.132
  587    H    VAL  80           H        VAL  80  -0.148  -1.842  -2.360
  588    HA   VAL  80           HA       VAL  80   0.197  -4.685  -1.952
  589    HB   VAL  80           HB       VAL  80  -1.802  -2.920  -3.367
  590   1HG1  VAL  80          1HG1      VAL  80  -2.489  -4.743  -4.509
  591   2HG1  VAL  80          2HG1      VAL  80  -3.020  -5.388  -2.956
  592   3HG1  VAL  80          3HG1      VAL  80  -1.427  -5.805  -3.585
  593   1HG2  VAL  80          1HG2      VAL  80  -1.487  -3.148  -0.762
  594   2HG2  VAL  80          2HG2      VAL  80  -2.314  -4.690  -0.987
  595   3HG2  VAL  80          3HG2      VAL  80  -3.114  -3.186  -1.441
  596    H    GLY  81           H        GLY  81   0.791  -2.498  -4.617
  597   1HA   GLY  81          1HA       GLY  81   0.849  -4.493  -6.714
  598   2HA   GLY  81          2HA       GLY  81   1.548  -2.875  -6.814
  599    H    CYS  82           H        CYS  82   3.318  -3.007  -4.626
  600    HA   CYS  82           HA       CYS  82   5.516  -4.554  -5.791
  601   1HB   CYS  82          1HB       CYS  82   5.467  -2.251  -4.524
  602   2HB   CYS  82          2HB       CYS  82   5.481  -3.245  -3.071
  603    H    HIS  83           H        HIS  83   3.048  -5.000  -3.465
  604    HA   HIS  83           HA       HIS  83   4.366  -7.050  -1.867
  605   1HB   HIS  83          1HB       HIS  83   1.709  -5.709  -2.139
  606   2HB   HIS  83          2HB       HIS  83   1.761  -7.233  -1.270
  607    HD1  HIS  83           HD1      HIS  83   1.295  -5.898   0.980
  608    HD2  HIS  83           HD2      HIS  83   4.888  -4.941  -0.909
  609    HE1  HIS  83           HE1      HIS  83   2.688  -4.650   2.683
  610    H    LEU  84           H        LEU  84   1.589  -7.139  -4.173
  611    HA   LEU  84           HA       LEU  84   1.279  -9.913  -4.381
  612   1HB   LEU  84          1HB       LEU  84   0.417  -7.541  -5.610
  613   2HB   LEU  84          2HB       LEU  84   1.076  -8.512  -6.921
  614    HG   LEU  84           HG       LEU  84  -0.734  -9.781  -4.899
  615   1HD1  LEU  84          1HD1      LEU  84  -2.695  -9.117  -6.087
  616   2HD1  LEU  84          2HD1      LEU  84  -1.749  -8.428  -7.406
  617   3HD1  LEU  84          3HD1      LEU  84  -1.773  -7.635  -5.830
  618   1HD2  LEU  84          1HD2      LEU  84  -1.058 -11.399  -6.571
  619   2HD2  LEU  84          2HD2      LEU  84   0.628 -10.942  -6.813
  620   3HD2  LEU  84          3HD2      LEU  84  -0.623 -10.283  -7.866
  621    H    GLU  85           H        GLU  85   3.736  -7.808  -5.793
  622    HA   GLU  85           HA       GLU  85   4.830  -9.940  -7.511
  623   1HB   GLU  85          1HB       GLU  85   5.425  -7.052  -6.882
  624   2HB   GLU  85          2HB       GLU  85   6.587  -8.018  -7.792
  625   1HG   GLU  85          1HG       GLU  85   4.652  -8.650  -9.334
  626   2HG   GLU  85          2HG       GLU  85   3.725  -7.378  -8.535
  627    H    THR  86           H        THR  86   5.969  -8.019  -4.700
  628    HA   THR  86           HA       THR  86   8.423  -9.376  -4.278
  629    HB   THR  86           HB       THR  86   6.452  -7.857  -2.580
  630    HG1  THR  86           1HG      THR  86   7.719  -6.533  -3.697
  631   1HG2  THR  86          1HG2      THR  86   9.058  -9.021  -1.564
  632   2HG2  THR  86          2HG2      THR  86   7.463  -9.646  -1.149
  633   3HG2  THR  86          3HG2      THR  86   7.926  -8.017  -0.657
  634    H    ALA  87           H        ALA  87   5.181 -10.462  -3.841
  635    HA   ALA  87           HA       ALA  87   5.910 -12.582  -1.908
  636   1HB   ALA  87          1HB       ALA  87   3.483 -11.316  -3.051
  637   2HB   ALA  87          2HB       ALA  87   3.778 -11.894  -1.410
  638   3HB   ALA  87          3HB       ALA  87   3.329 -13.033  -2.679
  639    H    GLY  88           H        GLY  88   5.065 -12.191  -5.315
  640   1HA   GLY  88          1HA       GLY  88   5.230 -13.675  -7.123
  641   2HA   GLY  88          2HA       GLY  88   6.462 -14.510  -6.174
  642    H    ALA  89           H        ALA  89   5.801 -16.627  -6.531
  643    HA   ALA  89           HA       ALA  89   2.979 -17.402  -6.199
  644   1HB   ALA  89          1HB       ALA  89   3.708 -19.412  -7.139
  645   2HB   ALA  89          2HB       ALA  89   5.311 -19.275  -6.418
  646   3HB   ALA  89          3HB       ALA  89   4.879 -18.273  -7.803
  647    H    ASP  90           H        ASP  90   3.870 -16.293  -3.811
  648    HA   ASP  90           HA       ASP  90   4.297 -18.677  -2.055
  649   1HB   ASP  90          1HB       ASP  90   6.157 -17.088  -2.096
  650   2HB   ASP  90          2HB       ASP  90   5.062 -15.760  -1.729
  651    H    ALA  91           H        ALA  91   1.936 -18.896  -2.157
  652    HA   ALA  91           HA       ALA  91  -0.115 -17.182  -1.583
  653   1HB   ALA  91          1HB       ALA  91  -1.267 -19.087  -0.806
  654   2HB   ALA  91          2HB       ALA  91   0.169 -19.743  -0.017
  655   3HB   ALA  91          3HB       ALA  91   0.032 -19.782  -1.775
  656    H    ALA  92           H        ALA  92   2.440 -18.101   0.641
  657    HA   ALA  92           HA       ALA  92   1.134 -17.053   3.033
  658   1HB   ALA  92          1HB       ALA  92   4.073 -17.219   2.959
  659   2HB   ALA  92          2HB       ALA  92   3.277 -18.699   2.426
  660   3HB   ALA  92          3HB       ALA  92   2.937 -18.042   4.027
  661    H    LYS  93           H        LYS  93   3.545 -15.941   0.696
  662    HA   LYS  93           HA       LYS  93   3.957 -13.355   1.965
  663   1HB   LYS  93          1HB       LYS  93   4.782 -14.898  -0.421
  664   2HB   LYS  93          2HB       LYS  93   4.850 -13.152  -0.605
  665   1HG   LYS  93          1HG       LYS  93   6.130 -13.086   1.587
  666   2HG   LYS  93          2HG       LYS  93   6.221 -14.845   1.492
  667   1HD   LYS  93          1HD       LYS  93   7.319 -14.639  -0.735
  668   2HD   LYS  93          2HD       LYS  93   7.300 -12.884  -0.556
  669   1HE   LYS  93          1HE       LYS  93   8.812 -12.949   1.291
  670   2HE   LYS  93          2HE       LYS  93   8.597 -14.700   1.496
  671   1HZ   LYS  93          1HZ       LYS  93   9.819 -13.311  -0.829
  672   2HZ   LYS  93          2HZ       LYS  93   9.448 -14.968  -0.800
  673   3HZ   LYS  93          3HZ       LYS  93  10.606 -14.335   0.271
  674    H    LYS  94           H        LYS  94   1.727 -14.727  -0.352
  675    HA   LYS  94           HA       LYS  94   0.862 -12.178  -1.494
  676   1HB   LYS  94          1HB       LYS  94   0.454 -15.011  -1.839
  677   2HB   LYS  94          2HB       LYS  94  -1.112 -14.203  -1.771
  678   1HG   LYS  94          1HG       LYS  94   0.345 -12.490  -3.362
  679   2HG   LYS  94          2HG       LYS  94   0.975 -14.068  -3.841
  680   1HD   LYS  94          1HD       LYS  94  -1.847 -14.332  -3.593
  681   2HD   LYS  94          2HD       LYS  94  -1.539 -12.873  -4.535
  682   1HE   LYS  94          1HE       LYS  94  -1.291 -14.303  -6.300
  683   2HE   LYS  94          2HE       LYS  94   0.290 -14.677  -5.588
  684   1HZ   LYS  94          1HZ       LYS  94  -0.934 -16.283  -4.116
  685   2HZ   LYS  94          2HZ       LYS  94  -0.850 -16.724  -5.755
  686   3HZ   LYS  94          3HZ       LYS  94  -2.285 -16.072  -5.120
  687    H    LYS  95           H        LYS  95  -0.001 -14.154   1.269
  688    HA   LYS  95           HA       LYS  95  -2.515 -12.700   1.785
  689   1HB   LYS  95          1HB       LYS  95  -2.776 -14.328   3.494
  690   2HB   LYS  95          2HB       LYS  95  -1.916 -15.187   2.217
  691   1HG   LYS  95          1HG       LYS  95  -0.388 -15.711   3.797
  692   2HG   LYS  95          2HG       LYS  95   0.130 -14.029   3.686
  693   1HD   LYS  95          1HD       LYS  95  -2.079 -13.867   5.336
  694   2HD   LYS  95          2HD       LYS  95  -1.338 -15.389   5.831
  695   1HE   LYS  95          1HE       LYS  95   0.892 -13.892   5.700
  696   2HE   LYS  95          2HE       LYS  95  -0.279 -12.610   6.068
  697   1HZ   LYS  95          1HZ       LYS  95   0.281 -15.079   7.596
  698   2HZ   LYS  95          2HZ       LYS  95  -1.189 -14.248   7.776
  699   3HZ   LYS  95          3HZ       LYS  95   0.277 -13.476   8.149
  700    H    GLU  96           H        GLU  96   0.841 -12.494   2.610
  701    HA   GLU  96           HA       GLU  96   0.370 -10.767   4.975
  702   1HB   GLU  96          1HB       GLU  96   2.769 -11.031   5.231
  703   2HB   GLU  96          2HB       GLU  96   2.105 -12.598   4.807
  704   1HG   GLU  96          1HG       GLU  96   2.763 -12.294   2.501
  705   2HG   GLU  96          2HG       GLU  96   3.322 -10.658   2.846
  706    H    LEU  97           H        LEU  97   1.837 -10.642   1.763
  707    HA   LEU  97           HA       LEU  97   2.430  -7.786   1.878
  708   1HB   LEU  97          1HB       LEU  97   2.339  -9.791  -0.387
  709   2HB   LEU  97          2HB       LEU  97   3.113  -8.208  -0.451
  710    HG   LEU  97           HG       LEU  97   3.893 -10.592   1.226
  711   1HD1  LEU  97          1HD1      LEU  97   5.082  -8.945  -0.969
  712   2HD1  LEU  97          2HD1      LEU  97   5.041 -10.698  -0.784
  713   3HD1  LEU  97          3HD1      LEU  97   6.154  -9.733   0.187
  714   1HD2  LEU  97          1HD2      LEU  97   5.703  -8.734   1.948
  715   2HD2  LEU  97          2HD2      LEU  97   4.221  -9.004   2.865
  716   3HD2  LEU  97          3HD2      LEU  97   4.311  -7.678   1.706
  717    H    THR  98           H        THR  98   0.304  -9.627  -0.338
  718    HA   THR  98           HA       THR  98  -1.265  -7.167  -0.822
  719    HB   THR  98           HB       THR  98  -2.343  -8.686  -2.526
  720    HG1  THR  98           1HG      THR  98  -2.073 -10.711  -2.044
  721   1HG2  THR  98          1HG2      THR  98   0.056  -7.382  -2.582
  722   2HG2  THR  98          2HG2      THR  98  -0.661  -8.186  -3.976
  723   3HG2  THR  98          3HG2      THR  98   0.551  -9.020  -3.002
  724    H    GLY  99           H        GLY  99  -1.506 -10.086   1.037
  725   1HA   GLY  99          1HA       GLY  99  -4.249 -10.537   1.190
  726   2HA   GLY  99          2HA       GLY  99  -3.173 -10.700   2.581
  727    H    CYS 100           H        CYS 100  -5.925  -9.244   1.751
  728    HA   CYS 100           HA       CYS 100  -5.420  -6.541   2.739
  729   1HB   CYS 100          1HB       CYS 100  -8.165  -7.577   2.810
  730   2HB   CYS 100          2HB       CYS 100  -7.543  -6.158   2.010
  731    H    LYS 101           H        LYS 101  -7.555  -9.117   3.958
  732    HA   LYS 101           HA       LYS 101  -7.175  -8.008   6.690
  733   1HB   LYS 101          1HB       LYS 101  -9.078 -10.143   5.675
  734   2HB   LYS 101          2HB       LYS 101  -9.208  -9.242   7.186
  735   1HG   LYS 101          1HG       LYS 101  -9.628  -7.183   6.017
  736   2HG   LYS 101          2HG       LYS 101  -9.238  -7.920   4.463
  737   1HD   LYS 101          1HD       LYS 101 -11.173  -9.595   5.130
  738   2HD   LYS 101          2HD       LYS 101 -11.687  -8.256   6.157
  739   1HE   LYS 101          1HE       LYS 101 -11.950  -6.787   4.291
  740   2HE   LYS 101          2HE       LYS 101 -11.073  -7.890   3.210
  741   1HZ   LYS 101          1HZ       LYS 101 -13.273  -8.419   2.785
  742   2HZ   LYS 101          2HZ       LYS 101 -13.755  -8.208   4.400
  743   3HZ   LYS 101          3HZ       LYS 101 -12.853  -9.576   3.950
  744    H    GLY 102           H        GLY 102  -5.500  -8.948   7.806
  745   1HA   GLY 102          1HA       GLY 102  -4.802 -10.961   9.059
  746   2HA   GLY 102          2HA       GLY 102  -5.231 -11.919   7.641
  747    H    SER 103           H        SER 103  -3.874  -9.306   6.295
  748    HA   SER 103           HA       SER 103  -1.332 -10.671   5.805
  749   1HB   SER 103          1HB       SER 103  -1.028  -8.775   4.261
  750   2HB   SER 103          2HB       SER 103  -2.633  -9.464   4.079
  751    HG   SER 103           HG       SER 103  -2.157  -7.003   4.471
  752    H    LYS 104           H        LYS 104   0.212  -8.231   5.529
  753    HA   LYS 104           HA       LYS 104   0.946  -7.794   8.389
  754   1HB   LYS 104          1HB       LYS 104   2.314  -7.322   5.721
  755   2HB   LYS 104          2HB       LYS 104   3.053  -7.003   7.289
  756   1HG   LYS 104          1HG       LYS 104   1.888  -9.715   6.857
  757   2HG   LYS 104          2HG       LYS 104   3.399  -9.341   6.026
  758   1HD   LYS 104          1HD       LYS 104   4.240  -8.496   8.311
  759   2HD   LYS 104          2HD       LYS 104   2.850  -9.341   8.995
  760   1HE   LYS 104          1HE       LYS 104   3.614 -11.458   7.991
  761   2HE   LYS 104          2HE       LYS 104   5.001 -10.620   7.266
  762   1HZ   LYS 104          1HZ       LYS 104   5.987 -10.297   9.271
  763   2HZ   LYS 104          2HZ       LYS 104   5.144 -11.722   9.653
  764   3HZ   LYS 104          3HZ       LYS 104   4.519 -10.212  10.118
  765    H    CYS 105           H        CYS 105  -0.168  -6.302   5.475
  766    HA   CYS 105           HA       CYS 105   0.321  -3.546   6.266
  767   1HB   CYS 105          1HB       CYS 105  -0.141  -5.014   3.974
  768   2HB   CYS 105          2HB       CYS 105  -1.657  -4.173   4.197
  769    H    HIS 106           H        HIS 106  -2.319  -5.845   6.620
  770    HA   HIS 106           HA       HIS 106  -4.001  -3.661   7.814
  771   1HB   HIS 106          1HB       HIS 106  -4.542  -5.983   6.014
  772   2HB   HIS 106          2HB       HIS 106  -5.813  -5.508   7.142
  773    HD1  HIS 106           HD1      HIS 106  -5.122  -2.413   7.047
  774    HD2  HIS 106           HD2      HIS 106  -5.794  -4.851   3.714
  775    HE1  HIS 106           HE1      HIS 106  -5.712  -0.861   5.141
  776    H    SER 107           H        SER 107  -2.467  -4.503   9.718
  777    HA   SER 107           HA       SER 107  -3.397  -7.036  10.928
  778   1HB   SER 107          1HB       SER 107  -1.123  -5.238  11.050
  779   2HB   SER 107          2HB       SER 107  -1.702  -5.613  12.670
  780    HG   SER 107           HG       SER 107  -0.931  -7.545  12.432
  781    HHA  HEC 201           HHA      HEC 201   5.899   8.572   5.614
  782    HHB  HEC 201           HHB      HEC 201  11.974   9.839   4.636
  783    HHC  HEC 201           HHC      HEC 201  12.508   4.679   1.016
  784    HHD  HEC 201           HHD      HEC 201   6.404   3.557   1.744
  785   1HMA  HEC 201          1HMA      HEC 201  10.077  12.014   6.173
  786   2HMA  HEC 201          2HMA      HEC 201  11.219  10.790   6.726
  787   3HMA  HEC 201          3HMA      HEC 201   9.728  11.074   7.625
  788   1HAA  HEC 201          1HAA      HEC 201   6.686   9.476   7.498
  789   2HAA  HEC 201          2HAA      HEC 201   7.841  10.769   7.803
  790   1HBA  HEC 201          1HBA      HEC 201   6.577  11.442   5.383
  791   2HBA  HEC 201          2HBA      HEC 201   5.289  10.896   6.456
  792   1HMB  HEC 201          1HMB      HEC 201  15.043   8.343   4.244
  793   2HMB  HEC 201          2HMB      HEC 201  14.820   9.249   2.747
  794   3HMB  HEC 201          3HMB      HEC 201  13.919   9.702   4.194
  795    HAB  HEC 201           HAB      HEC 201  14.355   5.525   1.120
  796   1HBB  HEC 201          1HBB      HEC 201  15.341   6.134   3.822
  797   2HBB  HEC 201          2HBB      HEC 201  16.600   6.170   2.587
  798   3HBB  HEC 201          3HBB      HEC 201  15.629   4.716   2.815
  799   1HMC  HEC 201          1HMC      HEC 201  11.718   1.847   0.622
  800   2HMC  HEC 201          2HMC      HEC 201  10.665   1.997  -0.784
  801   3HMC  HEC 201          3HMC      HEC 201  11.919   3.201  -0.488
  802    HAC  HEC 201           HAC      HEC 201   7.024   2.237   0.578
  803   1HBC  HEC 201          1HBC      HEC 201   8.985   0.365  -0.513
  804   2HBC  HEC 201          2HBC      HEC 201   7.647   0.068   0.597
  805   3HBC  HEC 201          3HBC      HEC 201   9.194   0.641   1.216
  806   1HMD  HEC 201          1HMD      HEC 201   3.379   4.506   2.756
  807   2HMD  HEC 201          2HMD      HEC 201   4.592   3.266   3.075
  808   3HMD  HEC 201          3HMD      HEC 201   3.705   3.993   4.413
  809   1HAD  HEC 201          1HAD      HEC 201   4.163   7.851   5.508
  810   2HAD  HEC 201          2HAD      HEC 201   3.155   7.252   4.196
  811   1HBD  HEC 201          1HBD      HEC 201   2.680   5.229   5.340
  812   2HBD  HEC 201          2HBD      HEC 201   3.997   5.478   6.487
  813    HHA  HEC 202           HHA      HEC 202   1.645   7.679  -9.454
  814    HHB  HEC 202           HHB      HEC 202   2.879   4.128  -4.769
  815    HHC  HEC 202           HHC      HEC 202   4.560   8.985  -1.193
  816    HHD  HEC 202           HHD      HEC 202   2.567  12.927  -5.796
  817   1HMA  HEC 202          1HMA      HEC 202   0.979   3.242  -5.837
  818   2HMA  HEC 202          2HMA      HEC 202   2.161   2.831  -7.081
  819   3HMA  HEC 202          3HMA      HEC 202   0.506   3.239  -7.535
  820   1HAA  HEC 202          1HAA      HEC 202   1.203   5.215  -9.972
  821   2HAA  HEC 202          2HAA      HEC 202   0.074   4.400  -8.932
  822   1HBA  HEC 202          1HBA      HEC 202  -1.262   6.401  -8.712
  823   2HBA  HEC 202          2HBA      HEC 202  -0.087   7.332  -9.631
  824   1HMB  HEC 202          1HMB      HEC 202   2.875   3.595  -2.142
  825   2HMB  HEC 202          2HMB      HEC 202   4.334   3.350  -3.102
  826   3HMB  HEC 202          3HMB      HEC 202   4.463   3.785  -1.397
  827    HAB  HEC 202           HAB      HEC 202   4.278   7.066   0.130
  828   1HBB  HEC 202          1HBB      HEC 202   6.413   5.116  -0.017
  829   2HBB  HEC 202          2HBB      HEC 202   6.489   6.806   0.481
  830   3HBB  HEC 202          3HBB      HEC 202   6.647   6.380  -1.223
  831   1HMC  HEC 202          1HMC      HEC 202   4.049  12.072  -0.444
  832   2HMC  HEC 202          2HMC      HEC 202   5.369  10.947  -0.761
  833   3HMC  HEC 202          3HMC      HEC 202   5.475  12.613  -1.330
  834    HAC  HEC 202           HAC      HEC 202   2.733  14.038  -4.007
  835   1HBC  HEC 202          1HBC      HEC 202   4.344  15.513  -3.177
  836   2HBC  HEC 202          2HBC      HEC 202   5.359  14.094  -3.445
  837   3HBC  HEC 202          3HBC      HEC 202   4.758  14.457  -1.826
  838   1HMD  HEC 202          1HMD      HEC 202   1.701  12.981  -9.658
  839   2HMD  HEC 202          2HMD      HEC 202   2.824  13.528  -8.411
  840   3HMD  HEC 202          3HMD      HEC 202   1.097  13.440  -8.066
  841   1HAD  HEC 202          1HAD      HEC 202   1.922   9.292 -10.695
  842   2HAD  HEC 202          2HAD      HEC 202   1.166  10.872 -10.829
  843   1HBD  HEC 202          1HBD      HEC 202   3.662  11.690 -10.354
  844   2HBD  HEC 202          2HBD      HEC 202   4.040  10.115 -11.052
  845    HHA  HEC 203           HHA      HEC 203   7.126  -6.844   4.596
  846    HHB  HEC 203           HHB      HEC 203   2.784  -2.045   4.925
  847    HHC  HEC 203           HHC      HEC 203   4.689   0.064  -0.470
  848    HHD  HEC 203           HHD      HEC 203   9.002  -4.495  -0.943
  849   1HMA  HEC 203          1HMA      HEC 203   3.035  -5.106   7.448
  850   2HMA  HEC 203          2HMA      HEC 203   2.218  -3.861   6.501
  851   3HMA  HEC 203          3HMA      HEC 203   3.520  -3.418   7.607
  852   1HAA  HEC 203          1HAA      HEC 203   4.841  -6.138   7.678
  853   2HAA  HEC 203          2HAA      HEC 203   4.659  -7.331   6.398
  854   1HBA  HEC 203          1HBA      HEC 203   6.906  -7.725   6.261
  855   2HBA  HEC 203          2HBA      HEC 203   7.325  -6.044   6.591
  856   1HMB  HEC 203          1HMB      HEC 203   1.380  -0.520   4.336
  857   2HMB  HEC 203          2HMB      HEC 203   2.546   0.688   4.872
  858   3HMB  HEC 203          3HMB      HEC 203   1.522   1.011   3.473
  859    HAB  HEC 203           HAB      HEC 203   2.733   0.909   0.143
  860   1HBB  HEC 203          1HBB      HEC 203   4.273   2.556  -0.015
  861   2HBB  HEC 203          2HBB      HEC 203   4.814   2.280   1.641
  862   3HBB  HEC 203          3HBB      HEC 203   3.452   3.357   1.325
  863   1HMC  HEC 203          1HMC      HEC 203   5.588   0.345  -2.198
  864   2HMC  HEC 203          2HMC      HEC 203   7.234   0.218  -2.823
  865   3HMC  HEC 203          3HMC      HEC 203   5.949  -0.773  -3.513
  866    HAC  HEC 203           HAC      HEC 203   9.221  -3.354  -2.579
  867   1HBC  HEC 203          1HBC      HEC 203   9.888  -1.580  -3.963
  868   2HBC  HEC 203          2HBC      HEC 203   9.179  -0.726  -2.593
  869   3HBC  HEC 203          3HBC      HEC 203   8.252  -0.930  -4.077
  870   1HMD  HEC 203          1HMD      HEC 203  10.054  -7.722   0.213
  871   2HMD  HEC 203          2HMD      HEC 203  11.049  -6.517   1.032
  872   3HMD  HEC 203          3HMD      HEC 203  10.244  -6.113  -0.485
  873   1HAD  HEC 203          1HAD      HEC 203  10.158  -7.840   3.104
  874   2HAD  HEC 203          2HAD      HEC 203   8.720  -7.912   4.114
  875   1HBD  HEC 203          1HBD      HEC 203   7.608  -9.381   2.583
  876   2HBD  HEC 203          2HBD      HEC 203   8.838  -9.123   1.346
  877    HHA  HEC 204           HHA      HEC 204  -6.854   2.184   3.876
  878    HHB  HEC 204           HHB      HEC 204 -10.121  -2.315   1.010
  879    HHC  HEC 204           HHC      HEC 204  -4.803  -5.912   0.943
  880    HHD  HEC 204           HHD      HEC 204  -1.499  -0.913   2.625
  881   1HMA  HEC 204          1HMA      HEC 204 -11.715   0.136   3.088
  882   2HMA  HEC 204          2HMA      HEC 204 -11.497  -0.971   1.733
  883   3HMA  HEC 204          3HMA      HEC 204 -11.396   0.771   1.474
  884   1HAA  HEC 204          1HAA      HEC 204  -9.988   1.963   4.597
  885   2HAA  HEC 204          2HAA      HEC 204  -8.601   2.804   3.913
  886   1HBA  HEC 204          1HBA      HEC 204  -9.838   3.135   1.802
  887   2HBA  HEC 204          2HBA      HEC 204 -11.218   2.282   2.487
  888   1HMB  HEC 204          1HMB      HEC 204 -10.583  -3.941  -0.205
  889   2HMB  HEC 204          2HMB      HEC 204 -10.225  -5.660  -0.037
  890   3HMB  HEC 204          3HMB      HEC 204  -9.774  -4.807  -1.513
  891    HAB  HEC 204           HAB      HEC 204  -6.455  -7.012   0.276
  892   1HBB  HEC 204          1HBB      HEC 204  -5.734  -6.288  -1.869
  893   2HBB  HEC 204          2HBB      HEC 204  -7.380  -5.909  -2.379
  894   3HBB  HEC 204          3HBB      HEC 204  -6.883  -7.590  -2.177
  895   1HMC  HEC 204          1HMC      HEC 204  -1.611  -6.034   0.487
  896   2HMC  HEC 204          2HMC      HEC 204  -1.521  -6.124   2.245
  897   3HMC  HEC 204          3HMC      HEC 204  -2.997  -6.610   1.413
  898    HAC  HEC 204           HAC      HEC 204  -0.428  -2.422   2.891
  899   1HBC  HEC 204          1HBC      HEC 204   0.187  -2.557   0.432
  900   2HBC  HEC 204          2HBC      HEC 204   0.423  -4.290   0.653
  901   3HBC  HEC 204          3HBC      HEC 204   1.438  -3.143   1.528
  902   1HMD  HEC 204          1HMD      HEC 204  -1.382   1.563   4.563
  903   2HMD  HEC 204          2HMD      HEC 204  -0.951   1.126   2.909
  904   3HMD  HEC 204          3HMD      HEC 204  -1.596   2.730   3.257
  905   1HAD  HEC 204          1HAD      HEC 204  -3.785   3.884   3.566
  906   2HAD  HEC 204          2HAD      HEC 204  -5.421   3.473   4.066
  907   1HBD  HEC 204          1HBD      HEC 204  -4.127   2.277   6.060
  908   2HBD  HEC 204          2HBD      HEC 204  -2.900   3.478   5.657
  Start of MODEL   14
    1   1H    ALA   1          1H        ALA   1  19.864  15.159   2.094
    2   2H    ALA   1          2H        ALA   1  19.130  14.559   0.684
    3   3H    ALA   1          3H        ALA   1  20.821  14.523   0.847
    4    HA   ALA   1           HA       ALA   1  19.689  12.325   1.215
    5   1HB   ALA   1          1HB       ALA   1  21.415  13.756   3.250
    6   2HB   ALA   1          2HB       ALA   1  21.942  12.705   1.935
    7   3HB   ALA   1          3HB       ALA   1  21.109  12.021   3.331
    8    HA   PRO   2           HA       PRO   2  16.132  13.175   3.854
    9   1HB   PRO   2          1HB       PRO   2  14.800  10.883   3.184
   10   2HB   PRO   2          2HB       PRO   2  14.784  12.334   2.172
   11   1HG   PRO   2          1HG       PRO   2  16.366   9.837   1.870
   12   2HG   PRO   2          2HG       PRO   2  15.621  10.857   0.630
   13   1HD   PRO   2          1HD       PRO   2  18.290  10.893   1.229
   14   2HD   PRO   2          2HD       PRO   2  17.410  12.277   0.543
   15    H    LYS   3           H        LYS   3  15.627  12.357   5.920
   16    HA   LYS   3           HA       LYS   3  17.327  10.080   6.849
   17   1HB   LYS   3          1HB       LYS   3  15.831  12.192   8.409
   18   2HB   LYS   3          2HB       LYS   3  17.036  11.070   9.035
   19   1HG   LYS   3          1HG       LYS   3  18.769  12.327   8.280
   20   2HG   LYS   3          2HG       LYS   3  17.979  12.633   6.732
   21   1HD   LYS   3          1HD       LYS   3  16.749  14.462   7.588
   22   2HD   LYS   3          2HD       LYS   3  17.039  13.984   9.261
   23   1HE   LYS   3          1HE       LYS   3  18.465  15.918   8.627
   24   2HE   LYS   3          2HE       LYS   3  19.462  14.489   8.968
   25   1HZ   LYS   3          1HZ       LYS   3  19.803  15.776   6.753
   26   2HZ   LYS   3          2HZ       LYS   3  18.420  14.927   6.250
   27   3HZ   LYS   3          3HZ       LYS   3  19.808  14.080   6.744
   28    H    ALA   4           H        ALA   4  15.851   8.481   6.055
   29    HA   ALA   4           HA       ALA   4  13.137   8.155   6.298
   30   1HB   ALA   4          1HB       ALA   4  13.662   5.974   5.878
   31   2HB   ALA   4          2HB       ALA   4  14.675   5.852   7.317
   32   3HB   ALA   4          3HB       ALA   4  15.328   6.552   5.837
   33    HA   PRO   5           HA       PRO   5  12.386   8.534  10.623
   34   1HB   PRO   5          1HB       PRO   5   9.745   7.806  10.586
   35   2HB   PRO   5          2HB       PRO   5  10.336   9.396  10.075
   36   1HG   PRO   5          1HG       PRO   5   9.384   7.132   8.441
   37   2HG   PRO   5          2HG       PRO   5   9.392   8.862   8.090
   38   1HD   PRO   5          1HD       PRO   5  11.197   6.957   7.090
   39   2HD   PRO   5          2HD       PRO   5  11.357   8.720   6.989
   40    H    ALA   6           H        ALA   6  11.795   7.167  12.458
   41    HA   ALA   6           HA       ALA   6  12.883   4.567  12.399
   42   1HB   ALA   6          1HB       ALA   6  10.903   5.933  14.242
   43   2HB   ALA   6          2HB       ALA   6  12.655   5.863  14.427
   44   3HB   ALA   6          3HB       ALA   6  11.688   4.400  14.622
   45    H    ASP   7           H        ASP   7  11.930   2.536  12.303
   46    HA   ASP   7           HA       ASP   7   9.681   2.123  10.602
   47   1HB   ASP   7          1HB       ASP   7  10.749   0.204  12.680
   48   2HB   ASP   7          2HB       ASP   7  10.088  -0.173  11.090
   49    H    GLY   8           H        GLY   8   7.636   1.105  11.270
   50   1HA   GLY   8          1HA       GLY   8   5.964   0.573  12.946
   51   2HA   GLY   8          2HA       GLY   8   6.841   1.587  14.089
   52    H    LEU   9           H        LEU   9   6.475   2.937  10.953
   53    HA   LEU   9           HA       LEU   9   5.055   5.231  11.851
   54   1HB   LEU   9          1HB       LEU   9   6.159   4.145   9.447
   55   2HB   LEU   9          2HB       LEU   9   4.513   4.668   9.088
   56    HG   LEU   9           HG       LEU   9   6.057   6.550  10.757
   57   1HD1  LEU   9          1HD1      LEU   9   7.071   7.357   8.416
   58   2HD1  LEU   9          2HD1      LEU   9   7.018   5.626   8.086
   59   3HD1  LEU   9          3HD1      LEU   9   7.939   6.233   9.462
   60   1HD2  LEU   9          1HD2      LEU   9   4.650   7.034   8.124
   61   2HD2  LEU   9          2HD2      LEU   9   4.906   8.169   9.447
   62   3HD2  LEU   9          3HD2      LEU   9   3.746   6.848   9.629
   63    H    LYS  10           H        LYS  10   2.822   5.707  10.609
   64    HA   LYS  10           HA       LYS  10   1.042   3.350  10.596
   65   1HB   LYS  10          1HB       LYS  10   1.184   5.453  12.700
   66   2HB   LYS  10          2HB       LYS  10  -0.420   4.900  12.213
   67   1HG   LYS  10          1HG       LYS  10   0.577   2.511  12.471
   68   2HG   LYS  10          2HG       LYS  10   1.827   3.310  13.428
   69   1HD   LYS  10          1HD       LYS  10  -0.502   4.419  14.427
   70   2HD   LYS  10          2HD       LYS  10  -0.970   2.747  14.112
   71   1HE   LYS  10          1HE       LYS  10   0.866   1.911  15.471
   72   2HE   LYS  10          2HE       LYS  10   1.506   3.554  15.679
   73   1HZ   LYS  10          1HZ       LYS  10  -0.151   4.130  17.083
   74   2HZ   LYS  10          2HZ       LYS  10  -0.204   2.459  17.388
   75   3HZ   LYS  10          3HZ       LYS  10  -1.309   3.165  16.307
   76    H    MET  11           H        MET  11   0.201   3.720   8.594
   77    HA   MET  11           HA       MET  11  -0.460   6.415   7.640
   78   1HB   MET  11          1HB       MET  11  -0.241   3.656   6.647
   79   2HB   MET  11          2HB       MET  11  -1.622   4.516   5.966
   80   1HG   MET  11          1HG       MET  11   1.271   5.402   5.909
   81   2HG   MET  11          2HG       MET  11   0.293   4.901   4.533
   82   1HE   MET  11          1HE       MET  11   1.526   6.765   3.789
   83   2HE   MET  11          2HE       MET  11   1.292   8.470   4.164
   84   3HE   MET  11          3HE       MET  11   0.210   7.669   3.025
   85    H    ASP  12           H        ASP  12  -2.132   7.228   8.958
   86    HA   ASP  12           HA       ASP  12  -4.544   5.475   9.285
   87   1HB   ASP  12          1HB       ASP  12  -5.008   7.304  11.071
   88   2HB   ASP  12          2HB       ASP  12  -3.716   6.148  11.374
   89    H    LYS  13           H        LYS  13  -3.735   7.341   6.965
   90    HA   LYS  13           HA       LYS  13  -5.423   9.608   6.841
   91   1HB   LYS  13          1HB       LYS  13  -4.268   7.634   4.887
   92   2HB   LYS  13          2HB       LYS  13  -5.297   8.945   4.316
   93   1HG   LYS  13          1HG       LYS  13  -2.778   9.259   5.978
   94   2HG   LYS  13          2HG       LYS  13  -2.929   9.622   4.258
   95   1HD   LYS  13          1HD       LYS  13  -4.914  11.159   5.049
   96   2HD   LYS  13          2HD       LYS  13  -4.093  11.082   6.608
   97   1HE   LYS  13          1HE       LYS  13  -1.948  11.660   5.158
   98   2HE   LYS  13          2HE       LYS  13  -3.158  12.319   4.039
   99   1HZ   LYS  13          1HZ       LYS  13  -4.134  13.205   6.322
  100   2HZ   LYS  13          2HZ       LYS  13  -2.992  14.089   5.427
  101   3HZ   LYS  13          3HZ       LYS  13  -2.496  13.156   6.757
  102    H    THR  14           H        THR  14  -6.134   6.196   6.505
  103    HA   THR  14           HA       THR  14  -8.987   6.840   5.817
  104    HB   THR  14           HB       THR  14  -8.968   4.465   4.973
  105    HG1  THR  14           1HG      THR  14  -7.336   3.297   5.517
  106   1HG2  THR  14          1HG2      THR  14  -6.830   6.285   3.842
  107   2HG2  THR  14          2HG2      THR  14  -8.551   6.378   3.470
  108   3HG2  THR  14          3HG2      THR  14  -7.618   4.962   2.983
  109    H    LYS  15           H        LYS  15 -10.449   4.899   6.645
  110    HA   LYS  15           HA       LYS  15 -10.406   4.911   9.523
  111   1HB   LYS  15          1HB       LYS  15 -11.964   3.763   7.284
  112   2HB   LYS  15          2HB       LYS  15 -12.040   2.834   8.782
  113   1HG   LYS  15          1HG       LYS  15 -13.478   4.331   9.644
  114   2HG   LYS  15          2HG       LYS  15 -12.273   5.605   9.447
  115   1HD   LYS  15          1HD       LYS  15 -13.004   5.995   7.151
  116   2HD   LYS  15          2HD       LYS  15 -14.145   4.655   7.260
  117   1HE   LYS  15          1HE       LYS  15 -15.654   6.241   7.908
  118   2HE   LYS  15          2HE       LYS  15 -14.805   6.211   9.467
  119   1HZ   LYS  15          1HZ       LYS  15 -14.831   8.452   8.561
  120   2HZ   LYS  15          2HZ       LYS  15 -14.094   7.908   7.130
  121   3HZ   LYS  15          3HZ       LYS  15 -13.245   7.853   8.600
  122    H    GLN  16           H        GLN  16  -8.977   2.863   7.099
  123    HA   GLN  16           HA       GLN  16  -8.270   0.799   9.140
  124   1HB   GLN  16          1HB       GLN  16  -8.293   0.912   6.114
  125   2HB   GLN  16          2HB       GLN  16  -7.592  -0.439   7.006
  126   1HG   GLN  16          1HG       GLN  16  -9.684  -1.019   7.982
  127   2HG   GLN  16          2HG       GLN  16 -10.417   0.512   7.501
  128   1HE2  GLN  16          2HE2      GLN  16  -8.526  -1.977   5.684
  129   2HE2  GLN  16          1HE2      GLN  16  -9.673  -2.152   4.447
  130    HA   PRO  17           HA       PRO  17  -4.492   3.406   8.690
  131   1HB   PRO  17          1HB       PRO  17  -3.710   3.114  11.302
  132   2HB   PRO  17          2HB       PRO  17  -4.839   4.371  10.756
  133   1HG   PRO  17          1HG       PRO  17  -5.414   1.745  12.048
  134   2HG   PRO  17          2HG       PRO  17  -6.159   3.326  12.333
  135   1HD   PRO  17          1HD       PRO  17  -7.349   1.416  10.837
  136   2HD   PRO  17          2HD       PRO  17  -7.551   3.152  10.505
  137    H    VAL  18           H        VAL  18  -2.479   2.555   8.210
  138    HA   VAL  18           HA       VAL  18  -1.917  -0.256   9.079
  139    HB   VAL  18           HB       VAL  18  -1.617   1.201   6.448
  140   1HG1  VAL  18          1HG1      VAL  18   0.504   0.010   7.051
  141   2HG1  VAL  18          2HG1      VAL  18  -0.289  -0.650   5.620
  142   3HG1  VAL  18          3HG1      VAL  18  -0.421  -1.487   7.167
  143   1HG2  VAL  18          1HG2      VAL  18  -2.625  -1.226   5.873
  144   2HG2  VAL  18          2HG2      VAL  18  -3.652   0.124   6.353
  145   3HG2  VAL  18          3HG2      VAL  18  -3.181  -1.093   7.541
  146    H    VAL  19           H        VAL  19   0.174  -0.626   9.813
  147    HA   VAL  19           HA       VAL  19   1.872   1.751  10.283
  148    HB   VAL  19           HB       VAL  19   2.027  -1.154  11.145
  149   1HG1  VAL  19          1HG1      VAL  19   3.389   1.026  12.646
  150   2HG1  VAL  19          2HG1      VAL  19   4.119   0.549  11.113
  151   3HG1  VAL  19          3HG1      VAL  19   3.891  -0.646  12.390
  152   1HG2  VAL  19          1HG2      VAL  19   1.431   0.986  13.094
  153   2HG2  VAL  19          2HG2      VAL  19   0.710  -0.615  12.925
  154   3HG2  VAL  19          3HG2      VAL  19   0.170   0.709  11.893
  155    H    PHE  20           H        PHE  20   3.649   2.174   8.997
  156    HA   PHE  20           HA       PHE  20   4.562  -0.006   7.157
  157   1HB   PHE  20          1HB       PHE  20   3.712   2.000   6.059
  158   2HB   PHE  20          2HB       PHE  20   4.778   3.021   7.022
  159    HD1  PHE  20           HD1      PHE  20   4.926   0.046   4.757
  160    HD2  PHE  20           HD2      PHE  20   6.869   3.620   6.122
  161    HE1  PHE  20           HE1      PHE  20   6.732  -0.299   3.097
  162    HE2  PHE  20           HE2      PHE  20   8.670   3.274   4.463
  163    HZ   PHE  20           HZ       PHE  20   8.606   1.314   2.952
  164    H    ASN  21           H        ASN  21   6.399  -0.985   7.906
  165    HA   ASN  21           HA       ASN  21   8.240   0.474   9.700
  166   1HB   ASN  21          1HB       ASN  21   7.335  -2.212   9.172
  167   2HB   ASN  21          2HB       ASN  21   9.088  -2.147   9.069
  168   1HD2  ASN  21          2HD2      ASN  21   6.503  -0.825  11.215
  169   2HD2  ASN  21          1HD2      ASN  21   7.351  -1.115  12.656
  170    H    HIS  22           H        HIS  22   9.463   1.871   8.329
  171    HA   HIS  22           HA       HIS  22  10.378   1.420   5.726
  172   1HB   HIS  22          1HB       HIS  22  11.423   2.860   8.146
  173   2HB   HIS  22          2HB       HIS  22  12.421   2.797   6.695
  174    HD1  HIS  22           HD1      HIS  22   9.597   4.575   8.187
  175    HD2  HIS  22           HD2      HIS  22  10.981   3.902   4.308
  176    HE1  HIS  22           HE1      HIS  22   8.544   6.356   6.732
  177    H    SER  23           H        SER  23  11.606   0.113   8.775
  178    HA   SER  23           HA       SER  23  14.113  -0.901   8.052
  179   1HB   SER  23          1HB       SER  23  13.144  -2.877   9.607
  180   2HB   SER  23          2HB       SER  23  13.559  -1.294  10.256
  181    HG   SER  23           HG       SER  23  11.110  -2.490   9.903
  182    H    THR  24           H        THR  24  10.899  -2.313   7.427
  183    HA   THR  24           HA       THR  24  11.977  -4.643   6.030
  184    HB   THR  24           HB       THR  24   9.212  -3.959   5.458
  185    HG1  THR  24           1HG      THR  24   8.826  -2.948   7.251
  186   1HG2  THR  24          1HG2      THR  24  10.750  -6.200   6.038
  187   2HG2  THR  24          2HG2      THR  24   8.997  -6.169   5.848
  188   3HG2  THR  24          3HG2      THR  24   9.712  -6.029   7.454
  189    H    HIS  25           H        HIS  25  11.906  -1.444   5.202
  190    HA   HIS  25           HA       HIS  25  11.606  -2.069   2.299
  191   1HB   HIS  25          1HB       HIS  25  10.810   0.375   3.907
  192   2HB   HIS  25          2HB       HIS  25  10.617   0.194   2.167
  193    HD1  HIS  25           HD1      HIS  25   9.269  -1.030   5.435
  194    HD2  HIS  25           HD2      HIS  25   8.583  -1.661   1.372
  195    HE1  HIS  25           HE1      HIS  25   7.126  -2.368   5.271
  196    H    LYS  26           H        LYS  26  13.650  -0.891   4.774
  197    HA   LYS  26           HA       LYS  26  15.162   1.156   3.597
  198   1HB   LYS  26          1HB       LYS  26  16.097  -1.262   5.182
  199   2HB   LYS  26          2HB       LYS  26  16.995   0.246   5.004
  200   1HG   LYS  26          1HG       LYS  26  14.870   1.388   5.940
  201   2HG   LYS  26          2HG       LYS  26  14.399  -0.229   6.459
  202   1HD   LYS  26          1HD       LYS  26  16.435  -0.458   7.768
  203   2HD   LYS  26          2HD       LYS  26  17.038   1.085   7.162
  204   1HE   LYS  26          1HE       LYS  26  14.357   1.287   8.358
  205   2HE   LYS  26          2HE       LYS  26  15.614   0.785   9.507
  206   1HZ   LYS  26          1HZ       LYS  26  17.022   2.588   8.509
  207   2HZ   LYS  26          2HZ       LYS  26  15.698   3.134   9.423
  208   3HZ   LYS  26          3HZ       LYS  26  15.630   3.157   7.725
  209    H    ALA  27           H        ALA  27  15.048  -2.263   2.808
  210    HA   ALA  27           HA       ALA  27  17.404  -2.148   1.045
  211   1HB   ALA  27          1HB       ALA  27  15.391  -4.365   1.040
  212   2HB   ALA  27          2HB       ALA  27  16.310  -4.089   2.519
  213   3HB   ALA  27          3HB       ALA  27  17.152  -4.457   1.013
  214    H    VAL  28           H        VAL  28  14.161  -1.235   0.816
  215    HA   VAL  28           HA       VAL  28  13.728  -1.975  -1.991
  216    HB   VAL  28           HB       VAL  28  12.305  -0.258   0.054
  217   1HG1  VAL  28          1HG1      VAL  28  11.817   0.699  -2.117
  218   2HG1  VAL  28          2HG1      VAL  28  10.416  -0.227  -1.583
  219   3HG1  VAL  28          3HG1      VAL  28  11.508  -0.901  -2.793
  220   1HG2  VAL  28          1HG2      VAL  28  10.961  -2.091   0.432
  221   2HG2  VAL  28          2HG2      VAL  28  12.430  -2.936  -0.059
  222   3HG2  VAL  28          3HG2      VAL  28  11.128  -2.680  -1.222
  223    H    LYS  29           H        LYS  29  13.024   0.023  -3.442
  224    HA   LYS  29           HA       LYS  29  15.348   1.847  -3.444
  225   1HB   LYS  29          1HB       LYS  29  13.521   0.683  -5.336
  226   2HB   LYS  29          2HB       LYS  29  13.518   2.440  -5.504
  227   1HG   LYS  29          1HG       LYS  29  15.335   1.965  -6.835
  228   2HG   LYS  29          2HG       LYS  29  16.149   2.095  -5.274
  229   1HD   LYS  29          1HD       LYS  29  15.328  -0.530  -5.268
  230   2HD   LYS  29          2HD       LYS  29  15.716  -0.274  -6.970
  231   1HE   LYS  29          1HE       LYS  29  17.742   0.941  -5.275
  232   2HE   LYS  29          2HE       LYS  29  17.561  -0.788  -4.915
  233   1HZ   LYS  29          1HZ       LYS  29  17.802  -1.336  -7.189
  234   2HZ   LYS  29          2HZ       LYS  29  19.064  -0.254  -6.838
  235   3HZ   LYS  29          3HZ       LYS  29  17.688   0.284  -7.678
  236    H    CYS  30           H        CYS  30  15.057   3.463  -2.007
  237    HA   CYS  30           HA       CYS  30  12.740   4.634  -0.996
  238   1HB   CYS  30          1HB       CYS  30  15.466   5.724  -1.710
  239   2HB   CYS  30          2HB       CYS  30  14.252   6.756  -0.954
  240    H    GLY  31           H        GLY  31  14.068   4.884  -4.205
  241   1HA   GLY  31          1HA       GLY  31  12.360   7.182  -4.921
  242   2HA   GLY  31          2HA       GLY  31  13.497   6.361  -5.995
  243    H    ASP  32           H        ASP  32  12.099   3.767  -4.799
  244    HA   ASP  32           HA       ASP  32  10.231   3.507  -7.041
  245   1HB   ASP  32          1HB       ASP  32  11.799   1.853  -5.416
  246   2HB   ASP  32          2HB       ASP  32  10.145   1.440  -4.981
  247    H    CYS  33           H        CYS  33  10.103   4.062  -3.570
  248    HA   CYS  33           HA       CYS  33   7.130   3.953  -3.540
  249   1HB   CYS  33          1HB       CYS  33   9.376   4.193  -1.536
  250   2HB   CYS  33          2HB       CYS  33   7.733   4.617  -1.061
  251    H    HIS  34           H        HIS  34   9.709   6.249  -2.547
  252    HA   HIS  34           HA       HIS  34   7.865   8.545  -2.866
  253   1HB   HIS  34          1HB       HIS  34  10.765   8.211  -2.016
  254   2HB   HIS  34          2HB       HIS  34   9.943   9.760  -2.072
  255    HD1  HIS  34           HD1      HIS  34   7.518   9.692  -0.622
  256    HD2  HIS  34           HD2      HIS  34  10.544   7.038   0.462
  257    HE1  HIS  34           HE1      HIS  34   7.029   8.974   1.759
  258    H    HIS  35           H        HIS  35   8.338   7.126  -5.275
  259    HA   HIS  35           HA       HIS  35  10.363   7.598  -6.995
  260   1HB   HIS  35          1HB       HIS  35   8.524   8.091  -8.716
  261   2HB   HIS  35          2HB       HIS  35   8.339   6.623  -7.773
  262    HD1  HIS  35           HD1      HIS  35   7.097  10.125  -7.994
  263    HD2  HIS  35           HD2      HIS  35   6.058   6.573  -6.106
  264    HE1  HIS  35           HE1      HIS  35   4.827  10.519  -6.958
  265    HA   PRO  36           HA       PRO  36  11.380  11.806  -7.367
  266   1HB   PRO  36          1HB       PRO  36  11.838  12.048 -10.060
  267   2HB   PRO  36          2HB       PRO  36  12.948  11.220  -8.950
  268   1HG   PRO  36          1HG       PRO  36  10.875  10.063 -10.760
  269   2HG   PRO  36          2HG       PRO  36  12.531   9.512 -10.448
  270   1HD   PRO  36          1HD       PRO  36  10.404   8.332  -9.297
  271   2HD   PRO  36          2HD       PRO  36  11.961   8.495  -8.450
  272    H    VAL  37           H        VAL  37   9.516  12.964  -6.860
  273    HA   VAL  37           HA       VAL  37   7.549  13.495  -9.048
  274    HB   VAL  37           HB       VAL  37   7.550  13.635  -6.034
  275   1HG1  VAL  37          1HG1      VAL  37   5.282  14.655  -6.192
  276   2HG1  VAL  37          2HG1      VAL  37   5.518  14.854  -7.929
  277   3HG1  VAL  37          3HG1      VAL  37   6.542  15.734  -6.793
  278   1HG2  VAL  37          1HG2      VAL  37   6.678  11.582  -6.484
  279   2HG2  VAL  37          2HG2      VAL  37   6.333  11.996  -8.164
  280   3HG2  VAL  37          3HG2      VAL  37   5.213  12.476  -6.890
  281    H    ASN  38           H        ASN  38   6.945  15.762  -9.403
  282    HA   ASN  38           HA       ASN  38   7.572  18.021  -9.804
  283   1HB   ASN  38          1HB       ASN  38   6.985  17.680  -7.314
  284   2HB   ASN  38          2HB       ASN  38   8.706  17.767  -7.026
  285   1HD2  ASN  38          2HD2      ASN  38   9.813  19.788  -8.073
  286   2HD2  ASN  38          1HD2      ASN  38   8.944  21.243  -7.997
  287    H    GLY  39           H        GLY  39   9.732  15.752 -10.123
  288   1HA   GLY  39          1HA       GLY  39  11.886  16.029 -11.150
  289   2HA   GLY  39          2HA       GLY  39  11.994  17.636 -10.425
  290    H    LYS  40           H        LYS  40  10.847  16.000  -7.922
  291    HA   LYS  40           HA       LYS  40  13.456  14.775  -7.100
  292   1HB   LYS  40          1HB       LYS  40  13.385  16.116  -5.030
  293   2HB   LYS  40          2HB       LYS  40  13.402  17.168  -6.445
  294   1HG   LYS  40          1HG       LYS  40  10.907  17.312  -6.309
  295   2HG   LYS  40          2HG       LYS  40  10.974  16.386  -4.809
  296   1HD   LYS  40          1HD       LYS  40  12.720  18.800  -5.025
  297   2HD   LYS  40          2HD       LYS  40  10.991  19.056  -4.793
  298   1HE   LYS  40          1HE       LYS  40  12.289  17.008  -3.048
  299   2HE   LYS  40          2HE       LYS  40  12.637  18.714  -2.702
  300   1HZ   LYS  40          1HZ       LYS  40  10.009  17.365  -2.827
  301   2HZ   LYS  40          2HZ       LYS  40  10.143  19.048  -3.016
  302   3HZ   LYS  40          3HZ       LYS  40  10.650  18.309  -1.573
  303    H    GLU  41           H        GLU  41  13.186  13.035  -5.656
  304    HA   GLU  41           HA       GLU  41  10.608  11.781  -5.475
  305   1HB   GLU  41          1HB       GLU  41  13.266  11.418  -4.081
  306   2HB   GLU  41          2HB       GLU  41  11.889  10.373  -3.741
  307   1HG   GLU  41          1HG       GLU  41  11.923   9.410  -5.850
  308   2HG   GLU  41          2HG       GLU  41  12.660  10.826  -6.600
  309    H    ASP  42           H        ASP  42   8.969  12.710  -4.278
  310    HA   ASP  42           HA       ASP  42   9.420  14.433  -2.010
  311   1HB   ASP  42          1HB       ASP  42   7.039  12.860  -3.015
  312   2HB   ASP  42          2HB       ASP  42   6.952  14.030  -1.699
  313    H    TYR  43           H        TYR  43  10.654  13.406  -0.437
  314    HA   TYR  43           HA       TYR  43  10.087  10.682   0.458
  315   1HB   TYR  43          1HB       TYR  43  11.857  12.922   1.494
  316   2HB   TYR  43          2HB       TYR  43  11.894  11.267   2.101
  317    HD1  TYR  43           HD1      TYR  43  13.001  13.524  -0.496
  318    HD2  TYR  43           HD2      TYR  43  12.432   9.377   0.475
  319    HE1  TYR  43           HE1      TYR  43  14.523  12.881  -2.345
  320    HE2  TYR  43           HE2      TYR  43  13.953   8.736  -1.374
  321    HH   TYR  43           HH       TYR  43  15.485   9.512  -2.845
  322    H    GLN  44           H        GLN  44   7.694  11.883   0.766
  323    HA   GLN  44           HA       GLN  44   7.523  12.453   3.710
  324   1HB   GLN  44          1HB       GLN  44   5.592  13.979   2.979
  325   2HB   GLN  44          2HB       GLN  44   7.216  14.528   2.562
  326   1HG   GLN  44          1HG       GLN  44   6.933  13.482   0.304
  327   2HG   GLN  44          2HG       GLN  44   5.264  13.103   0.732
  328   1HE2  GLN  44          2HE2      GLN  44   5.333  15.793   2.361
  329   2HE2  GLN  44          1HE2      GLN  44   5.040  16.962   1.166
  330    H    LYS  45           H        LYS  45   5.200  12.076   4.504
  331    HA   LYS  45           HA       LYS  45   4.361   9.456   4.265
  332   1HB   LYS  45          1HB       LYS  45   3.057  12.063   4.894
  333   2HB   LYS  45          2HB       LYS  45   2.018  10.651   4.725
  334   1HG   LYS  45          1HG       LYS  45   2.744   9.744   6.669
  335   2HG   LYS  45          2HG       LYS  45   4.427  10.142   6.323
  336   1HD   LYS  45          1HD       LYS  45   3.942  11.490   8.187
  337   2HD   LYS  45          2HD       LYS  45   3.713  12.593   6.829
  338   1HE   LYS  45          1HE       LYS  45   1.499  12.828   7.282
  339   2HE   LYS  45          2HE       LYS  45   1.281  11.076   7.464
  340   1HZ   LYS  45          1HZ       LYS  45   2.685  12.737   9.479
  341   2HZ   LYS  45          2HZ       LYS  45   2.132  11.139   9.647
  342   3HZ   LYS  45          3HZ       LYS  45   1.021  12.422   9.562
  343    H    CYS  46           H        CYS  46   3.509   8.259   2.645
  344    HA   CYS  46           HA       CYS  46   3.215   8.907  -0.001
  345   1HB   CYS  46          1HB       CYS  46   1.475   7.123   1.713
  346   2HB   CYS  46          2HB       CYS  46   1.559   7.028  -0.040
  347    H    ALA  47           H        ALA  47   0.718   9.352   2.490
  348    HA   ALA  47           HA       ALA  47  -0.983  10.787   0.501
  349   1HB   ALA  47          1HB       ALA  47  -2.346   9.272   1.537
  350   2HB   ALA  47          2HB       ALA  47  -2.474  10.556   2.737
  351   3HB   ALA  47          3HB       ALA  47  -1.351   9.221   2.991
  352    H    THR  48           H        THR  48   0.995  12.441   1.019
  353    HA   THR  48           HA       THR  48   1.116  13.973   3.364
  354    HB   THR  48           HB       THR  48   1.213  15.301   0.681
  355    HG1  THR  48           1HG      THR  48   2.288  13.660  -0.052
  356   1HG2  THR  48          1HG2      THR  48   2.101  15.939   3.204
  357   2HG2  THR  48          2HG2      THR  48   2.726  16.636   1.710
  358   3HG2  THR  48          3HG2      THR  48   3.552  15.270   2.459
  359    H    ALA  49           H        ALA  49   0.394  16.588   2.772
  360    HA   ALA  49           HA       ALA  49  -2.472  16.558   3.311
  361   1HB   ALA  49          1HB       ALA  49  -0.561  18.839   2.702
  362   2HB   ALA  49          2HB       ALA  49  -0.795  18.129   4.299
  363   3HB   ALA  49          3HB       ALA  49  -2.123  18.978   3.509
  364    H    GLY  50           H        GLY  50  -0.455  17.057   0.488
  365   1HA   GLY  50          1HA       GLY  50  -2.935  17.440  -1.132
  366   2HA   GLY  50          2HA       GLY  50  -1.518  18.449  -1.425
  367    H    CYS  51           H        CYS  51  -1.729  14.992  -0.682
  368    HA   CYS  51           HA       CYS  51  -0.504  14.407  -3.351
  369   1HB   CYS  51          1HB       CYS  51   0.835  14.514  -1.003
  370   2HB   CYS  51          2HB       CYS  51   0.346  12.843  -0.963
  371    H    HIS  52           H        HIS  52  -0.472  11.615  -1.608
  372    HA   HIS  52           HA       HIS  52  -2.837  10.544  -2.958
  373   1HB   HIS  52          1HB       HIS  52  -0.815   9.478  -0.980
  374   2HB   HIS  52          2HB       HIS  52  -2.109   8.488  -1.617
  375    HD1  HIS  52           HD1      HIS  52  -2.172   8.980  -4.463
  376    HD2  HIS  52           HD2      HIS  52   1.453   8.926  -2.438
  377    HE1  HIS  52           HE1      HIS  52  -0.395   8.460  -6.204
  378    H    ASP  53           H        ASP  53  -3.738  12.600  -1.328
  379    HA   ASP  53           HA       ASP  53  -4.724  11.312   1.174
  380   1HB   ASP  53          1HB       ASP  53  -5.219  13.653   1.804
  381   2HB   ASP  53          2HB       ASP  53  -3.539  13.476   1.295
  382    H    ASN  54           H        ASN  54  -5.873  10.862  -1.664
  383    HA   ASN  54           HA       ASN  54  -8.478  12.209  -1.576
  384   1HB   ASN  54          1HB       ASN  54  -6.896  10.991  -3.484
  385   2HB   ASN  54          2HB       ASN  54  -8.159   9.792  -3.230
  386   1HD2  ASN  54          2HD2      ASN  54  -9.773  10.101  -4.763
  387   2HD2  ASN  54          1HD2      ASN  54 -10.370  11.610  -5.261
  388    H    MET  55           H        MET  55  -9.685  11.586   0.219
  389    HA   MET  55           HA       MET  55  -9.674   8.842   1.216
  390   1HB   MET  55          1HB       MET  55 -11.055  11.442   1.828
  391   2HB   MET  55          2HB       MET  55 -11.630   9.956   2.582
  392   1HG   MET  55          1HG       MET  55 -10.030  10.352   4.141
  393   2HG   MET  55          2HG       MET  55  -8.906   9.753   2.922
  394   1HE   MET  55          1HE       MET  55  -7.090  11.004   4.216
  395   2HE   MET  55          2HE       MET  55  -6.503  12.451   3.400
  396   3HE   MET  55          3HE       MET  55  -6.842  10.997   2.465
  397    H    ASP  56           H        ASP  56 -10.553   9.162  -1.586
  398    HA   ASP  56           HA       ASP  56 -13.462   8.523  -1.421
  399   1HB   ASP  56          1HB       ASP  56 -12.144  10.205  -3.035
  400   2HB   ASP  56          2HB       ASP  56 -11.915   8.729  -3.976
  401    H    LYS  57           H        LYS  57 -10.367   7.063  -1.712
  402    HA   LYS  57           HA       LYS  57  -9.699   4.856  -2.234
  403   1HB   LYS  57          1HB       LYS  57 -12.556   4.271  -1.444
  404   2HB   LYS  57          2HB       LYS  57 -11.153   3.232  -1.219
  405   1HG   LYS  57          1HG       LYS  57 -10.469   4.350   0.645
  406   2HG   LYS  57          2HG       LYS  57 -10.943   5.921   0.002
  407   1HD   LYS  57          1HD       LYS  57 -13.384   4.771   0.295
  408   2HD   LYS  57          2HD       LYS  57 -12.514   3.990   1.614
  409   1HE   LYS  57          1HE       LYS  57 -11.675   6.469   2.095
  410   2HE   LYS  57          2HE       LYS  57 -13.170   6.891   1.239
  411   1HZ   LYS  57          1HZ       LYS  57 -12.821   5.455   3.759
  412   2HZ   LYS  57          2HZ       LYS  57 -14.072   4.927   2.738
  413   3HZ   LYS  57          3HZ       LYS  57 -14.043   6.533   3.291
  414    H    LYS  58           H        LYS  58 -11.259   6.533  -4.314
  415    HA   LYS  58           HA       LYS  58 -11.915   4.229  -6.117
  416   1HB   LYS  58          1HB       LYS  58 -13.387   6.870  -5.832
  417   2HB   LYS  58          2HB       LYS  58 -13.829   5.552  -6.919
  418   1HG   LYS  58          1HG       LYS  58 -13.527   4.462  -4.295
  419   2HG   LYS  58          2HG       LYS  58 -14.557   5.888  -4.177
  420   1HD   LYS  58          1HD       LYS  58 -15.056   3.958  -6.409
  421   2HD   LYS  58          2HD       LYS  58 -15.590   3.520  -4.786
  422   1HE   LYS  58          1HE       LYS  58 -16.237   6.266  -5.832
  423   2HE   LYS  58          2HE       LYS  58 -17.222   4.882  -6.347
  424   1HZ   LYS  58          1HZ       LYS  58 -17.779   4.357  -4.169
  425   2HZ   LYS  58          2HZ       LYS  58 -17.855   6.054  -4.171
  426   3HZ   LYS  58          3HZ       LYS  58 -16.506   5.262  -3.509
  427    H    ASP  59           H        ASP  59 -10.482   7.395  -5.687
  428    HA   ASP  59           HA       ASP  59 -10.218   8.239  -8.388
  429   1HB   ASP  59          1HB       ASP  59  -9.698   9.721  -6.590
  430   2HB   ASP  59          2HB       ASP  59  -8.560   8.576  -5.880
  431    H    LYS  60           H        LYS  60  -9.466   6.806  -9.937
  432    HA   LYS  60           HA       LYS  60  -7.297   4.908  -9.334
  433   1HB   LYS  60          1HB       LYS  60  -9.397   5.345 -11.303
  434   2HB   LYS  60          2HB       LYS  60  -7.866   4.943 -12.082
  435   1HG   LYS  60          1HG       LYS  60  -8.954   3.357  -9.749
  436   2HG   LYS  60          2HG       LYS  60  -9.341   2.959 -11.425
  437   1HD   LYS  60          1HD       LYS  60  -6.492   3.275 -10.464
  438   2HD   LYS  60          2HD       LYS  60  -7.338   1.728 -10.407
  439   1HE   LYS  60          1HE       LYS  60  -7.878   2.237 -12.935
  440   2HE   LYS  60          2HE       LYS  60  -6.476   3.319 -12.810
  441   1HZ   LYS  60          1HZ       LYS  60  -6.262   0.693 -13.248
  442   2HZ   LYS  60          2HZ       LYS  60  -6.180   0.721 -11.551
  443   3HZ   LYS  60          3HZ       LYS  60  -5.066   1.613 -12.473
  444    H    SER  61           H        SER  61  -7.041   8.049  -9.595
  445    HA   SER  61           HA       SER  61  -5.073   8.250 -11.797
  446   1HB   SER  61          1HB       SER  61  -6.943   9.927 -10.755
  447   2HB   SER  61          2HB       SER  61  -5.518  10.463  -9.868
  448    HG   SER  61           HG       SER  61  -5.138  11.529 -11.647
  449    H    ALA  62           H        ALA  62  -3.369  10.171 -10.527
  450    HA   ALA  62           HA       ALA  62  -1.746   8.340  -8.826
  451   1HB   ALA  62          1HB       ALA  62  -1.299  10.264 -10.919
  452   2HB   ALA  62          2HB       ALA  62  -0.134   9.167 -10.179
  453   3HB   ALA  62          3HB       ALA  62  -0.406  10.765  -9.484
  454    H    LYS  63           H        LYS  63  -4.140  10.169  -7.994
  455    HA   LYS  63           HA       LYS  63  -2.673  11.644  -5.828
  456   1HB   LYS  63          1HB       LYS  63  -4.251  12.634  -7.860
  457   2HB   LYS  63          2HB       LYS  63  -5.404  12.491  -6.532
  458   1HG   LYS  63          1HG       LYS  63  -4.414  14.149  -5.327
  459   2HG   LYS  63          2HG       LYS  63  -2.787  13.629  -5.770
  460   1HD   LYS  63          1HD       LYS  63  -3.235  14.573  -8.086
  461   2HD   LYS  63          2HD       LYS  63  -4.700  15.296  -7.421
  462   1HE   LYS  63          1HE       LYS  63  -2.132  15.752  -5.945
  463   2HE   LYS  63          2HE       LYS  63  -2.416  16.666  -7.440
  464   1HZ   LYS  63          1HZ       LYS  63  -3.433  17.904  -5.724
  465   2HZ   LYS  63          2HZ       LYS  63  -4.150  16.525  -5.038
  466   3HZ   LYS  63          3HZ       LYS  63  -4.701  17.119  -6.531
  467    H    GLY  64           H        GLY  64  -4.862   9.130  -6.520
  468   1HA   GLY  64          1HA       GLY  64  -6.560   9.379  -4.203
  469   2HA   GLY  64          2HA       GLY  64  -6.377   7.934  -5.188
  470    H    TYR  65           H        TYR  65  -6.479   7.945  -2.350
  471    HA   TYR  65           HA       TYR  65  -3.689   7.494  -1.449
  472   1HB   TYR  65          1HB       TYR  65  -5.335   8.756  -0.076
  473   2HB   TYR  65          2HB       TYR  65  -6.361   7.323  -0.023
  474    HD1  TYR  65           HD1      TYR  65  -6.283   6.532   2.180
  475    HD2  TYR  65           HD2      TYR  65  -2.641   7.625   0.194
  476    HE1  TYR  65           HE1      TYR  65  -4.975   5.617   4.079
  477    HE2  TYR  65           HE2      TYR  65  -1.326   6.716   2.090
  478    HH   TYR  65           HH       TYR  65  -1.967   4.757   3.989
  479    H    TYR  66           H        TYR  66  -6.698   5.695  -2.028
  480    HA   TYR  66           HA       TYR  66  -5.546   3.181  -1.042
  481   1HB   TYR  66          1HB       TYR  66  -7.817   3.389  -0.598
  482   2HB   TYR  66          2HB       TYR  66  -8.131   4.255  -2.096
  483    HD1  TYR  66           HD1      TYR  66  -8.510   1.177  -0.439
  484    HD2  TYR  66           HD2      TYR  66  -7.654   2.855  -4.295
  485    HE1  TYR  66           HE1      TYR  66  -9.236  -0.937  -1.515
  486    HE2  TYR  66           HE2      TYR  66  -8.383   0.739  -5.380
  487    HH   TYR  66           HH       TYR  66  -9.201  -1.297  -5.067
  488    H    HIS  67           H        HIS  67  -6.102   4.797  -4.129
  489    HA   HIS  67           HA       HIS  67  -5.813   2.581  -5.903
  490   1HB   HIS  67          1HB       HIS  67  -6.579   4.661  -6.748
  491   2HB   HIS  67          2HB       HIS  67  -5.232   5.542  -6.026
  492    HD1  HIS  67           HD1      HIS  67  -5.870   2.936  -8.721
  493    HD2  HIS  67           HD2      HIS  67  -3.046   5.835  -7.724
  494    HE1  HIS  67           HE1      HIS  67  -4.175   2.956 -10.596
  495    H    ALA  68           H        ALA  68  -3.286   5.047  -5.395
  496    HA   ALA  68           HA       ALA  68  -1.103   3.680  -6.411
  497   1HB   ALA  68          1HB       ALA  68  -1.650   5.841  -4.524
  498   2HB   ALA  68          2HB       ALA  68  -0.397   5.731  -5.761
  499   3HB   ALA  68          3HB       ALA  68  -0.128   5.022  -4.168
  500    H    MET  69           H        MET  69  -2.783   2.944  -3.418
  501    HA   MET  69           HA       MET  69  -0.536   1.330  -2.390
  502   1HB   MET  69          1HB       MET  69  -3.342   1.890  -1.416
  503   2HB   MET  69          2HB       MET  69  -2.112   1.029  -0.494
  504   1HG   MET  69          1HG       MET  69  -1.125   3.555  -1.570
  505   2HG   MET  69          2HG       MET  69  -2.501   3.775  -0.494
  506   1HE   MET  69          1HE       MET  69   0.386   4.907   0.006
  507   2HE   MET  69          2HE       MET  69   1.108   3.543  -0.843
  508   3HE   MET  69          3HE       MET  69   1.538   3.854   0.837
  509    H    HIS  70           H        HIS  70  -3.874   0.726  -3.555
  510    HA   HIS  70           HA       HIS  70  -3.347  -2.183  -3.377
  511   1HB   HIS  70          1HB       HIS  70  -5.815  -0.638  -4.223
  512   2HB   HIS  70          2HB       HIS  70  -5.749  -2.341  -3.768
  513    HD1  HIS  70           HD1      HIS  70  -5.969   1.066  -2.361
  514    HD2  HIS  70           HD2      HIS  70  -5.167  -2.767  -0.940
  515    HE1  HIS  70           HE1      HIS  70  -6.166   1.184   0.159
  516    H    ASP  71           H        ASP  71  -3.398   0.351  -5.750
  517    HA   ASP  71           HA       ASP  71  -3.932  -1.395  -8.036
  518   1HB   ASP  71          1HB       ASP  71  -3.053   1.456  -7.585
  519   2HB   ASP  71          2HB       ASP  71  -3.185   0.778  -9.201
  520    H    LYS  72           H        LYS  72  -2.406  -2.745  -8.874
  521    HA   LYS  72           HA       LYS  72   0.433  -2.435  -8.172
  522   1HB   LYS  72          1HB       LYS  72   0.548  -4.564  -9.579
  523   2HB   LYS  72          2HB       LYS  72  -0.505  -4.644  -8.167
  524   1HG   LYS  72          1HG       LYS  72  -2.288  -5.073  -9.469
  525   2HG   LYS  72          2HG       LYS  72  -1.987  -3.619 -10.418
  526   1HD   LYS  72          1HD       LYS  72  -0.126  -5.008 -11.571
  527   2HD   LYS  72          2HD       LYS  72  -0.947  -6.408 -10.881
  528   1HE   LYS  72          1HE       LYS  72  -2.489  -4.332 -12.447
  529   2HE   LYS  72          2HE       LYS  72  -1.673  -5.682 -13.261
  530   1HZ   LYS  72          1HZ       LYS  72  -3.604  -6.725 -12.735
  531   2HZ   LYS  72          2HZ       LYS  72  -3.923  -5.726 -11.398
  532   3HZ   LYS  72          3HZ       LYS  72  -2.793  -6.988 -11.269
  533    H    GLY  73           H        GLY  73  -1.623  -2.033 -11.028
  534   1HA   GLY  73          1HA       GLY  73   0.654  -1.526 -12.800
  535   2HA   GLY  73          2HA       GLY  73  -1.050  -1.336 -13.223
  536    H    THR  74           H        THR  74   1.194   0.126 -10.854
  537    HA   THR  74           HA       THR  74  -0.017   2.788 -11.484
  538    HB   THR  74           HB       THR  74   1.131   3.271  -9.213
  539    HG1  THR  74           1HG      THR  74   2.348   1.200  -9.524
  540   1HG2  THR  74          1HG2      THR  74  -0.689   1.869  -8.010
  541   2HG2  THR  74          2HG2      THR  74  -1.174   1.376  -9.634
  542   3HG2  THR  74          3HG2      THR  74  -1.220   3.079  -9.178
  543    H    LYS  75           H        LYS  75   1.502   4.642 -11.458
  544    HA   LYS  75           HA       LYS  75   3.594   4.664 -13.229
  545   1HB   LYS  75          1HB       LYS  75   2.523   6.527 -11.793
  546   2HB   LYS  75          2HB       LYS  75   3.716   6.102 -10.570
  547   1HG   LYS  75          1HG       LYS  75   4.361   7.993 -12.164
  548   2HG   LYS  75          2HG       LYS  75   5.530   6.689 -11.986
  549   1HD   LYS  75          1HD       LYS  75   4.820   5.672 -14.059
  550   2HD   LYS  75          2HD       LYS  75   3.472   6.802 -14.203
  551   1HE   LYS  75          1HE       LYS  75   5.111   8.687 -14.343
  552   2HE   LYS  75          2HE       LYS  75   6.427   7.496 -14.332
  553   1HZ   LYS  75          1HZ       LYS  75   5.765   6.603 -16.334
  554   2HZ   LYS  75          2HZ       LYS  75   5.424   8.248 -16.588
  555   3HZ   LYS  75          3HZ       LYS  75   4.172   7.169 -16.195
  556    H    PHE  76           H        PHE  76   3.870   3.919  -9.753
  557    HA   PHE  76           HA       PHE  76   6.530   2.631 -10.307
  558   1HB   PHE  76          1HB       PHE  76   5.575   4.108  -7.839
  559   2HB   PHE  76          2HB       PHE  76   7.186   3.450  -8.098
  560    HD1  PHE  76           HD1      PHE  76   8.524   4.340 -10.126
  561    HD2  PHE  76           HD2      PHE  76   4.990   6.238  -8.593
  562    HE1  PHE  76           HE1      PHE  76   9.135   6.436 -11.303
  563    HE2  PHE  76           HE2      PHE  76   5.601   8.331  -9.767
  564    HZ   PHE  76           HZ       PHE  76   7.668   8.424 -11.119
  565    H    LYS  77           H        LYS  77   7.047   1.126  -8.247
  566    HA   LYS  77           HA       LYS  77   4.916  -0.840  -8.152
  567   1HB   LYS  77          1HB       LYS  77   6.463  -1.976  -6.605
  568   2HB   LYS  77          2HB       LYS  77   7.293  -1.438  -8.062
  569   1HG   LYS  77          1HG       LYS  77   7.973   0.640  -6.785
  570   2HG   LYS  77          2HG       LYS  77   7.337  -0.132  -5.333
  571   1HD   LYS  77          1HD       LYS  77   9.804  -0.488  -5.635
  572   2HD   LYS  77          2HD       LYS  77   8.884  -1.990  -5.580
  573   1HE   LYS  77          1HE       LYS  77   9.305  -0.747  -8.268
  574   2HE   LYS  77          2HE       LYS  77  10.680  -1.574  -7.509
  575   1HZ   LYS  77          1HZ       LYS  77   8.571  -2.785  -8.781
  576   2HZ   LYS  77          2HZ       LYS  77   8.243  -3.003  -7.129
  577   3HZ   LYS  77          3HZ       LYS  77   9.714  -3.544  -7.785
  578    H    SER  78           H        SER  78   3.168  -0.470  -7.013
  579    HA   SER  78           HA       SER  78   2.993   1.429  -4.815
  580   1HB   SER  78          1HB       SER  78   0.619   0.217  -4.841
  581   2HB   SER  78          2HB       SER  78   1.083   1.341  -6.115
  582    HG   SER  78           HG       SER  78   0.261  -0.810  -6.761
  583    H    CYS  79           H        CYS  79   1.610   0.557  -2.833
  584    HA   CYS  79           HA       CYS  79   3.236  -1.168  -1.262
  585   1HB   CYS  79          1HB       CYS  79   0.304  -0.412  -1.067
  586   2HB   CYS  79          2HB       CYS  79   1.260  -1.078   0.254
  587    H    VAL  80           H        VAL  80  -0.097  -1.880  -2.344
  588    HA   VAL  80           HA       VAL  80   0.182  -4.738  -2.020
  589    HB   VAL  80           HB       VAL  80  -1.735  -2.881  -3.432
  590   1HG1  VAL  80          1HG1      VAL  80  -1.378  -5.719  -3.857
  591   2HG1  VAL  80          2HG1      VAL  80  -2.495  -4.608  -4.653
  592   3HG1  VAL  80          3HG1      VAL  80  -2.960  -5.396  -3.144
  593   1HG2  VAL  80          1HG2      VAL  80  -2.543  -4.732  -1.243
  594   2HG2  VAL  80          2HG2      VAL  80  -3.012  -3.056  -1.522
  595   3HG2  VAL  80          3HG2      VAL  80  -1.450  -3.423  -0.791
  596    H    GLY  81           H        GLY  81   0.781  -2.482  -4.652
  597   1HA   GLY  81          1HA       GLY  81   0.917  -4.416  -6.782
  598   2HA   GLY  81          2HA       GLY  81   1.636  -2.805  -6.817
  599    H    CYS  82           H        CYS  82   3.328  -3.042  -4.562
  600    HA   CYS  82           HA       CYS  82   5.540  -4.584  -5.724
  601   1HB   CYS  82          1HB       CYS  82   5.506  -2.295  -4.439
  602   2HB   CYS  82          2HB       CYS  82   5.470  -3.300  -2.994
  603    H    HIS  83           H        HIS  83   3.094  -4.956  -3.314
  604    HA   HIS  83           HA       HIS  83   4.363  -7.059  -1.774
  605   1HB   HIS  83          1HB       HIS  83   1.709  -5.713  -2.044
  606   2HB   HIS  83          2HB       HIS  83   1.755  -7.246  -1.194
  607    HD1  HIS  83           HD1      HIS  83   1.292  -5.945   1.077
  608    HD2  HIS  83           HD2      HIS  83   4.878  -4.953  -0.805
  609    HE1  HIS  83           HE1      HIS  83   2.687  -4.725   2.797
  610    H    LEU  84           H        LEU  84   1.650  -7.102  -4.156
  611    HA   LEU  84           HA       LEU  84   1.359  -9.897  -4.368
  612   1HB   LEU  84          1HB       LEU  84   0.454  -7.516  -5.569
  613   2HB   LEU  84          2HB       LEU  84   1.094  -8.488  -6.889
  614    HG   LEU  84           HG       LEU  84  -0.680  -9.746  -4.824
  615   1HD1  LEU  84          1HD1      LEU  84  -1.897  -8.706  -7.341
  616   2HD1  LEU  84          2HD1      LEU  84  -1.594  -7.545  -6.048
  617   3HD1  LEU  84          3HD1      LEU  84  -2.629  -8.943  -5.754
  618   1HD2  LEU  84          1HD2      LEU  84  -0.688 -11.496  -6.274
  619   2HD2  LEU  84          2HD2      LEU  84   0.695 -10.699  -7.024
  620   3HD2  LEU  84          3HD2      LEU  84  -0.927 -10.445  -7.670
  621    H    GLU  85           H        GLU  85   3.753  -7.714  -5.764
  622    HA   GLU  85           HA       GLU  85   4.890  -9.774  -7.534
  623   1HB   GLU  85          1HB       GLU  85   5.855  -7.009  -6.727
  624   2HB   GLU  85          2HB       GLU  85   6.429  -7.945  -8.107
  625   1HG   GLU  85          1HG       GLU  85   3.492  -7.426  -7.881
  626   2HG   GLU  85          2HG       GLU  85   4.534  -6.101  -8.401
  627    H    THR  86           H        THR  86   5.958  -7.951  -4.634
  628    HA   THR  86           HA       THR  86   8.445  -9.250  -4.238
  629    HB   THR  86           HB       THR  86   6.396  -7.885  -2.504
  630    HG1  THR  86           1HG      THR  86   7.691  -6.537  -3.639
  631   1HG2  THR  86          1HG2      THR  86   7.850  -8.096  -0.561
  632   2HG2  THR  86          2HG2      THR  86   9.010  -9.040  -1.496
  633   3HG2  THR  86          3HG2      THR  86   7.419  -9.708  -1.136
  634    H    ALA  87           H        ALA  87   5.228 -10.447  -3.899
  635    HA   ALA  87           HA       ALA  87   5.987 -12.641  -2.069
  636   1HB   ALA  87          1HB       ALA  87   3.468 -13.185  -2.752
  637   2HB   ALA  87          2HB       ALA  87   3.508 -11.518  -3.326
  638   3HB   ALA  87          3HB       ALA  87   3.833 -11.874  -1.630
  639    H    GLY  88           H        GLY  88   5.191 -12.112  -5.471
  640   1HA   GLY  88          1HA       GLY  88   5.443 -13.496  -7.346
  641   2HA   GLY  88          2HA       GLY  88   6.693 -14.326  -6.418
  642    H    ALA  89           H        ALA  89   6.257 -16.467  -6.373
  643    HA   ALA  89           HA       ALA  89   3.427 -17.392  -6.389
  644   1HB   ALA  89          1HB       ALA  89   5.452 -18.140  -7.895
  645   2HB   ALA  89          2HB       ALA  89   4.315 -19.352  -7.303
  646   3HB   ALA  89          3HB       ALA  89   5.870 -19.132  -6.500
  647    H    ASP  90           H        ASP  90   4.206 -16.257  -3.942
  648    HA   ASP  90           HA       ASP  90   4.574 -18.655  -2.194
  649   1HB   ASP  90          1HB       ASP  90   6.442 -17.095  -2.125
  650   2HB   ASP  90          2HB       ASP  90   5.349 -15.744  -1.840
  651    H    ALA  91           H        ALA  91   2.220 -18.873  -2.396
  652    HA   ALA  91           HA       ALA  91   0.148 -17.164  -1.889
  653   1HB   ALA  91          1HB       ALA  91   0.737 -19.942  -0.861
  654   2HB   ALA  91          2HB       ALA  91  -0.291 -19.472  -2.216
  655   3HB   ALA  91          3HB       ALA  91  -0.818 -19.168  -0.560
  656    H    ALA  92           H        ALA  92   2.608 -18.107   0.427
  657    HA   ALA  92           HA       ALA  92   1.206 -17.096   2.781
  658   1HB   ALA  92          1HB       ALA  92   4.082 -17.160   3.017
  659   2HB   ALA  92          2HB       ALA  92   3.544 -18.582   2.121
  660   3HB   ALA  92          3HB       ALA  92   2.904 -18.261   3.733
  661    H    LYS  93           H        LYS  93   3.676 -15.939   0.537
  662    HA   LYS  93           HA       LYS  93   4.066 -13.370   1.821
  663   1HB   LYS  93          1HB       LYS  93   4.804 -14.825  -0.665
  664   2HB   LYS  93          2HB       LYS  93   4.926 -13.072  -0.725
  665   1HG   LYS  93          1HG       LYS  93   6.009 -14.070   1.762
  666   2HG   LYS  93          2HG       LYS  93   6.786 -14.868   0.395
  667   1HD   LYS  93          1HD       LYS  93   6.602 -12.181  -0.373
  668   2HD   LYS  93          2HD       LYS  93   7.079 -12.127   1.325
  669   1HE   LYS  93          1HE       LYS  93   9.149 -12.296   0.173
  670   2HE   LYS  93          2HE       LYS  93   8.811 -13.973   0.645
  671   1HZ   LYS  93          1HZ       LYS  93   9.108 -14.260  -1.585
  672   2HZ   LYS  93          2HZ       LYS  93   8.570 -12.698  -1.982
  673   3HZ   LYS  93          3HZ       LYS  93   7.447 -13.910  -1.584
  674    H    LYS  94           H        LYS  94   1.834 -14.719  -0.518
  675    HA   LYS  94           HA       LYS  94   0.883 -12.156  -1.549
  676   1HB   LYS  94          1HB       LYS  94   0.559 -14.977  -2.006
  677   2HB   LYS  94          2HB       LYS  94  -1.037 -14.243  -1.847
  678   1HG   LYS  94          1HG       LYS  94  -0.836 -13.108  -3.799
  679   2HG   LYS  94          2HG       LYS  94   0.832 -12.646  -3.459
  680   1HD   LYS  94          1HD       LYS  94   1.590 -14.258  -4.830
  681   2HD   LYS  94          2HD       LYS  94   0.721 -15.484  -3.904
  682   1HE   LYS  94          1HE       LYS  94  -1.362 -14.900  -5.190
  683   2HE   LYS  94          2HE       LYS  94  -0.374 -13.830  -6.204
  684   1HZ   LYS  94          1HZ       LYS  94  -0.094 -16.757  -5.833
  685   2HZ   LYS  94          2HZ       LYS  94   1.149 -15.802  -6.488
  686   3HZ   LYS  94          3HZ       LYS  94  -0.350 -15.911  -7.280
  687    H    LYS  95           H        LYS  95   0.170 -14.200   1.189
  688    HA   LYS  95           HA       LYS  95  -2.387 -12.836   1.785
  689   1HB   LYS  95          1HB       LYS  95  -2.647 -14.577   3.338
  690   2HB   LYS  95          2HB       LYS  95  -1.645 -15.342   2.107
  691   1HG   LYS  95          1HG       LYS  95  -0.255 -15.849   3.825
  692   2HG   LYS  95          2HG       LYS  95   0.244 -14.161   3.719
  693   1HD   LYS  95          1HD       LYS  95  -0.332 -14.433   5.993
  694   2HD   LYS  95          2HD       LYS  95  -1.758 -13.675   5.284
  695   1HE   LYS  95          1HE       LYS  95  -2.956 -15.417   6.114
  696   2HE   LYS  95          2HE       LYS  95  -2.146 -16.440   4.911
  697   1HZ   LYS  95          1HZ       LYS  95  -1.760 -17.216   7.201
  698   2HZ   LYS  95          2HZ       LYS  95  -1.020 -15.732   7.569
  699   3HZ   LYS  95          3HZ       LYS  95  -0.320 -16.772   6.422
  700    H    GLU  96           H        GLU  96   0.972 -12.562   2.520
  701    HA   GLU  96           HA       GLU  96   0.513 -10.956   4.976
  702   1HB   GLU  96          1HB       GLU  96   2.917 -11.191   5.197
  703   2HB   GLU  96          2HB       GLU  96   2.276 -12.751   4.715
  704   1HG   GLU  96          1HG       GLU  96   2.900 -12.333   2.413
  705   2HG   GLU  96          2HG       GLU  96   3.449 -10.709   2.829
  706    H    LEU  97           H        LEU  97   1.955 -10.678   1.759
  707    HA   LEU  97           HA       LEU  97   2.473  -7.813   1.983
  708   1HB   LEU  97          1HB       LEU  97   2.418  -9.691  -0.390
  709   2HB   LEU  97          2HB       LEU  97   3.222  -8.122  -0.322
  710    HG   LEU  97           HG       LEU  97   3.936 -10.654   1.149
  711   1HD1  LEU  97          1HD1      LEU  97   5.317  -8.711  -0.692
  712   2HD1  LEU  97          2HD1      LEU  97   5.073 -10.444  -0.912
  713   3HD1  LEU  97          3HD1      LEU  97   6.224  -9.860   0.292
  714   1HD2  LEU  97          1HD2      LEU  97   4.892  -7.839   1.769
  715   2HD2  LEU  97          2HD2      LEU  97   5.507  -9.319   2.504
  716   3HD2  LEU  97          3HD2      LEU  97   3.847  -8.808   2.807
  717    H    THR  98           H        THR  98   0.421  -9.602  -0.338
  718    HA   THR  98           HA       THR  98  -1.207  -7.176  -0.746
  719    HB   THR  98           HB       THR  98  -2.263  -8.648  -2.474
  720    HG1  THR  98           1HG      THR  98  -2.011 -10.703  -2.253
  721   1HG2  THR  98          1HG2      THR  98   0.599  -9.140  -2.944
  722   2HG2  THR  98          2HG2      THR  98   0.229  -7.485  -2.462
  723   3HG2  THR  98          3HG2      THR  98  -0.547  -8.181  -3.883
  724    H    GLY  99           H        GLY  99  -1.279  -9.751   1.427
  725   1HA   GLY  99          1HA       GLY  99  -4.010 -10.475   1.522
  726   2HA   GLY  99          2HA       GLY  99  -2.942 -10.462   2.925
  727    H    CYS 100           H        CYS 100  -5.760  -9.209   1.854
  728    HA   CYS 100           HA       CYS 100  -5.469  -6.453   2.788
  729   1HB   CYS 100          1HB       CYS 100  -8.142  -7.648   2.590
  730   2HB   CYS 100          2HB       CYS 100  -7.532  -6.186   1.869
  731    H    LYS 101           H        LYS 101  -7.566  -9.118   3.900
  732    HA   LYS 101           HA       LYS 101  -7.617  -7.825   6.580
  733   1HB   LYS 101          1HB       LYS 101  -9.395  -9.415   4.881
  734   2HB   LYS 101          2HB       LYS 101  -9.404  -9.938   6.565
  735   1HG   LYS 101          1HG       LYS 101 -10.721  -8.188   7.077
  736   2HG   LYS 101          2HG       LYS 101  -9.425  -7.097   6.584
  737   1HD   LYS 101          1HD       LYS 101 -11.573  -6.708   5.346
  738   2HD   LYS 101          2HD       LYS 101 -10.217  -7.105   4.289
  739   1HE   LYS 101          1HE       LYS 101 -11.477  -9.556   5.127
  740   2HE   LYS 101          2HE       LYS 101 -12.706  -8.463   4.459
  741   1HZ   LYS 101          1HZ       LYS 101 -11.378  -9.848   2.804
  742   2HZ   LYS 101          2HZ       LYS 101 -10.073  -8.818   3.160
  743   3HZ   LYS 101          3HZ       LYS 101 -11.503  -8.185   2.494
  744    H    GLY 102           H        GLY 102  -5.450  -9.772   5.395
  745   1HA   GLY 102          1HA       GLY 102  -5.101 -11.241   7.912
  746   2HA   GLY 102          2HA       GLY 102  -5.383 -12.270   6.508
  747    H    SER 103           H        SER 103  -3.577  -9.214   6.493
  748    HA   SER 103           HA       SER 103  -1.136 -10.789   5.783
  749   1HB   SER 103          1HB       SER 103  -0.903  -9.408   3.984
  750   2HB   SER 103          2HB       SER 103  -2.627  -9.200   4.199
  751    HG   SER 103           HG       SER 103  -1.471  -7.203   4.075
  752    H    LYS 104           H        LYS 104   0.379  -8.299   5.618
  753    HA   LYS 104           HA       LYS 104   0.915  -7.875   8.524
  754   1HB   LYS 104          1HB       LYS 104   2.426  -7.346   5.947
  755   2HB   LYS 104          2HB       LYS 104   3.062  -7.002   7.555
  756   1HG   LYS 104          1HG       LYS 104   2.012  -9.737   7.241
  757   2HG   LYS 104          2HG       LYS 104   3.412  -9.382   6.230
  758   1HD   LYS 104          1HD       LYS 104   4.783  -8.896   8.078
  759   2HD   LYS 104          2HD       LYS 104   3.404  -8.629   9.146
  760   1HE   LYS 104          1HE       LYS 104   3.823 -11.347   7.912
  761   2HE   LYS 104          2HE       LYS 104   4.723 -10.880   9.369
  762   1HZ   LYS 104          1HZ       LYS 104   2.852 -10.750  10.607
  763   2HZ   LYS 104          2HZ       LYS 104   2.259 -11.861   9.465
  764   3HZ   LYS 104          3HZ       LYS 104   1.891 -10.208   9.318
  765    H    CYS 105           H        CYS 105  -0.088  -6.386   5.576
  766    HA   CYS 105           HA       CYS 105   0.310  -3.625   6.395
  767   1HB   CYS 105          1HB       CYS 105  -0.039  -5.092   4.083
  768   2HB   CYS 105          2HB       CYS 105  -1.581  -4.292   4.257
  769    H    HIS 106           H        HIS 106  -2.274  -5.990   6.662
  770    HA   HIS 106           HA       HIS 106  -4.041  -3.858   7.825
  771   1HB   HIS 106          1HB       HIS 106  -4.474  -6.118   5.925
  772   2HB   HIS 106          2HB       HIS 106  -5.789  -5.735   7.038
  773    HD1  HIS 106           HD1      HIS 106  -5.144  -2.612   7.094
  774    HD2  HIS 106           HD2      HIS 106  -5.760  -4.918   3.655
  775    HE1  HIS 106           HE1      HIS 106  -5.740  -0.992   5.248
  776    H    SER 107           H        SER 107  -2.357  -4.947   9.627
  777    HA   SER 107           HA       SER 107  -2.863  -7.439  10.803
  778   1HB   SER 107          1HB       SER 107  -1.182  -5.569  11.365
  779   2HB   SER 107          2HB       SER 107  -2.467  -4.867  12.345
  780    HG   SER 107           HG       SER 107  -1.545  -6.186  13.757
  781    HHA  HEC 201           HHA      HEC 201   6.017   8.689   5.699
  782    HHB  HEC 201           HHB      HEC 201  12.108   9.759   4.765
  783    HHC  HEC 201           HHC      HEC 201  12.525   4.658   1.091
  784    HHD  HEC 201           HHD      HEC 201   6.391   3.627   1.796
  785   1HMA  HEC 201          1HMA      HEC 201  10.323  11.919   6.462
  786   2HMA  HEC 201          2HMA      HEC 201  11.375  10.582   6.926
  787   3HMA  HEC 201          3HMA      HEC 201   9.879  10.877   7.815
  788   1HAA  HEC 201          1HAA      HEC 201   6.644   9.740   7.375
  789   2HAA  HEC 201          2HAA      HEC 201   7.924  10.867   7.817
  790   1HBA  HEC 201          1HBA      HEC 201   6.661  11.437   5.222
  791   2HBA  HEC 201          2HBA      HEC 201   5.573  11.585   6.601
  792   1HMB  HEC 201          1HMB      HEC 201  14.997   9.050   2.910
  793   2HMB  HEC 201          2HMB      HEC 201  14.055   9.568   4.308
  794   3HMB  HEC 201          3HMB      HEC 201  15.079   8.136   4.416
  795    HAB  HEC 201           HAB      HEC 201  14.361   5.391   1.217
  796   1HBB  HEC 201          1HBB      HEC 201  15.639   6.476   3.702
  797   2HBB  HEC 201          2HBB      HEC 201  16.679   5.984   2.366
  798   3HBB  HEC 201          3HBB      HEC 201  15.583   4.817   3.107
  799   1HMC  HEC 201          1HMC      HEC 201  10.675   1.624  -0.275
  800   2HMC  HEC 201          2HMC      HEC 201  11.548   3.078  -0.761
  801   3HMC  HEC 201          3HMC      HEC 201  12.007   2.225   0.713
  802    HAC  HEC 201           HAC      HEC 201   7.026   2.221   0.650
  803   1HBC  HEC 201          1HBC      HEC 201   9.187   0.467  -0.382
  804   2HBC  HEC 201          2HBC      HEC 201   7.692   0.041   0.450
  805   3HBC  HEC 201          3HBC      HEC 201   9.078   0.622   1.370
  806   1HMD  HEC 201          1HMD      HEC 201   3.254   4.633   4.094
  807   2HMD  HEC 201          2HMD      HEC 201   3.850   4.228   2.486
  808   3HMD  HEC 201          3HMD      HEC 201   4.451   3.353   3.897
  809   1HAD  HEC 201          1HAD      HEC 201   4.292   7.916   5.708
  810   2HAD  HEC 201          2HAD      HEC 201   3.167   7.190   4.569
  811   1HBD  HEC 201          1HBD      HEC 201   3.067   5.153   5.848
  812   2HBD  HEC 201          2HBD      HEC 201   4.402   5.671   6.878
  813    HHA  HEC 202           HHA      HEC 202   1.524   7.753  -9.511
  814    HHB  HEC 202           HHB      HEC 202   2.763   4.131  -4.898
  815    HHC  HEC 202           HHC      HEC 202   4.475   8.929  -1.218
  816    HHD  HEC 202           HHD      HEC 202   2.899  12.924  -5.764
  817   1HMA  HEC 202          1HMA      HEC 202   0.285   3.330  -7.405
  818   2HMA  HEC 202          2HMA      HEC 202   1.107   3.251  -5.848
  819   3HMA  HEC 202          3HMA      HEC 202   1.985   2.874  -7.329
  820   1HAA  HEC 202          1HAA      HEC 202   0.979   5.433 -10.042
  821   2HAA  HEC 202          2HAA      HEC 202  -0.090   4.524  -9.011
  822   1HBA  HEC 202          1HBA      HEC 202  -1.375   6.540  -8.514
  823   2HBA  HEC 202          2HBA      HEC 202  -0.278   7.495  -9.509
  824   1HMB  HEC 202          1HMB      HEC 202   2.914   3.566  -2.064
  825   2HMB  HEC 202          2HMB      HEC 202   4.155   3.310  -3.290
  826   3HMB  HEC 202          3HMB      HEC 202   4.617   3.712  -1.635
  827    HAB  HEC 202           HAB      HEC 202   4.212   7.008   0.072
  828   1HBB  HEC 202          1HBB      HEC 202   6.550   6.119  -1.348
  829   2HBB  HEC 202          2HBB      HEC 202   6.323   5.096   0.070
  830   3HBB  HEC 202          3HBB      HEC 202   6.457   6.845   0.258
  831   1HMC  HEC 202          1HMC      HEC 202   3.984  11.957  -0.495
  832   2HMC  HEC 202          2HMC      HEC 202   5.418  10.984  -0.820
  833   3HMC  HEC 202          3HMC      HEC 202   5.366  12.674  -1.322
  834    HAC  HEC 202           HAC      HEC 202   2.380  13.813  -3.588
  835   1HBC  HEC 202          1HBC      HEC 202   3.799  13.869  -1.416
  836   2HBC  HEC 202          2HBC      HEC 202   3.543  15.390  -2.271
  837   3HBC  HEC 202          3HBC      HEC 202   5.074  14.531  -2.440
  838   1HMD  HEC 202          1HMD      HEC 202   2.387  12.987  -9.792
  839   2HMD  HEC 202          2HMD      HEC 202   3.031  13.535  -8.242
  840   3HMD  HEC 202          3HMD      HEC 202   1.286  13.428  -8.486
  841   1HAD  HEC 202          1HAD      HEC 202   1.981   9.251 -10.751
  842   2HAD  HEC 202          2HAD      HEC 202   1.252  10.839 -10.924
  843   1HBD  HEC 202          1HBD      HEC 202   3.814  11.559 -10.446
  844   2HBD  HEC 202          2HBD      HEC 202   4.075  10.002 -11.231
  845    HHA  HEC 203           HHA      HEC 203   7.130  -6.914   4.690
  846    HHB  HEC 203           HHB      HEC 203   2.739  -2.144   4.997
  847    HHC  HEC 203           HHC      HEC 203   4.703   0.010  -0.361
  848    HHD  HEC 203           HHD      HEC 203   8.993  -4.580  -0.837
  849   1HMA  HEC 203          1HMA      HEC 203   3.404  -3.387   7.600
  850   2HMA  HEC 203          2HMA      HEC 203   3.131  -5.130   7.636
  851   3HMA  HEC 203          3HMA      HEC 203   2.162  -4.106   6.575
  852   1HAA  HEC 203          1HAA      HEC 203   4.868  -6.179   7.793
  853   2HAA  HEC 203          2HAA      HEC 203   4.672  -7.386   6.530
  854   1HBA  HEC 203          1HBA      HEC 203   6.924  -7.763   6.352
  855   2HBA  HEC 203          2HBA      HEC 203   7.337  -6.083   6.699
  856   1HMB  HEC 203          1HMB      HEC 203   1.060  -0.115   3.793
  857   2HMB  HEC 203          2HMB      HEC 203   2.214  -0.164   5.125
  858   3HMB  HEC 203          3HMB      HEC 203   2.136   1.253   4.078
  859    HAB  HEC 203           HAB      HEC 203   2.757   0.837   0.224
  860   1HBB  HEC 203          1HBB      HEC 203   4.642   2.232   0.402
  861   2HBB  HEC 203          2HBB      HEC 203   4.412   2.482   2.133
  862   3HBB  HEC 203          3HBB      HEC 203   3.345   3.283   0.975
  863   1HMC  HEC 203          1HMC      HEC 203   5.620   0.293  -2.099
  864   2HMC  HEC 203          2HMC      HEC 203   7.276   0.159  -2.695
  865   3HMC  HEC 203          3HMC      HEC 203   5.998  -0.823  -3.411
  866    HAC  HEC 203           HAC      HEC 203   9.266  -3.355  -2.464
  867   1HBC  HEC 203          1HBC      HEC 203   8.154  -1.058  -4.053
  868   2HBC  HEC 203          2HBC      HEC 203   9.824  -1.609  -3.921
  869   3HBC  HEC 203          3HBC      HEC 203   9.075  -0.730  -2.588
  870   1HMD  HEC 203          1HMD      HEC 203  10.374  -6.035  -0.256
  871   2HMD  HEC 203          2HMD      HEC 203   9.962  -7.703   0.142
  872   3HMD  HEC 203          3HMD      HEC 203  11.018  -6.777   1.209
  873   1HAD  HEC 203          1HAD      HEC 203  10.184  -7.809   3.305
  874   2HAD  HEC 203          2HAD      HEC 203   8.694  -7.970   4.228
  875   1HBD  HEC 203          1HBD      HEC 203   7.749  -9.240   2.223
  876   2HBD  HEC 203          2HBD      HEC 203   9.401  -9.294   1.605
  877    HHA  HEC 204           HHA      HEC 204  -6.865   2.110   3.975
  878    HHB  HEC 204           HHB      HEC 204  -9.990  -2.254   0.779
  879    HHC  HEC 204           HHC      HEC 204  -4.660  -5.897   0.942
  880    HHD  HEC 204           HHD      HEC 204  -1.457  -0.985   2.794
  881   1HMA  HEC 204          1HMA      HEC 204 -11.370  -0.875   1.305
  882   2HMA  HEC 204          2HMA      HEC 204 -11.084   0.834   0.966
  883   3HMA  HEC 204          3HMA      HEC 204 -11.701   0.337   2.543
  884   1HAA  HEC 204          1HAA      HEC 204 -10.211   1.948   4.292
  885   2HAA  HEC 204          2HAA      HEC 204  -8.659   2.712   3.956
  886   1HBA  HEC 204          1HBA      HEC 204  -9.380   3.167   1.640
  887   2HBA  HEC 204          2HBA      HEC 204 -10.923   2.387   1.968
  888   1HMB  HEC 204          1HMB      HEC 204 -10.435  -3.977  -0.372
  889   2HMB  HEC 204          2HMB      HEC 204  -9.994  -5.684  -0.419
  890   3HMB  HEC 204          3HMB      HEC 204  -9.537  -4.617  -1.748
  891    HAB  HEC 204           HAB      HEC 204  -6.296  -6.994   0.191
  892   1HBB  HEC 204          1HBB      HEC 204  -6.708  -7.520  -2.311
  893   2HBB  HEC 204          2HBB      HEC 204  -5.475  -6.326  -1.903
  894   3HBB  HEC 204          3HBB      HEC 204  -7.063  -5.799  -2.463
  895   1HMC  HEC 204          1HMC      HEC 204  -1.216  -5.700   0.387
  896   2HMC  HEC 204          2HMC      HEC 204  -1.701  -6.327   1.963
  897   3HMC  HEC 204          3HMC      HEC 204  -2.817  -6.407   0.599
  898    HAC  HEC 204           HAC      HEC 204  -0.365  -2.474   3.022
  899   1HBC  HEC 204          1HBC      HEC 204   0.254  -2.549   0.553
  900   2HBC  HEC 204          2HBC      HEC 204   0.509  -4.283   0.747
  901   3HBC  HEC 204          3HBC      HEC 204   1.505  -3.139   1.649
  902   1HMD  HEC 204          1HMD      HEC 204  -1.192   1.098   4.511
  903   2HMD  HEC 204          2HMD      HEC 204  -1.076   1.591   2.823
  904   3HMD  HEC 204          3HMD      HEC 204  -1.715   2.711   4.027
  905   1HAD  HEC 204          1HAD      HEC 204  -3.844   3.871   3.620
  906   2HAD  HEC 204          2HAD      HEC 204  -5.461   3.456   4.175
  907   1HBD  HEC 204          1HBD      HEC 204  -4.327   2.490   6.258
  908   2HBD  HEC 204          2HBD      HEC 204  -2.881   3.339   5.722
  Start of MODEL   15
    1   1H    ALA   1          1H        ALA   1  20.216  15.184   3.602
    2   2H    ALA   1          2H        ALA   1  19.869  15.388   1.951
    3   3H    ALA   1          3H        ALA   1  21.387  14.801   2.436
    4    HA   ALA   1           HA       ALA   1  19.578  13.148   1.572
    5   1HB   ALA   1          1HB       ALA   1  20.748  12.040   3.977
    6   2HB   ALA   1          2HB       ALA   1  21.888  13.141   3.203
    7   3HB   ALA   1          3HB       ALA   1  21.224  11.780   2.300
    8    HA   PRO   2           HA       PRO   2  16.045  13.217   4.228
    9   1HB   PRO   2          1HB       PRO   2  14.860  10.928   3.316
   10   2HB   PRO   2          2HB       PRO   2  14.838  12.450   2.414
   11   1HG   PRO   2          1HG       PRO   2  16.542  10.047   2.028
   12   2HG   PRO   2          2HG       PRO   2  15.830  11.130   0.822
   13   1HD   PRO   2          1HD       PRO   2  18.454  11.223   1.589
   14   2HD   PRO   2          2HD       PRO   2  17.558  12.619   0.950
   15    H    LYS   3           H        LYS   3  15.814  12.463   6.312
   16    HA   LYS   3           HA       LYS   3  17.363  10.045   7.099
   17   1HB   LYS   3          1HB       LYS   3  15.936  12.172   8.708
   18   2HB   LYS   3          2HB       LYS   3  16.997  10.924   9.356
   19   1HG   LYS   3          1HG       LYS   3  18.336  12.309   7.211
   20   2HG   LYS   3          2HG       LYS   3  17.751  13.478   8.394
   21   1HD   LYS   3          1HD       LYS   3  19.660  12.951   9.519
   22   2HD   LYS   3          2HD       LYS   3  18.749  11.530  10.033
   23   1HE   LYS   3          1HE       LYS   3  20.260  10.217   8.978
   24   2HE   LYS   3          2HE       LYS   3  19.816  10.976   7.436
   25   1HZ   LYS   3          1HZ       LYS   3  21.382  12.664   7.727
   26   2HZ   LYS   3          2HZ       LYS   3  22.211  11.266   8.221
   27   3HZ   LYS   3          3HZ       LYS   3  21.582  12.337   9.379
   28    H    ALA   4           H        ALA   4  15.856   8.518   6.230
   29    HA   ALA   4           HA       ALA   4  13.133   8.250   6.440
   30   1HB   ALA   4          1HB       ALA   4  13.555   6.012   6.058
   31   2HB   ALA   4          2HB       ALA   4  14.747   5.914   7.355
   32   3HB   ALA   4          3HB       ALA   4  15.190   6.626   5.803
   33    HA   PRO   5           HA       PRO   5  12.344   8.419  10.766
   34   1HB   PRO   5          1HB       PRO   5   9.690   7.740  10.664
   35   2HB   PRO   5          2HB       PRO   5  10.316   9.341  10.238
   36   1HG   PRO   5          1HG       PRO   5   9.316   7.195   8.489
   37   2HG   PRO   5          2HG       PRO   5   9.416   8.933   8.209
   38   1HD   PRO   5          1HD       PRO   5  11.161   6.957   7.197
   39   2HD   PRO   5          2HD       PRO   5  11.364   8.716   7.097
   40    H    ALA   6           H        ALA   6  11.720   6.988  12.532
   41    HA   ALA   6           HA       ALA   6  12.767   4.378  12.378
   42   1HB   ALA   6          1HB       ALA   6  10.633   5.332  14.298
   43   2HB   ALA   6          2HB       ALA   6  12.298   5.909  14.378
   44   3HB   ALA   6          3HB       ALA   6  11.945   4.197  14.616
   45    H    ASP   7           H        ASP   7  11.764   2.356  12.259
   46    HA   ASP   7           HA       ASP   7   9.574   2.008  10.479
   47   1HB   ASP   7          1HB       ASP   7  10.486   0.067  12.611
   48   2HB   ASP   7          2HB       ASP   7   9.878  -0.298  10.999
   49    H    GLY   8           H        GLY   8   7.470   1.063  11.056
   50   1HA   GLY   8          1HA       GLY   8   5.713   0.587  12.658
   51   2HA   GLY   8          2HA       GLY   8   6.555   1.603  13.828
   52    H    LEU   9           H        LEU   9   6.448   2.962  10.700
   53    HA   LEU   9           HA       LEU   9   4.959   5.253  11.508
   54   1HB   LEU   9          1HB       LEU   9   6.395   4.349   9.275
   55   2HB   LEU   9          2HB       LEU   9   4.761   4.630   8.668
   56    HG   LEU   9           HG       LEU   9   5.917   6.692  10.483
   57   1HD1  LEU   9          1HD1      LEU   9   6.998   7.768   8.460
   58   2HD1  LEU   9          2HD1      LEU   9   6.771   6.238   7.608
   59   3HD1  LEU   9          3HD1      LEU   9   7.812   6.310   9.032
   60   1HD2  LEU   9          1HD2      LEU   9   4.794   7.857   8.214
   61   2HD2  LEU   9          2HD2      LEU   9   3.977   7.610   9.760
   62   3HD2  LEU   9          3HD2      LEU   9   3.806   6.415   8.475
   63    H    LYS  10           H        LYS  10   2.784   5.483  11.755
   64    HA   LYS  10           HA       LYS  10   1.054   3.232  10.849
   65   1HB   LYS  10          1HB       LYS  10   1.175   5.091  13.096
   66   2HB   LYS  10          2HB       LYS  10  -0.444   4.963  12.407
   67   1HG   LYS  10          1HG       LYS  10   0.148   2.364  12.422
   68   2HG   LYS  10          2HG       LYS  10   1.214   2.866  13.735
   69   1HD   LYS  10          1HD       LYS  10  -0.681   2.550  14.986
   70   2HD   LYS  10          2HD       LYS  10  -1.022   4.197  14.453
   71   1HE   LYS  10          1HE       LYS  10  -2.396   3.377  12.613
   72   2HE   LYS  10          2HE       LYS  10  -1.966   1.699  12.999
   73   1HZ   LYS  10          1HZ       LYS  10  -4.099   2.424  14.006
   74   2HZ   LYS  10          2HZ       LYS  10  -3.243   3.574  14.917
   75   3HZ   LYS  10          3HZ       LYS  10  -2.953   1.916  15.149
   76    H    MET  11           H        MET  11   0.114   3.548   8.918
   77    HA   MET  11           HA       MET  11  -0.491   6.264   7.908
   78   1HB   MET  11          1HB       MET  11  -0.247   3.480   6.904
   79   2HB   MET  11          2HB       MET  11  -1.461   4.466   6.088
   80   1HG   MET  11          1HG       MET  11   0.371   6.267   5.920
   81   2HG   MET  11          2HG       MET  11   1.499   4.978   6.342
   82   1HE   MET  11          1HE       MET  11   2.176   3.249   5.241
   83   2HE   MET  11          2HE       MET  11   1.989   2.838   3.538
   84   3HE   MET  11          3HE       MET  11   0.781   2.302   4.704
   85    H    ASP  12           H        ASP  12  -2.253   6.976   9.192
   86    HA   ASP  12           HA       ASP  12  -4.645   5.171   9.287
   87   1HB   ASP  12          1HB       ASP  12  -5.252   6.910  11.118
   88   2HB   ASP  12          2HB       ASP  12  -3.964   5.762  11.453
   89    H    LYS  13           H        LYS  13  -3.664   7.255   7.164
   90    HA   LYS  13           HA       LYS  13  -5.347   9.481   7.004
   91   1HB   LYS  13          1HB       LYS  13  -4.181   7.540   5.023
   92   2HB   LYS  13          2HB       LYS  13  -5.152   8.901   4.467
   93   1HG   LYS  13          1HG       LYS  13  -2.703   9.106   6.247
   94   2HG   LYS  13          2HG       LYS  13  -2.736   9.464   4.519
   95   1HD   LYS  13          1HD       LYS  13  -4.557  11.163   5.014
   96   2HD   LYS  13          2HD       LYS  13  -4.210  10.918   6.726
   97   1HE   LYS  13          1HE       LYS  13  -1.778  11.478   6.202
   98   2HE   LYS  13          2HE       LYS  13  -2.340  12.004   4.603
   99   1HZ   LYS  13          1HZ       LYS  13  -3.473  13.742   5.458
  100   2HZ   LYS  13          2HZ       LYS  13  -2.347  13.604   6.724
  101   3HZ   LYS  13          3HZ       LYS  13  -3.896  12.922   6.881
  102    H    THR  14           H        THR  14  -6.116   6.090   6.471
  103    HA   THR  14           HA       THR  14  -8.948   6.856   5.825
  104    HB   THR  14           HB       THR  14  -8.939   4.490   4.832
  105    HG1  THR  14           1HG      THR  14  -7.176   3.554   5.624
  106   1HG2  THR  14          1HG2      THR  14  -7.188   6.709   3.767
  107   2HG2  THR  14          2HG2      THR  14  -8.868   6.364   3.351
  108   3HG2  THR  14          3HG2      THR  14  -7.586   5.271   2.826
  109    H    LYS  15           H        LYS  15 -10.485   4.950   6.498
  110    HA   LYS  15           HA       LYS  15 -10.498   4.705   9.339
  111   1HB   LYS  15          1HB       LYS  15 -11.955   3.648   6.983
  112   2HB   LYS  15          2HB       LYS  15 -12.096   2.681   8.451
  113   1HG   LYS  15          1HG       LYS  15 -13.649   4.139   9.179
  114   2HG   LYS  15          2HG       LYS  15 -12.374   5.352   9.288
  115   1HD   LYS  15          1HD       LYS  15 -12.920   5.355   6.595
  116   2HD   LYS  15          2HD       LYS  15 -14.515   5.059   7.289
  117   1HE   LYS  15          1HE       LYS  15 -13.689   7.028   8.947
  118   2HE   LYS  15          2HE       LYS  15 -12.797   7.482   7.481
  119   1HZ   LYS  15          1HZ       LYS  15 -15.095   6.832   6.392
  120   2HZ   LYS  15          2HZ       LYS  15 -14.799   8.401   6.973
  121   3HZ   LYS  15          3HZ       LYS  15 -15.684   7.296   7.913
  122    H    GLN  16           H        GLN  16  -8.978   2.794   6.845
  123    HA   GLN  16           HA       GLN  16  -8.330   0.627   8.795
  124   1HB   GLN  16          1HB       GLN  16  -8.386   0.943   5.798
  125   2HB   GLN  16          2HB       GLN  16  -7.456  -0.367   6.528
  126   1HG   GLN  16          1HG       GLN  16  -9.845  -0.517   7.894
  127   2HG   GLN  16          2HG       GLN  16 -10.367  -0.059   6.273
  128   1HE2  GLN  16          2HE2      GLN  16  -7.560  -2.093   7.229
  129   2HE2  GLN  16          1HE2      GLN  16  -8.077  -3.470   6.380
  130    HA   PRO  17           HA       PRO  17  -4.572   3.307   8.674
  131   1HB   PRO  17          1HB       PRO  17  -3.904   2.851  11.296
  132   2HB   PRO  17          2HB       PRO  17  -5.025   4.129  10.782
  133   1HG   PRO  17          1HG       PRO  17  -5.626   1.409  11.854
  134   2HG   PRO  17          2HG       PRO  17  -6.393   2.962  12.230
  135   1HD   PRO  17          1HD       PRO  17  -7.523   1.184  10.550
  136   2HD   PRO  17          2HD       PRO  17  -7.686   2.941  10.318
  137    H    VAL  18           H        VAL  18  -2.645   2.437   8.022
  138    HA   VAL  18           HA       VAL  18  -2.009  -0.377   8.833
  139    HB   VAL  18           HB       VAL  18  -1.720   1.189   6.265
  140   1HG1  VAL  18          1HG1      VAL  18  -0.486  -1.507   6.885
  141   2HG1  VAL  18          2HG1      VAL  18   0.417   0.008   6.826
  142   3HG1  VAL  18          3HG1      VAL  18  -0.364  -0.611   5.370
  143   1HG2  VAL  18          1HG2      VAL  18  -3.341  -1.059   7.287
  144   2HG2  VAL  18          2HG2      VAL  18  -2.657  -1.323   5.684
  145   3HG2  VAL  18          3HG2      VAL  18  -3.689   0.075   5.983
  146    H    VAL  19           H        VAL  19   0.056  -0.709   9.644
  147    HA   VAL  19           HA       VAL  19   1.723   1.679  10.147
  148    HB   VAL  19           HB       VAL  19   1.873  -1.231  10.992
  149   1HG1  VAL  19          1HG1      VAL  19   3.979  -0.736  11.639
  150   2HG1  VAL  19          2HG1      VAL  19   3.271   0.373  12.813
  151   3HG1  VAL  19          3HG1      VAL  19   3.769   0.967  11.228
  152   1HG2  VAL  19          1HG2      VAL  19   1.295   0.973  12.902
  153   2HG2  VAL  19          2HG2      VAL  19   0.632  -0.660  12.834
  154   3HG2  VAL  19          3HG2      VAL  19   0.017   0.587  11.748
  155    H    PHE  20           H        PHE  20   3.531   2.132   8.898
  156    HA   PHE  20           HA       PHE  20   4.476   0.007   7.012
  157   1HB   PHE  20          1HB       PHE  20   3.692   2.119   6.015
  158   2HB   PHE  20          2HB       PHE  20   4.816   3.028   7.024
  159    HD1  PHE  20           HD1      PHE  20   4.874   0.075   4.705
  160    HD2  PHE  20           HD2      PHE  20   6.858   3.633   6.056
  161    HE1  PHE  20           HE1      PHE  20   6.673  -0.291   3.041
  162    HE2  PHE  20           HE2      PHE  20   8.651   3.267   4.391
  163    HZ   PHE  20           HZ       PHE  20   8.563   1.305   2.881
  164    H    ASN  21           H        ASN  21   6.364  -0.984   7.623
  165    HA   ASN  21           HA       ASN  21   8.143   0.381   9.568
  166   1HB   ASN  21          1HB       ASN  21   7.206  -2.278   8.981
  167   2HB   ASN  21          2HB       ASN  21   8.961  -2.243   8.911
  168   1HD2  ASN  21          2HD2      ASN  21   6.437  -0.749  11.023
  169   2HD2  ASN  21          1HD2      ASN  21   7.220  -1.137  12.478
  170    H    HIS  22           H        HIS  22   9.404   1.788   8.269
  171    HA   HIS  22           HA       HIS  22  10.365   1.406   5.673
  172   1HB   HIS  22          1HB       HIS  22  11.362   2.776   8.151
  173   2HB   HIS  22          2HB       HIS  22  12.396   2.746   6.724
  174    HD1  HIS  22           HD1      HIS  22   9.555   4.509   8.191
  175    HD2  HIS  22           HD2      HIS  22  11.002   3.895   4.326
  176    HE1  HIS  22           HE1      HIS  22   8.530   6.315   6.748
  177    H    SER  23           H        SER  23  11.616   0.055   8.711
  178    HA   SER  23           HA       SER  23  14.106  -0.951   7.920
  179   1HB   SER  23          1HB       SER  23  13.566  -1.328  10.146
  180   2HB   SER  23          2HB       SER  23  11.906  -1.783   9.771
  181    HG   SER  23           HG       SER  23  14.262  -3.297   9.699
  182    H    THR  24           H        THR  24  10.880  -2.373   7.375
  183    HA   THR  24           HA       THR  24  11.886  -4.711   5.969
  184    HB   THR  24           HB       THR  24   9.174  -3.988   5.307
  185    HG1  THR  24           1HG      THR  24   9.474  -4.082   8.067
  186   1HG2  THR  24          1HG2      THR  24  10.696  -6.136   6.580
  187   2HG2  THR  24          2HG2      THR  24   9.251  -6.228   5.571
  188   3HG2  THR  24          3HG2      THR  24   9.103  -5.913   7.301
  189    H    HIS  25           H        HIS  25  11.709  -1.453   5.142
  190    HA   HIS  25           HA       HIS  25  11.577  -2.093   2.227
  191   1HB   HIS  25          1HB       HIS  25  10.753   0.376   3.784
  192   2HB   HIS  25          2HB       HIS  25  10.566   0.143   2.050
  193    HD1  HIS  25           HD1      HIS  25   9.241  -1.052   5.351
  194    HD2  HIS  25           HD2      HIS  25   8.503  -1.666   1.297
  195    HE1  HIS  25           HE1      HIS  25   7.089  -2.377   5.209
  196    H    LYS  26           H        LYS  26  13.552  -0.980   4.763
  197    HA   LYS  26           HA       LYS  26  15.105   1.093   3.696
  198   1HB   LYS  26          1HB       LYS  26  16.802   0.283   5.208
  199   2HB   LYS  26          2HB       LYS  26  15.246  -0.100   5.946
  200   1HG   LYS  26          1HG       LYS  26  15.378  -2.392   5.224
  201   2HG   LYS  26          2HG       LYS  26  16.786  -2.052   4.219
  202   1HD   LYS  26          1HD       LYS  26  16.926  -1.438   7.148
  203   2HD   LYS  26          2HD       LYS  26  17.092  -3.113   6.622
  204   1HE   LYS  26          1HE       LYS  26  19.246  -2.702   6.064
  205   2HE   LYS  26          2HE       LYS  26  18.698  -1.487   4.892
  206   1HZ   LYS  26          1HZ       LYS  26  18.822   0.196   6.431
  207   2HZ   LYS  26          2HZ       LYS  26  20.140  -0.760   6.916
  208   3HZ   LYS  26          3HZ       LYS  26  18.670  -0.846   7.762
  209    H    ALA  27           H        ALA  27  14.889  -2.248   2.704
  210    HA   ALA  27           HA       ALA  27  17.311  -2.089   1.007
  211   1HB   ALA  27          1HB       ALA  27  15.294  -4.162   1.840
  212   2HB   ALA  27          2HB       ALA  27  17.047  -4.183   2.033
  213   3HB   ALA  27          3HB       ALA  27  16.331  -4.470   0.448
  214    H    VAL  28           H        VAL  28  14.081  -1.176   0.781
  215    HA   VAL  28           HA       VAL  28  13.633  -1.892  -2.029
  216    HB   VAL  28           HB       VAL  28  12.235  -0.237   0.074
  217   1HG1  VAL  28          1HG1      VAL  28  11.386  -0.687  -2.796
  218   2HG1  VAL  28          2HG1      VAL  28  11.813   0.860  -2.065
  219   3HG1  VAL  28          3HG1      VAL  28  10.365   0.007  -1.537
  220   1HG2  VAL  28          1HG2      VAL  28  11.686  -2.863  -1.319
  221   2HG2  VAL  28          2HG2      VAL  28  10.474  -2.030  -0.346
  222   3HG2  VAL  28          3HG2      VAL  28  11.969  -2.595   0.401
  223    H    LYS  29           H        LYS  29  12.924   0.139  -3.448
  224    HA   LYS  29           HA       LYS  29  15.276   1.932  -3.446
  225   1HB   LYS  29          1HB       LYS  29  13.439   0.797  -5.349
  226   2HB   LYS  29          2HB       LYS  29  13.476   2.554  -5.516
  227   1HG   LYS  29          1HG       LYS  29  15.303   2.077  -6.817
  228   2HG   LYS  29          2HG       LYS  29  16.105   2.119  -5.245
  229   1HD   LYS  29          1HD       LYS  29  14.887  -0.459  -6.175
  230   2HD   LYS  29          2HD       LYS  29  16.437   0.043  -6.853
  231   1HE   LYS  29          1HE       LYS  29  16.055   0.140  -3.869
  232   2HE   LYS  29          2HE       LYS  29  16.417  -1.410  -4.654
  233   1HZ   LYS  29          1HZ       LYS  29  17.960   1.112  -4.965
  234   2HZ   LYS  29          2HZ       LYS  29  18.273  -0.332  -5.803
  235   3HZ   LYS  29          3HZ       LYS  29  18.466  -0.266  -4.117
  236    H    CYS  30           H        CYS  30  14.998   3.540  -2.005
  237    HA   CYS  30           HA       CYS  30  12.701   4.751  -0.997
  238   1HB   CYS  30          1HB       CYS  30  15.448   5.784  -1.710
  239   2HB   CYS  30          2HB       CYS  30  14.255   6.850  -0.971
  240    H    GLY  31           H        GLY  31  14.043   4.996  -4.204
  241   1HA   GLY  31          1HA       GLY  31  12.380   7.320  -4.924
  242   2HA   GLY  31          2HA       GLY  31  13.493   6.473  -5.998
  243    H    ASP  32           H        ASP  32  12.067   3.901  -4.839
  244    HA   ASP  32           HA       ASP  32  10.168   3.697  -7.060
  245   1HB   ASP  32          1HB       ASP  32  11.744   2.004  -5.484
  246   2HB   ASP  32          2HB       ASP  32  10.094   1.600  -5.028
  247    H    CYS  33           H        CYS  33  10.080   4.215  -3.583
  248    HA   CYS  33           HA       CYS  33   7.106   4.096  -3.526
  249   1HB   CYS  33          1HB       CYS  33   9.386   4.221  -1.562
  250   2HB   CYS  33          2HB       CYS  33   7.785   4.730  -1.032
  251    H    HIS  34           H        HIS  34   9.730   6.359  -2.598
  252    HA   HIS  34           HA       HIS  34   7.873   8.665  -2.718
  253   1HB   HIS  34          1HB       HIS  34  10.791   8.246  -1.998
  254   2HB   HIS  34          2HB       HIS  34  10.033   9.834  -2.009
  255    HD1  HIS  34           HD1      HIS  34   7.638   9.828  -0.501
  256    HD2  HIS  34           HD2      HIS  34  10.598   7.061   0.473
  257    HE1  HIS  34           HE1      HIS  34   7.184   9.096   1.881
  258    H    HIS  35           H        HIS  35   8.520   7.156  -5.178
  259    HA   HIS  35           HA       HIS  35  10.413   7.897  -6.931
  260   1HB   HIS  35          1HB       HIS  35   8.572   8.026  -8.642
  261   2HB   HIS  35          2HB       HIS  35   8.439   6.652  -7.558
  262    HD1  HIS  35           HD1      HIS  35   7.038  10.067  -8.113
  263    HD2  HIS  35           HD2      HIS  35   6.131   6.634  -5.958
  264    HE1  HIS  35           HE1      HIS  35   4.726  10.431  -7.157
  265    HA   PRO  36           HA       PRO  36  10.748  12.222  -7.450
  266   1HB   PRO  36          1HB       PRO  36  11.010  12.472 -10.171
  267   2HB   PRO  36          2HB       PRO  36  12.300  11.849  -9.122
  268   1HG   PRO  36          1HG       PRO  36  10.339  10.349 -10.798
  269   2HG   PRO  36          2HG       PRO  36  12.073  10.063 -10.562
  270   1HD   PRO  36          1HD       PRO  36  10.191   8.609  -9.290
  271   2HD   PRO  36          2HD       PRO  36  11.759   8.992  -8.542
  272    H    VAL  37           H        VAL  37   9.034  13.593  -7.188
  273    HA   VAL  37           HA       VAL  37   6.629  13.234  -8.926
  274    HB   VAL  37           HB       VAL  37   7.202  14.142  -6.130
  275   1HG1  VAL  37          1HG1      VAL  37   5.999  16.068  -6.877
  276   2HG1  VAL  37          2HG1      VAL  37   4.808  15.045  -6.074
  277   3HG1  VAL  37          3HG1      VAL  37   4.888  15.089  -7.835
  278   1HG2  VAL  37          1HG2      VAL  37   4.743  12.710  -7.072
  279   2HG2  VAL  37          2HG2      VAL  37   5.638  12.520  -5.564
  280   3HG2  VAL  37          3HG2      VAL  37   6.277  11.841  -7.061
  281    H    ASN  38           H        ASN  38   9.250  14.789  -9.376
  282    HA   ASN  38           HA       ASN  38   8.208  16.959 -10.908
  283   1HB   ASN  38          1HB       ASN  38   7.724  17.581  -8.425
  284   2HB   ASN  38          2HB       ASN  38   9.443  17.865  -8.304
  285   1HD2  ASN  38          2HD2      ASN  38   7.130  19.850  -8.277
  286   2HD2  ASN  38          1HD2      ASN  38   7.522  20.970  -9.491
  287    H    GLY  39           H        GLY  39  10.870  17.372  -8.672
  288   1HA   GLY  39          1HA       GLY  39  12.812  16.703 -10.830
  289   2HA   GLY  39          2HA       GLY  39  13.002  18.166  -9.853
  290    H    LYS  40           H        LYS  40  11.596  15.957  -7.858
  291    HA   LYS  40           HA       LYS  40  13.998  14.418  -7.124
  292   1HB   LYS  40          1HB       LYS  40  13.970  15.570  -4.819
  293   2HB   LYS  40          2HB       LYS  40  14.628  16.507  -6.160
  294   1HG   LYS  40          1HG       LYS  40  12.716  17.856  -6.326
  295   2HG   LYS  40          2HG       LYS  40  11.702  16.687  -5.479
  296   1HD   LYS  40          1HD       LYS  40  13.915  17.510  -3.800
  297   2HD   LYS  40          2HD       LYS  40  13.005  18.915  -4.356
  298   1HE   LYS  40          1HE       LYS  40  10.962  18.091  -3.432
  299   2HE   LYS  40          2HE       LYS  40  11.644  16.470  -3.187
  300   1HZ   LYS  40          1HZ       LYS  40  11.884  17.452  -1.112
  301   2HZ   LYS  40          2HZ       LYS  40  12.274  18.976  -1.756
  302   3HZ   LYS  40          3HZ       LYS  40  13.405  17.709  -1.815
  303    H    GLU  41           H        GLU  41  13.376  12.598  -5.966
  304    HA   GLU  41           HA       GLU  41  10.678  11.778  -5.763
  305   1HB   GLU  41          1HB       GLU  41  13.301  11.023  -4.553
  306   2HB   GLU  41          2HB       GLU  41  11.843  10.286  -3.895
  307   1HG   GLU  41          1HG       GLU  41  11.450   9.063  -5.787
  308   2HG   GLU  41          2HG       GLU  41  12.040  10.337  -6.854
  309    H    ASP  42           H        ASP  42   9.121  12.797  -4.544
  310    HA   ASP  42           HA       ASP  42   9.656  14.516  -2.327
  311   1HB   ASP  42          1HB       ASP  42   7.257  12.999  -3.344
  312   2HB   ASP  42          2HB       ASP  42   7.157  14.006  -1.901
  313    H    TYR  43           H        TYR  43  10.786  13.665  -0.608
  314    HA   TYR  43           HA       TYR  43  10.279  10.926   0.343
  315   1HB   TYR  43          1HB       TYR  43  12.081  13.196   1.245
  316   2HB   TYR  43          2HB       TYR  43  12.110  11.575   1.941
  317    HD1  TYR  43           HD1      TYR  43  13.211  13.674  -0.783
  318    HD2  TYR  43           HD2      TYR  43  12.586   9.593   0.406
  319    HE1  TYR  43           HE1      TYR  43  14.693  12.912  -2.618
  320    HE2  TYR  43           HE2      TYR  43  14.068   8.832  -1.431
  321    HH   TYR  43           HH       TYR  43  15.430   9.452  -3.070
  322    H    GLN  44           H        GLN  44   7.889  11.876   0.743
  323    HA   GLN  44           HA       GLN  44   7.770  12.560   3.649
  324   1HB   GLN  44          1HB       GLN  44   6.001  14.247   3.049
  325   2HB   GLN  44          2HB       GLN  44   7.596  14.653   2.411
  326   1HG   GLN  44          1HG       GLN  44   6.763  13.272   0.315
  327   2HG   GLN  44          2HG       GLN  44   5.167  13.669   0.954
  328   1HE2  GLN  44          2HE2      GLN  44   8.267  15.517   0.691
  329   2HE2  GLN  44          1HE2      GLN  44   7.561  16.871  -0.047
  330    H    LYS  45           H        LYS  45   5.403  12.327   4.408
  331    HA   LYS  45           HA       LYS  45   4.443   9.763   4.217
  332   1HB   LYS  45          1HB       LYS  45   2.145  10.955   4.594
  333   2HB   LYS  45          2HB       LYS  45   3.425  11.172   5.786
  334   1HG   LYS  45          1HG       LYS  45   4.025  13.317   4.850
  335   2HG   LYS  45          2HG       LYS  45   2.945  13.075   3.477
  336   1HD   LYS  45          1HD       LYS  45   1.886  14.553   5.122
  337   2HD   LYS  45          2HD       LYS  45   1.011  13.024   5.038
  338   1HE   LYS  45          1HE       LYS  45   1.809  12.300   7.119
  339   2HE   LYS  45          2HE       LYS  45   3.227  13.366   7.053
  340   1HZ   LYS  45          1HZ       LYS  45   0.390  14.155   7.420
  341   2HZ   LYS  45          2HZ       LYS  45   1.619  15.265   7.041
  342   3HZ   LYS  45          3HZ       LYS  45   1.675  14.395   8.500
  343    H    CYS  46           H        CYS  46   3.360   8.544   2.732
  344    HA   CYS  46           HA       CYS  46   3.251   9.133  -0.008
  345   1HB   CYS  46          1HB       CYS  46   1.536   7.359   1.751
  346   2HB   CYS  46          2HB       CYS  46   1.590   7.241  -0.006
  347    H    ALA  47           H        ALA  47   0.774   9.642   2.480
  348    HA   ALA  47           HA       ALA  47  -0.995  10.955   0.464
  349   1HB   ALA  47          1HB       ALA  47  -1.734   9.066   1.978
  350   2HB   ALA  47          2HB       ALA  47  -2.727  10.520   2.074
  351   3HB   ALA  47          3HB       ALA  47  -1.539  10.177   3.330
  352    H    THR  48           H        THR  48   1.145  12.571   1.081
  353    HA   THR  48           HA       THR  48   1.081  14.230   3.318
  354    HB   THR  48           HB       THR  48   1.458  15.454   0.621
  355    HG1  THR  48           1HG      THR  48   2.810  13.204   1.637
  356   1HG2  THR  48          1HG2      THR  48   2.261  15.971   3.269
  357   2HG2  THR  48          2HG2      THR  48   2.789  16.817   1.815
  358   3HG2  THR  48          3HG2      THR  48   3.717  15.447   2.425
  359    H    ALA  49           H        ALA  49   0.466  16.804   2.681
  360    HA   ALA  49           HA       ALA  49  -2.427  16.875   2.913
  361   1HB   ALA  49          1HB       ALA  49  -0.357  19.049   2.449
  362   2HB   ALA  49          2HB       ALA  49  -0.870  18.442   4.024
  363   3HB   ALA  49          3HB       ALA  49  -2.010  19.316   3.002
  364    H    GLY  50           H        GLY  50  -0.381  16.632   0.232
  365   1HA   GLY  50          1HA       GLY  50  -2.620  17.333  -1.584
  366   2HA   GLY  50          2HA       GLY  50  -1.079  18.158  -1.847
  367    H    CYS  51           H        CYS  51  -0.892  15.031  -0.527
  368    HA   CYS  51           HA       CYS  51   0.210  13.964  -3.068
  369   1HB   CYS  51          1HB       CYS  51   0.719  13.957  -0.191
  370   2HB   CYS  51          2HB       CYS  51   0.852  12.369  -0.873
  371    H    HIS  52           H        HIS  52  -0.186  11.258  -1.444
  372    HA   HIS  52           HA       HIS  52  -2.682  10.521  -2.772
  373   1HB   HIS  52          1HB       HIS  52  -0.744   9.133  -0.909
  374   2HB   HIS  52          2HB       HIS  52  -2.126   8.324  -1.617
  375    HD1  HIS  52           HD1      HIS  52  -2.190   8.704  -4.365
  376    HD2  HIS  52           HD2      HIS  52   1.505   8.857  -2.478
  377    HE1  HIS  52           HE1      HIS  52  -0.454   8.276  -6.168
  378    H    ASP  53           H        ASP  53  -3.612  12.454  -1.233
  379    HA   ASP  53           HA       ASP  53  -4.445  11.286   1.386
  380   1HB   ASP  53          1HB       ASP  53  -3.317  13.432   1.469
  381   2HB   ASP  53          2HB       ASP  53  -4.409  14.094   0.254
  382    H    ASN  54           H        ASN  54  -5.714  10.772  -1.426
  383    HA   ASN  54           HA       ASN  54  -8.345  12.053  -1.202
  384   1HB   ASN  54          1HB       ASN  54  -6.857  10.995  -3.219
  385   2HB   ASN  54          2HB       ASN  54  -7.935   9.641  -2.886
  386   1HD2  ASN  54          2HD2      ASN  54  -9.663   9.748  -4.330
  387   2HD2  ASN  54          1HD2      ASN  54 -10.492  11.168  -4.751
  388    H    MET  55           H        MET  55  -9.481  11.391   0.616
  389    HA   MET  55           HA       MET  55  -9.354   8.653   1.628
  390   1HB   MET  55          1HB       MET  55 -10.757  11.227   2.273
  391   2HB   MET  55          2HB       MET  55 -11.317   9.736   3.031
  392   1HG   MET  55          1HG       MET  55  -9.712  10.312   4.575
  393   2HG   MET  55          2HG       MET  55  -8.680   9.437   3.443
  394   1HE   MET  55          1HE       MET  55  -6.531  11.959   4.818
  395   2HE   MET  55          2HE       MET  55  -6.045  11.191   3.309
  396   3HE   MET  55          3HE       MET  55  -6.974  10.278   4.495
  397    H    ASP  56           H        ASP  56 -10.729   9.668  -1.114
  398    HA   ASP  56           HA       ASP  56 -13.453   8.638  -0.809
  399   1HB   ASP  56          1HB       ASP  56 -12.254  10.398  -2.458
  400   2HB   ASP  56          2HB       ASP  56 -12.125   8.953  -3.463
  401    H    LYS  57           H        LYS  57 -10.371   7.233  -1.244
  402    HA   LYS  57           HA       LYS  57  -9.682   5.081  -1.974
  403   1HB   LYS  57          1HB       LYS  57 -10.811   4.571   0.099
  404   2HB   LYS  57          2HB       LYS  57 -12.391   4.671  -0.677
  405   1HG   LYS  57          1HG       LYS  57 -10.594   2.776  -2.004
  406   2HG   LYS  57          2HG       LYS  57 -10.922   2.349  -0.325
  407   1HD   LYS  57          1HD       LYS  57 -13.373   3.216  -1.520
  408   2HD   LYS  57          2HD       LYS  57 -12.634   2.017  -2.581
  409   1HE   LYS  57          1HE       LYS  57 -12.470   0.415  -0.753
  410   2HE   LYS  57          2HE       LYS  57 -13.049   1.629   0.406
  411   1HZ   LYS  57          1HZ       LYS  57 -15.144   1.632  -0.491
  412   2HZ   LYS  57          2HZ       LYS  57 -14.728   0.001  -0.725
  413   3HZ   LYS  57          3HZ       LYS  57 -14.624   1.101  -2.016
  414    H    LYS  58           H        LYS  58 -11.404   6.760  -3.872
  415    HA   LYS  58           HA       LYS  58 -12.249   4.493  -5.642
  416   1HB   LYS  58          1HB       LYS  58 -13.631   7.154  -5.156
  417   2HB   LYS  58          2HB       LYS  58 -14.172   5.919  -6.293
  418   1HG   LYS  58          1HG       LYS  58 -13.694   4.855  -3.607
  419   2HG   LYS  58          2HG       LYS  58 -14.943   6.099  -3.639
  420   1HD   LYS  58          1HD       LYS  58 -16.198   4.201  -4.129
  421   2HD   LYS  58          2HD       LYS  58 -15.794   4.768  -5.750
  422   1HE   LYS  58          1HE       LYS  58 -14.424   2.982  -6.166
  423   2HE   LYS  58          2HE       LYS  58 -13.782   2.972  -4.511
  424   1HZ   LYS  58          1HZ       LYS  58 -16.614   2.363  -4.823
  425   2HZ   LYS  58          2HZ       LYS  58 -15.475   1.702  -3.751
  426   3HZ   LYS  58          3HZ       LYS  58 -15.533   1.175  -5.365
  427    H    ASP  59           H        ASP  59 -10.290   7.201  -5.234
  428    HA   ASP  59           HA       ASP  59 -10.350   8.251  -7.954
  429   1HB   ASP  59          1HB       ASP  59  -9.673   9.738  -6.245
  430   2HB   ASP  59          2HB       ASP  59  -8.617   8.538  -5.501
  431    H    LYS  60           H        LYS  60  -9.689   6.862  -9.579
  432    HA   LYS  60           HA       LYS  60  -7.533   4.903  -9.103
  433   1HB   LYS  60          1HB       LYS  60  -9.795   5.260 -10.821
  434   2HB   LYS  60          2HB       LYS  60  -8.361   5.096 -11.836
  435   1HG   LYS  60          1HG       LYS  60  -8.905   3.213  -9.538
  436   2HG   LYS  60          2HG       LYS  60  -9.545   2.917 -11.155
  437   1HD   LYS  60          1HD       LYS  60  -6.610   3.444 -10.648
  438   2HD   LYS  60          2HD       LYS  60  -7.297   1.819 -10.627
  439   1HE   LYS  60          1HE       LYS  60  -8.326   2.631 -12.967
  440   2HE   LYS  60          2HE       LYS  60  -6.882   3.662 -12.940
  441   1HZ   LYS  60          1HZ       LYS  60  -5.904   1.784 -13.700
  442   2HZ   LYS  60          2HZ       LYS  60  -7.083   0.756 -13.035
  443   3HZ   LYS  60          3HZ       LYS  60  -5.853   1.393 -12.050
  444    H    SER  61           H        SER  61  -7.020   7.903  -9.131
  445    HA   SER  61           HA       SER  61  -5.268   8.144 -11.534
  446   1HB   SER  61          1HB       SER  61  -7.038   9.842 -10.223
  447   2HB   SER  61          2HB       SER  61  -5.460  10.408  -9.683
  448    HG   SER  61           HG       SER  61  -6.041  11.406 -11.631
  449    H    ALA  62           H        ALA  62  -3.479  10.042 -10.347
  450    HA   ALA  62           HA       ALA  62  -1.795   8.187  -8.731
  451   1HB   ALA  62          1HB       ALA  62  -0.062   9.174  -9.843
  452   2HB   ALA  62          2HB       ALA  62  -0.747  10.790  -9.665
  453   3HB   ALA  62          3HB       ALA  62  -1.322   9.724 -10.947
  454    H    LYS  63           H        LYS  63  -4.119   9.990  -7.737
  455    HA   LYS  63           HA       LYS  63  -2.530  11.442  -5.638
  456   1HB   LYS  63          1HB       LYS  63  -4.122  12.525  -7.594
  457   2HB   LYS  63          2HB       LYS  63  -5.273  12.349  -6.266
  458   1HG   LYS  63          1HG       LYS  63  -4.422  14.349  -5.580
  459   2HG   LYS  63          2HG       LYS  63  -3.108  13.360  -4.943
  460   1HD   LYS  63          1HD       LYS  63  -1.702  13.825  -6.771
  461   2HD   LYS  63          2HD       LYS  63  -3.048  14.337  -7.791
  462   1HE   LYS  63          1HE       LYS  63  -3.339  16.373  -6.500
  463   2HE   LYS  63          2HE       LYS  63  -2.139  15.836  -5.309
  464   1HZ   LYS  63          1HZ       LYS  63  -1.548  16.093  -8.204
  465   2HZ   LYS  63          2HZ       LYS  63  -0.441  15.854  -6.938
  466   3HZ   LYS  63          3HZ       LYS  63  -1.252  17.339  -7.092
  467    H    GLY  64           H        GLY  64  -4.917   9.074  -6.317
  468   1HA   GLY  64          1HA       GLY  64  -6.487   9.317  -3.933
  469   2HA   GLY  64          2HA       GLY  64  -6.383   7.879  -4.939
  470    H    TYR  65           H        TYR  65  -6.400   7.902  -2.090
  471    HA   TYR  65           HA       TYR  65  -3.615   7.303  -1.270
  472   1HB   TYR  65          1HB       TYR  65  -5.209   8.663   0.104
  473   2HB   TYR  65          2HB       TYR  65  -6.234   7.233   0.254
  474    HD1  TYR  65           HD1      TYR  65  -6.041   6.287   2.368
  475    HD2  TYR  65           HD2      TYR  65  -2.524   7.789   0.420
  476    HE1  TYR  65           HE1      TYR  65  -4.651   5.465   4.248
  477    HE2  TYR  65           HE2      TYR  65  -1.131   6.970   2.301
  478    HH   TYR  65           HH       TYR  65  -1.500   6.444   4.767
  479    H    TYR  66           H        TYR  66  -6.517   5.676  -2.257
  480    HA   TYR  66           HA       TYR  66  -5.618   3.090  -1.102
  481   1HB   TYR  66          1HB       TYR  66  -7.894   3.399  -0.746
  482   2HB   TYR  66          2HB       TYR  66  -8.107   4.297  -2.247
  483    HD1  TYR  66           HD1      TYR  66  -8.483   1.133  -0.645
  484    HD2  TYR  66           HD2      TYR  66  -7.786   2.981  -4.455
  485    HE1  TYR  66           HE1      TYR  66  -9.239  -0.937  -1.783
  486    HE2  TYR  66           HE2      TYR  66  -8.544   0.912  -5.600
  487    HH   TYR  66           HH       TYR  66 -10.286  -1.186  -4.635
  488    H    HIS  67           H        HIS  67  -6.189   4.681  -4.230
  489    HA   HIS  67           HA       HIS  67  -5.838   2.459  -5.964
  490   1HB   HIS  67          1HB       HIS  67  -6.623   4.490  -6.873
  491   2HB   HIS  67          2HB       HIS  67  -5.332   5.426  -6.117
  492    HD1  HIS  67           HD1      HIS  67  -5.889   2.910  -8.892
  493    HD2  HIS  67           HD2      HIS  67  -3.000   5.647  -7.654
  494    HE1  HIS  67           HE1      HIS  67  -4.107   2.931 -10.688
  495    H    ALA  68           H        ALA  68  -3.338   4.957  -5.483
  496    HA   ALA  68           HA       ALA  68  -1.140   3.626  -6.500
  497   1HB   ALA  68          1HB       ALA  68  -0.264   4.966  -4.166
  498   2HB   ALA  68          2HB       ALA  68  -1.721   5.808  -4.695
  499   3HB   ALA  68          3HB       ALA  68  -0.360   5.626  -5.800
  500    H    MET  69           H        MET  69  -2.827   2.820  -3.542
  501    HA   MET  69           HA       MET  69  -0.554   1.220  -2.529
  502   1HB   MET  69          1HB       MET  69  -3.344   1.808  -1.523
  503   2HB   MET  69          2HB       MET  69  -2.128   0.906  -0.620
  504   1HG   MET  69          1HG       MET  69  -1.008   3.371  -1.635
  505   2HG   MET  69          2HG       MET  69  -2.448   3.698  -0.677
  506   1HE   MET  69          1HE       MET  69   0.500   4.256  -0.700
  507   2HE   MET  69          2HE       MET  69   1.551   3.426   0.446
  508   3HE   MET  69          3HE       MET  69   0.497   4.721   1.007
  509    H    HIS  70           H        HIS  70  -3.917   0.624  -3.635
  510    HA   HIS  70           HA       HIS  70  -3.400  -2.284  -3.483
  511   1HB   HIS  70          1HB       HIS  70  -5.857  -0.723  -4.326
  512   2HB   HIS  70          2HB       HIS  70  -5.804  -2.424  -3.860
  513    HD1  HIS  70           HD1      HIS  70  -6.037   0.986  -2.482
  514    HD2  HIS  70           HD2      HIS  70  -5.190  -2.824  -1.024
  515    HE1  HIS  70           HE1      HIS  70  -6.225   1.129   0.037
  516    H    ASP  71           H        ASP  71  -3.449   0.259  -5.853
  517    HA   ASP  71           HA       ASP  71  -4.011  -1.461  -8.144
  518   1HB   ASP  71          1HB       ASP  71  -3.062   1.365  -7.675
  519   2HB   ASP  71          2HB       ASP  71  -3.211   0.702  -9.296
  520    H    LYS  72           H        LYS  72  -2.525  -2.605  -9.326
  521    HA   LYS  72           HA       LYS  72   0.299  -2.594  -8.463
  522   1HB   LYS  72          1HB       LYS  72  -1.299  -4.230 -10.456
  523   2HB   LYS  72          2HB       LYS  72   0.372  -4.565 -10.001
  524   1HG   LYS  72          1HG       LYS  72  -0.818  -4.363  -7.544
  525   2HG   LYS  72          2HG       LYS  72  -2.120  -5.068  -8.504
  526   1HD   LYS  72          1HD       LYS  72   0.706  -6.152  -8.515
  527   2HD   LYS  72          2HD       LYS  72  -0.550  -6.750  -7.431
  528   1HE   LYS  72          1HE       LYS  72  -1.586  -7.911  -9.100
  529   2HE   LYS  72          2HE       LYS  72  -1.388  -6.582 -10.260
  530   1HZ   LYS  72          1HZ       LYS  72   0.051  -8.812 -10.375
  531   2HZ   LYS  72          2HZ       LYS  72   1.050  -7.889  -9.358
  532   3HZ   LYS  72          3HZ       LYS  72   0.637  -7.310 -10.900
  533    H    GLY  73           H        GLY  73  -1.446  -2.293 -11.570
  534   1HA   GLY  73          1HA       GLY  73   0.873  -1.449 -13.049
  535   2HA   GLY  73          2HA       GLY  73  -0.799  -1.259 -13.582
  536    H    THR  74           H        THR  74   1.223   0.096 -10.956
  537    HA   THR  74           HA       THR  74  -0.007   2.764 -11.490
  538    HB   THR  74           HB       THR  74   1.185   3.125  -9.186
  539    HG1  THR  74           1HG      THR  74   2.432   1.272  -9.230
  540   1HG2  THR  74          1HG2      THR  74  -1.187   1.310  -9.654
  541   2HG2  THR  74          2HG2      THR  74  -1.201   3.032  -9.273
  542   3HG2  THR  74          3HG2      THR  74  -0.719   1.861  -8.045
  543    H    LYS  75           H        LYS  75   1.415   4.637 -11.566
  544    HA   LYS  75           HA       LYS  75   3.582   4.686 -13.241
  545   1HB   LYS  75          1HB       LYS  75   2.312   6.486 -11.714
  546   2HB   LYS  75          2HB       LYS  75   3.753   6.296 -10.718
  547   1HG   LYS  75          1HG       LYS  75   3.982   8.133 -12.387
  548   2HG   LYS  75          2HG       LYS  75   5.185   6.864 -12.611
  549   1HD   LYS  75          1HD       LYS  75   2.847   6.154 -14.103
  550   2HD   LYS  75          2HD       LYS  75   3.274   7.817 -14.500
  551   1HE   LYS  75          1HE       LYS  75   5.298   7.217 -15.445
  552   2HE   LYS  75          2HE       LYS  75   5.496   5.814 -14.376
  553   1HZ   LYS  75          1HZ       LYS  75   3.427   4.925 -15.538
  554   2HZ   LYS  75          2HZ       LYS  75   4.881   4.890 -16.417
  555   3HZ   LYS  75          3HZ       LYS  75   3.725   6.095 -16.729
  556    H    PHE  76           H        PHE  76   3.652   3.839  -9.789
  557    HA   PHE  76           HA       PHE  76   6.440   2.789 -10.170
  558   1HB   PHE  76          1HB       PHE  76   5.278   4.183  -7.741
  559   2HB   PHE  76          2HB       PHE  76   6.933   3.622  -7.927
  560    HD1  PHE  76           HD1      PHE  76   8.321   4.617  -9.864
  561    HD2  PHE  76           HD2      PHE  76   4.609   6.289  -8.497
  562    HE1  PHE  76           HE1      PHE  76   8.879   6.766 -10.969
  563    HE2  PHE  76           HE2      PHE  76   5.167   8.436  -9.600
  564    HZ   PHE  76           HZ       PHE  76   7.297   8.669 -10.832
  565    H    LYS  77           H        LYS  77   6.943   1.230  -8.197
  566    HA   LYS  77           HA       LYS  77   4.860  -0.789  -8.168
  567   1HB   LYS  77          1HB       LYS  77   6.432  -1.936  -6.658
  568   2HB   LYS  77          2HB       LYS  77   7.251  -1.330  -8.094
  569   1HG   LYS  77          1HG       LYS  77   7.848   0.734  -6.729
  570   2HG   LYS  77          2HG       LYS  77   7.271  -0.144  -5.313
  571   1HD   LYS  77          1HD       LYS  77   9.752  -0.360  -5.686
  572   2HD   LYS  77          2HD       LYS  77   8.900  -1.904  -5.664
  573   1HE   LYS  77          1HE       LYS  77   9.185  -0.556  -8.317
  574   2HE   LYS  77          2HE       LYS  77  10.628  -1.322  -7.622
  575   1HZ   LYS  77          1HZ       LYS  77   8.215  -2.858  -7.291
  576   2HZ   LYS  77          2HZ       LYS  77   9.750  -3.352  -7.827
  577   3HZ   LYS  77          3HZ       LYS  77   8.652  -2.646  -8.915
  578    H    SER  78           H        SER  78   3.103  -0.495  -7.024
  579    HA   SER  78           HA       SER  78   2.869   1.329  -4.771
  580   1HB   SER  78          1HB       SER  78   0.519   0.154  -4.840
  581   2HB   SER  78          2HB       SER  78   1.007   1.191  -6.178
  582    HG   SER  78           HG       SER  78   0.179  -0.962  -6.732
  583    H    CYS  79           H        CYS  79   1.595   0.434  -2.780
  584    HA   CYS  79           HA       CYS  79   3.223  -1.353  -1.291
  585   1HB   CYS  79          1HB       CYS  79   0.277  -0.712  -0.962
  586   2HB   CYS  79          2HB       CYS  79   1.386  -1.212   0.313
  587    H    VAL  80           H        VAL  80  -0.129  -2.002  -2.358
  588    HA   VAL  80           HA       VAL  80   0.108  -4.868  -2.089
  589    HB   VAL  80           HB       VAL  80  -1.780  -2.958  -3.469
  590   1HG1  VAL  80          1HG1      VAL  80  -2.542  -4.659  -4.728
  591   2HG1  VAL  80          2HG1      VAL  80  -3.064  -5.437  -3.232
  592   3HG1  VAL  80          3HG1      VAL  80  -1.481  -5.809  -3.914
  593   1HG2  VAL  80          1HG2      VAL  80  -2.430  -4.854  -1.221
  594   2HG2  VAL  80          2HG2      VAL  80  -3.175  -3.305  -1.611
  595   3HG2  VAL  80          3HG2      VAL  80  -1.573  -3.352  -0.875
  596    H    GLY  81           H        GLY  81   0.767  -2.576  -4.670
  597   1HA   GLY  81          1HA       GLY  81   0.892  -4.509  -6.819
  598   2HA   GLY  81          2HA       GLY  81   1.577  -2.883  -6.859
  599    H    CYS  82           H        CYS  82   3.285  -3.076  -4.615
  600    HA   CYS  82           HA       CYS  82   5.524  -4.576  -5.780
  601   1HB   CYS  82          1HB       CYS  82   5.410  -2.287  -4.465
  602   2HB   CYS  82          2HB       CYS  82   5.467  -3.321  -3.042
  603    H    HIS  83           H        HIS  83   3.086  -4.994  -3.375
  604    HA   HIS  83           HA       HIS  83   4.383  -7.073  -1.825
  605   1HB   HIS  83          1HB       HIS  83   1.701  -5.782  -2.124
  606   2HB   HIS  83          2HB       HIS  83   1.779  -7.305  -1.257
  607    HD1  HIS  83           HD1      HIS  83   1.244  -5.934   0.972
  608    HD2  HIS  83           HD2      HIS  83   4.871  -4.996  -0.857
  609    HE1  HIS  83           HE1      HIS  83   2.605  -4.673   2.691
  610    H    LEU  84           H        LEU  84   1.658  -7.176  -4.191
  611    HA   LEU  84           HA       LEU  84   1.438  -9.970  -4.430
  612   1HB   LEU  84          1HB       LEU  84   0.486  -7.598  -5.617
  613   2HB   LEU  84          2HB       LEU  84   1.143  -8.552  -6.941
  614    HG   LEU  84           HG       LEU  84  -0.594  -9.871  -4.886
  615   1HD1  LEU  84          1HD1      LEU  84  -1.738  -8.606  -7.373
  616   2HD1  LEU  84          2HD1      LEU  84  -1.662  -7.715  -5.853
  617   3HD1  LEU  84          3HD1      LEU  84  -2.594  -9.210  -5.955
  618   1HD2  LEU  84          1HD2      LEU  84   0.555 -10.464  -7.513
  619   2HD2  LEU  84          2HD2      LEU  84  -1.173 -10.805  -7.442
  620   3HD2  LEU  84          3HD2      LEU  84  -0.076 -11.570  -6.294
  621    H    GLU  85           H        GLU  85   3.812  -7.736  -5.757
  622    HA   GLU  85           HA       GLU  85   4.968  -9.671  -7.632
  623   1HB   GLU  85          1HB       GLU  85   5.422  -6.872  -6.691
  624   2HB   GLU  85          2HB       GLU  85   6.795  -7.705  -7.420
  625   1HG   GLU  85          1HG       GLU  85   5.311  -8.284  -9.373
  626   2HG   GLU  85          2HG       GLU  85   4.073  -7.243  -8.668
  627    H    THR  86           H        THR  86   5.939  -8.222  -4.502
  628    HA   THR  86           HA       THR  86   8.361  -9.758  -4.223
  629    HB   THR  86           HB       THR  86   6.552  -8.095  -2.494
  630    HG1  THR  86           1HG      THR  86   8.834  -7.228  -2.181
  631   1HG2  THR  86          1HG2      THR  86   7.279 -10.098  -1.133
  632   2HG2  THR  86          2HG2      THR  86   7.843  -8.548  -0.511
  633   3HG2  THR  86          3HG2      THR  86   8.947  -9.594  -1.405
  634    H    ALA  87           H        ALA  87   5.126 -10.701  -4.150
  635    HA   ALA  87           HA       ALA  87   5.826 -13.197  -2.644
  636   1HB   ALA  87          1HB       ALA  87   3.641 -13.067  -1.573
  637   2HB   ALA  87          2HB       ALA  87   3.211 -11.656  -2.539
  638   3HB   ALA  87          3HB       ALA  87   4.478 -11.537  -1.318
  639    H    GLY  88           H        GLY  88   5.557 -12.405  -5.597
  640   1HA   GLY  88          1HA       GLY  88   3.144 -13.647  -6.586
  641   2HA   GLY  88          2HA       GLY  88   4.569 -13.261  -7.551
  642    H    ALA  89           H        ALA  89   5.779 -14.994  -5.058
  643    HA   ALA  89           HA       ALA  89   5.262 -17.636  -6.377
  644   1HB   ALA  89          1HB       ALA  89   7.591 -18.032  -6.500
  645   2HB   ALA  89          2HB       ALA  89   7.954 -16.760  -5.333
  646   3HB   ALA  89          3HB       ALA  89   7.436 -16.337  -6.965
  647    H    ASP  90           H        ASP  90   4.926 -15.936  -3.585
  648    HA   ASP  90           HA       ASP  90   5.357 -18.365  -1.899
  649   1HB   ASP  90          1HB       ASP  90   7.090 -16.683  -1.556
  650   2HB   ASP  90          2HB       ASP  90   5.874 -15.440  -1.303
  651    H    ALA  91           H        ALA  91   3.063 -18.744  -2.331
  652    HA   ALA  91           HA       ALA  91   0.834 -17.187  -2.038
  653   1HB   ALA  91          1HB       ALA  91   1.539 -19.954  -1.099
  654   2HB   ALA  91          2HB       ALA  91   0.494 -19.470  -2.433
  655   3HB   ALA  91          3HB       ALA  91  -0.069 -19.311  -0.769
  656    H    ALA  92           H        ALA  92   3.079 -18.008   0.529
  657    HA   ALA  92           HA       ALA  92   1.337 -17.142   2.711
  658   1HB   ALA  92          1HB       ALA  92   4.107 -17.078   3.396
  659   2HB   ALA  92          2HB       ALA  92   3.870 -18.438   2.299
  660   3HB   ALA  92          3HB       ALA  92   2.933 -18.334   3.789
  661    H    LYS  93           H        LYS  93   4.045 -15.795   0.865
  662    HA   LYS  93           HA       LYS  93   4.141 -13.274   2.272
  663   1HB   LYS  93          1HB       LYS  93   5.253 -14.605  -0.119
  664   2HB   LYS  93          2HB       LYS  93   5.200 -12.851  -0.220
  665   1HG   LYS  93          1HG       LYS  93   6.364 -12.723   1.979
  666   2HG   LYS  93          2HG       LYS  93   6.470 -14.485   1.992
  667   1HD   LYS  93          1HD       LYS  93   7.565 -14.119  -0.389
  668   2HD   LYS  93          2HD       LYS  93   7.912 -12.515   0.255
  669   1HE   LYS  93          1HE       LYS  93   9.016 -13.558   2.228
  670   2HE   LYS  93          2HE       LYS  93   8.723 -15.158   1.517
  671   1HZ   LYS  93          1HZ       LYS  93  10.102 -12.963   0.075
  672   2HZ   LYS  93          2HZ       LYS  93   9.984 -14.592  -0.390
  673   3HZ   LYS  93          3HZ       LYS  93  10.932 -14.155   0.951
  674    H    LYS  94           H        LYS  94   2.144 -14.627  -0.232
  675    HA   LYS  94           HA       LYS  94   1.214 -12.094  -1.346
  676   1HB   LYS  94          1HB       LYS  94   0.949 -14.928  -1.772
  677   2HB   LYS  94          2HB       LYS  94  -0.658 -14.203  -1.736
  678   1HG   LYS  94          1HG       LYS  94   0.102 -12.498  -3.383
  679   2HG   LYS  94          2HG       LYS  94   1.667 -13.306  -3.463
  680   1HD   LYS  94          1HD       LYS  94   0.078 -15.430  -3.921
  681   2HD   LYS  94          2HD       LYS  94  -0.962 -14.158  -4.568
  682   1HE   LYS  94          1HE       LYS  94   1.434 -13.426  -5.650
  683   2HE   LYS  94          2HE       LYS  94   1.609 -15.192  -5.615
  684   1HZ   LYS  94          1HZ       LYS  94  -0.463 -15.456  -6.720
  685   2HZ   LYS  94          2HZ       LYS  94   0.430 -14.324  -7.619
  686   3HZ   LYS  94          3HZ       LYS  94  -0.823 -13.803  -6.596
  687    H    LYS  95           H        LYS  95   0.217 -14.242   1.272
  688    HA   LYS  95           HA       LYS  95  -2.345 -12.885   1.718
  689   1HB   LYS  95          1HB       LYS  95  -2.488 -14.461   3.569
  690   2HB   LYS  95          2HB       LYS  95  -1.824 -15.309   2.174
  691   1HG   LYS  95          1HG       LYS  95   0.145 -15.691   3.214
  692   2HG   LYS  95          2HG       LYS  95   0.245 -14.031   3.801
  693   1HD   LYS  95          1HD       LYS  95  -1.644 -14.774   5.453
  694   2HD   LYS  95          2HD       LYS  95  -1.089 -16.405   5.074
  695   1HE   LYS  95          1HE       LYS  95   1.101 -14.514   5.659
  696   2HE   LYS  95          2HE       LYS  95   0.021 -14.828   7.032
  697   1HZ   LYS  95          1HZ       LYS  95   0.369 -17.105   6.895
  698   2HZ   LYS  95          2HZ       LYS  95   1.919 -16.482   6.589
  699   3HZ   LYS  95          3HZ       LYS  95   0.953 -17.033   5.305
  700    H    GLU  96           H        GLU  96   0.952 -12.506   2.701
  701    HA   GLU  96           HA       GLU  96   0.276 -10.778   5.020
  702   1HB   GLU  96          1HB       GLU  96   2.673 -10.934   5.405
  703   2HB   GLU  96          2HB       GLU  96   2.081 -12.535   4.999
  704   1HG   GLU  96          1HG       GLU  96   2.862 -12.307   2.739
  705   2HG   GLU  96          2HG       GLU  96   3.308 -10.624   3.017
  706    H    LEU  97           H        LEU  97   1.867 -10.657   1.879
  707    HA   LEU  97           HA       LEU  97   2.401  -7.789   1.957
  708   1HB   LEU  97          1HB       LEU  97   2.433  -9.886  -0.219
  709   2HB   LEU  97          2HB       LEU  97   3.094  -8.259  -0.385
  710    HG   LEU  97           HG       LEU  97   4.016 -10.442   1.488
  711   1HD1  LEU  97          1HD1      LEU  97   5.718 -10.664   0.042
  712   2HD1  LEU  97          2HD1      LEU  97   5.974  -8.920  -0.028
  713   3HD1  LEU  97          3HD1      LEU  97   4.772  -9.679  -1.072
  714   1HD2  LEU  97          1HD2      LEU  97   5.664  -8.660   2.269
  715   2HD2  LEU  97          2HD2      LEU  97   4.005  -8.449   2.829
  716   3HD2  LEU  97          3HD2      LEU  97   4.615  -7.474   1.492
  717    H    THR  98           H        THR  98   0.384  -9.685  -0.312
  718    HA   THR  98           HA       THR  98  -1.211  -7.262  -0.866
  719    HB   THR  98           HB       THR  98  -2.238  -8.840  -2.558
  720    HG1  THR  98           1HG      THR  98  -1.929 -10.840  -1.958
  721   1HG2  THR  98          1HG2      THR  98   0.174  -7.504  -2.563
  722   2HG2  THR  98          2HG2      THR  98  -0.568  -8.255  -3.975
  723   3HG2  THR  98          3HG2      THR  98   0.642  -9.135  -3.042
  724    H    GLY  99           H        GLY  99  -1.471 -10.151   1.037
  725   1HA   GLY  99          1HA       GLY  99  -4.224 -10.600   1.128
  726   2HA   GLY  99          2HA       GLY  99  -3.174 -10.768   2.539
  727    H    CYS 100           H        CYS 100  -5.905  -9.295   1.656
  728    HA   CYS 100           HA       CYS 100  -5.401  -6.599   2.664
  729   1HB   CYS 100          1HB       CYS 100  -8.154  -7.618   2.669
  730   2HB   CYS 100          2HB       CYS 100  -7.508  -6.193   1.899
  731    H    LYS 101           H        LYS 101  -7.582  -9.161   3.823
  732    HA   LYS 101           HA       LYS 101  -7.262  -8.069   6.568
  733   1HB   LYS 101          1HB       LYS 101  -9.142 -10.193   5.489
  734   2HB   LYS 101          2HB       LYS 101  -9.303  -9.315   7.011
  735   1HG   LYS 101          1HG       LYS 101  -9.284  -7.184   5.503
  736   2HG   LYS 101          2HG       LYS 101  -9.688  -8.305   4.202
  737   1HD   LYS 101          1HD       LYS 101 -11.415  -9.096   6.194
  738   2HD   LYS 101          2HD       LYS 101 -11.350  -7.350   6.434
  739   1HE   LYS 101          1HE       LYS 101 -11.675  -7.226   3.836
  740   2HE   LYS 101          2HE       LYS 101 -12.283  -8.884   4.016
  741   1HZ   LYS 101          1HZ       LYS 101 -13.205  -6.513   5.558
  742   2HZ   LYS 101          2HZ       LYS 101 -13.757  -8.106   5.778
  743   3HZ   LYS 101          3HZ       LYS 101 -14.073  -7.287   4.323
  744    H    GLY 102           H        GLY 102  -5.605  -9.016   7.710
  745   1HA   GLY 102          1HA       GLY 102  -4.930 -11.028   8.971
  746   2HA   GLY 102          2HA       GLY 102  -5.350 -11.989   7.551
  747    H    SER 103           H        SER 103  -3.939  -9.346   6.266
  748    HA   SER 103           HA       SER 103  -1.410 -10.750   5.782
  749   1HB   SER 103          1HB       SER 103  -1.066  -8.824   4.267
  750   2HB   SER 103          2HB       SER 103  -2.654  -9.536   4.035
  751    HG   SER 103           HG       SER 103  -2.161  -7.057   4.531
  752    H    LYS 104           H        LYS 104   0.167  -8.326   5.538
  753    HA   LYS 104           HA       LYS 104   0.864  -7.899   8.409
  754   1HB   LYS 104          1HB       LYS 104   2.258  -7.472   5.749
  755   2HB   LYS 104          2HB       LYS 104   2.982  -7.081   7.307
  756   1HG   LYS 104          1HG       LYS 104   1.866  -9.832   6.890
  757   2HG   LYS 104          2HG       LYS 104   3.436  -9.436   6.190
  758   1HD   LYS 104          1HD       LYS 104   3.203  -8.494   8.941
  759   2HD   LYS 104          2HD       LYS 104   2.974 -10.239   8.819
  760   1HE   LYS 104          1HE       LYS 104   5.350  -8.639   7.809
  761   2HE   LYS 104          2HE       LYS 104   5.349  -9.877   9.079
  762   1HZ   LYS 104          1HZ       LYS 104   4.153 -11.180   7.081
  763   2HZ   LYS 104          2HZ       LYS 104   5.825 -11.250   7.375
  764   3HZ   LYS 104          3HZ       LYS 104   5.211 -10.193   6.196
  765    H    CYS 105           H        CYS 105  -0.196  -6.402   5.482
  766    HA   CYS 105           HA       CYS 105   0.291  -3.648   6.272
  767   1HB   CYS 105          1HB       CYS 105  -0.169  -5.136   3.981
  768   2HB   CYS 105          2HB       CYS 105  -1.665  -4.256   4.183
  769    H    HIS 106           H        HIS 106  -2.365  -5.938   6.591
  770    HA   HIS 106           HA       HIS 106  -4.054  -3.745   7.758
  771   1HB   HIS 106          1HB       HIS 106  -4.571  -6.062   5.950
  772   2HB   HIS 106          2HB       HIS 106  -5.853  -5.615   7.077
  773    HD1  HIS 106           HD1      HIS 106  -5.237  -2.519   7.034
  774    HD2  HIS 106           HD2      HIS 106  -5.783  -4.908   3.642
  775    HE1  HIS 106           HE1      HIS 106  -5.818  -0.945   5.145
  776    H    SER 107           H        SER 107  -3.028  -4.230   9.871
  777    HA   SER 107           HA       SER 107  -3.387  -6.914  11.022
  778   1HB   SER 107          1HB       SER 107  -1.540  -5.027  11.349
  779   2HB   SER 107          2HB       SER 107  -2.660  -4.460  12.584
  780    HG   SER 107           HG       SER 107  -1.502  -5.913  13.667
  781    HHA  HEC 201           HHA      HEC 201   6.069   8.810   5.616
  782    HHB  HEC 201           HHB      HEC 201  12.166   9.745   4.868
  783    HHC  HEC 201           HHC      HEC 201  12.565   4.665   1.116
  784    HHD  HEC 201           HHD      HEC 201   6.435   3.668   1.800
  785   1HMA  HEC 201          1HMA      HEC 201   9.839  10.737   7.965
  786   2HMA  HEC 201          2HMA      HEC 201  10.278  11.878   6.692
  787   3HMA  HEC 201          3HMA      HEC 201  11.362  10.546   7.093
  788   1HAA  HEC 201          1HAA      HEC 201   6.721   9.711   7.477
  789   2HAA  HEC 201          2HAA      HEC 201   7.923  10.957   7.796
  790   1HBA  HEC 201          1HBA      HEC 201   6.708  11.413   5.222
  791   2HBA  HEC 201          2HBA      HEC 201   5.456  11.262   6.456
  792   1HMB  HEC 201          1HMB      HEC 201  15.069   9.042   3.038
  793   2HMB  HEC 201          2HMB      HEC 201  14.097   9.581   4.406
  794   3HMB  HEC 201          3HMB      HEC 201  15.126   8.158   4.563
  795    HAB  HEC 201           HAB      HEC 201  14.434   5.431   1.272
  796   1HBB  HEC 201          1HBB      HEC 201  15.239   4.891   3.569
  797   2HBB  HEC 201          2HBB      HEC 201  16.016   6.473   3.644
  798   3HBB  HEC 201          3HBB      HEC 201  16.564   5.276   2.470
  799   1HMC  HEC 201          1HMC      HEC 201  10.741   2.217  -0.843
  800   2HMC  HEC 201          2HMC      HEC 201  12.087   3.169  -0.214
  801   3HMC  HEC 201          3HMC      HEC 201  11.546   1.730   0.650
  802    HAC  HEC 201           HAC      HEC 201   7.059   2.302   0.628
  803   1HBC  HEC 201          1HBC      HEC 201   8.291   0.193  -0.404
  804   2HBC  HEC 201          2HBC      HEC 201   8.101   0.366   1.340
  805   3HBC  HEC 201          3HBC      HEC 201   9.633   0.785   0.575
  806   1HMD  HEC 201          1HMD      HEC 201   3.401   4.742   2.778
  807   2HMD  HEC 201          2HMD      HEC 201   4.594   3.474   3.058
  808   3HMD  HEC 201          3HMD      HEC 201   3.745   4.200   4.422
  809   1HAD  HEC 201          1HAD      HEC 201   4.216   8.187   5.280
  810   2HAD  HEC 201          2HAD      HEC 201   3.171   7.316   4.162
  811   1HBD  HEC 201          1HBD      HEC 201   3.040   5.424   5.657
  812   2HBD  HEC 201          2HBD      HEC 201   4.258   6.124   6.724
  813    HHA  HEC 202           HHA      HEC 202   1.531   7.635  -9.527
  814    HHB  HEC 202           HHB      HEC 202   2.860   4.062  -4.912
  815    HHC  HEC 202           HHC      HEC 202   4.535   8.921  -1.280
  816    HHD  HEC 202           HHD      HEC 202   2.653  12.860  -5.923
  817   1HMA  HEC 202          1HMA      HEC 202   2.058   2.785  -7.404
  818   2HMA  HEC 202          2HMA      HEC 202   0.347   3.208  -7.371
  819   3HMA  HEC 202          3HMA      HEC 202   1.261   3.118  -5.867
  820   1HAA  HEC 202          1HAA      HEC 202   1.060   5.343 -10.065
  821   2HAA  HEC 202          2HAA      HEC 202  -0.005   4.400  -9.058
  822   1HBA  HEC 202          1HBA      HEC 202  -1.329   6.395  -8.552
  823   2HBA  HEC 202          2HBA      HEC 202  -0.252   7.371  -9.546
  824   1HMB  HEC 202          1HMB      HEC 202   4.341   3.719  -1.441
  825   2HMB  HEC 202          2HMB      HEC 202   2.880   3.458  -2.396
  826   3HMB  HEC 202          3HMB      HEC 202   4.466   3.304  -3.151
  827    HAB  HEC 202           HAB      HEC 202   4.150   6.978   0.052
  828   1HBB  HEC 202          1HBB      HEC 202   6.380   6.859   0.341
  829   2HBB  HEC 202          2HBB      HEC 202   6.546   6.248  -1.306
  830   3HBB  HEC 202          3HBB      HEC 202   6.333   5.122   0.033
  831   1HMC  HEC 202          1HMC      HEC 202   5.094  10.818  -0.702
  832   2HMC  HEC 202          2HMC      HEC 202   4.101  12.275  -0.665
  833   3HMC  HEC 202          3HMC      HEC 202   5.684  12.306  -1.442
  834    HAC  HEC 202           HAC      HEC 202   2.842  13.973  -4.178
  835   1HBC  HEC 202          1HBC      HEC 202   5.240  13.982  -2.297
  836   2HBC  HEC 202          2HBC      HEC 202   4.423  15.429  -2.888
  837   3HBC  HEC 202          3HBC      HEC 202   5.275  14.374  -4.016
  838   1HMD  HEC 202          1HMD      HEC 202   2.787  13.474  -8.478
  839   2HMD  HEC 202          2HMD      HEC 202   1.053  13.353  -8.182
  840   3HMD  HEC 202          3HMD      HEC 202   1.712  12.917  -9.760
  841   1HAD  HEC 202          1HAD      HEC 202   1.781   9.216 -10.781
  842   2HAD  HEC 202          2HAD      HEC 202   1.031  10.802 -10.885
  843   1HBD  HEC 202          1HBD      HEC 202   3.525  11.638 -10.583
  844   2HBD  HEC 202          2HBD      HEC 202   3.901  10.032 -11.207
  845    HHA  HEC 203           HHA      HEC 203   7.030  -6.933   4.586
  846    HHB  HEC 203           HHB      HEC 203   2.663  -2.142   4.886
  847    HHC  HEC 203           HHC      HEC 203   4.648   0.027  -0.437
  848    HHD  HEC 203           HHD      HEC 203   8.938  -4.574  -0.913
  849   1HMA  HEC 203          1HMA      HEC 203   3.455  -3.500   7.636
  850   2HMA  HEC 203          2HMA      HEC 203   2.938  -5.177   7.447
  851   3HMA  HEC 203          3HMA      HEC 203   2.148  -3.900   6.522
  852   1HAA  HEC 203          1HAA      HEC 203   4.773  -6.187   7.698
  853   2HAA  HEC 203          2HAA      HEC 203   4.598  -7.386   6.423
  854   1HBA  HEC 203          1HBA      HEC 203   6.812  -7.854   6.412
  855   2HBA  HEC 203          2HBA      HEC 203   7.256  -6.148   6.468
  856   1HMB  HEC 203          1HMB      HEC 203   1.295  -0.586   4.363
  857   2HMB  HEC 203          2HMB      HEC 203   2.479   0.606   4.900
  858   3HMB  HEC 203          3HMB      HEC 203   1.447   0.952   3.513
  859    HAB  HEC 203           HAB      HEC 203   2.817   0.841   0.085
  860   1HBB  HEC 203          1HBB      HEC 203   4.537   2.331   1.648
  861   2HBB  HEC 203          2HBB      HEC 203   2.987   3.114   1.954
  862   3HBB  HEC 203          3HBB      HEC 203   3.593   2.978   0.303
  863   1HMC  HEC 203          1HMC      HEC 203   7.350   0.182  -2.746
  864   2HMC  HEC 203          2HMC      HEC 203   6.022  -0.730  -3.464
  865   3HMC  HEC 203          3HMC      HEC 203   5.707   0.391  -2.138
  866    HAC  HEC 203           HAC      HEC 203   9.182  -3.439  -2.545
  867   1HBC  HEC 203          1HBC      HEC 203   9.292  -0.843  -2.631
  868   2HBC  HEC 203          2HBC      HEC 203   8.240  -0.992  -4.035
  869   3HBC  HEC 203          3HBC      HEC 203   9.837  -1.739  -4.047
  870   1HMD  HEC 203          1HMD      HEC 203   9.877  -7.693   0.032
  871   2HMD  HEC 203          2HMD      HEC 203  10.939  -6.820   1.137
  872   3HMD  HEC 203          3HMD      HEC 203  10.328  -6.024  -0.313
  873   1HAD  HEC 203          1HAD      HEC 203  10.097  -7.855   3.184
  874   2HAD  HEC 203          2HAD      HEC 203   8.641  -7.938   4.168
  875   1HBD  HEC 203          1HBD      HEC 203   7.744  -9.082   1.868
  876   2HBD  HEC 203          2HBD      HEC 203   9.438  -9.573   1.837
  877    HHA  HEC 204           HHA      HEC 204  -6.796   2.208   3.757
  878    HHB  HEC 204           HHB      HEC 204 -10.067  -2.280   0.816
  879    HHC  HEC 204           HHC      HEC 204  -4.794  -5.953   0.868
  880    HHD  HEC 204           HHD      HEC 204  -1.492  -1.012   2.681
  881   1HMA  HEC 204          1HMA      HEC 204 -11.119   0.856   0.906
  882   2HMA  HEC 204          2HMA      HEC 204 -11.698   0.420   2.515
  883   3HMA  HEC 204          3HMA      HEC 204 -11.413  -0.837   1.311
  884   1HAA  HEC 204          1HAA      HEC 204 -10.233   2.116   4.051
  885   2HAA  HEC 204          2HAA      HEC 204  -8.651   2.832   3.748
  886   1HBA  HEC 204          1HBA      HEC 204  -9.269   3.152   1.368
  887   2HBA  HEC 204          2HBA      HEC 204 -10.858   2.479   1.706
  888   1HMB  HEC 204          1HMB      HEC 204  -9.688  -4.864  -1.652
  889   2HMB  HEC 204          2HMB      HEC 204 -10.512  -3.896  -0.430
  890   3HMB  HEC 204          3HMB      HEC 204 -10.225  -5.613  -0.148
  891    HAB  HEC 204           HAB      HEC 204  -6.408  -7.015   0.159
  892   1HBB  HEC 204          1HBB      HEC 204  -5.663  -6.390  -1.963
  893   2HBB  HEC 204          2HBB      HEC 204  -7.252  -5.803  -2.459
  894   3HBB  HEC 204          3HBB      HEC 204  -6.950  -7.537  -2.335
  895   1HMC  HEC 204          1HMC      HEC 204  -1.604  -6.073   0.423
  896   2HMC  HEC 204          2HMC      HEC 204  -1.535  -6.218   2.178
  897   3HMC  HEC 204          3HMC      HEC 204  -3.004  -6.667   1.314
  898    HAC  HEC 204           HAC      HEC 204  -0.412  -2.523   2.901
  899   1HBC  HEC 204          1HBC      HEC 204   0.426  -4.308   0.592
  900   2HBC  HEC 204          2HBC      HEC 204   1.426  -3.147   1.468
  901   3HBC  HEC 204          3HBC      HEC 204   0.132  -2.579   0.413
  902   1HMD  HEC 204          1HMD      HEC 204  -1.644   2.591   3.938
  903   2HMD  HEC 204          2HMD      HEC 204  -1.207   0.970   4.478
  904   3HMD  HEC 204          3HMD      HEC 204  -1.011   1.417   2.784
  905   1HAD  HEC 204          1HAD      HEC 204  -3.654   3.792   3.655
  906   2HAD  HEC 204          2HAD      HEC 204  -5.331   3.461   4.082
  907   1HBD  HEC 204          1HBD      HEC 204  -4.157   2.169   6.105
  908   2HBD  HEC 204          2HBD      HEC 204  -2.884   3.340   5.774
  Start of MODEL   16
    1   1H    ALA   1          1H        ALA   1  20.561  14.493   1.159
    2   2H    ALA   1          2H        ALA   1  20.699  15.315   2.640
    3   3H    ALA   1          3H        ALA   1  19.165  14.970   1.996
    4    HA   ALA   1           HA       ALA   1  20.081  12.499   2.126
    5   1HB   ALA   1          1HB       ALA   1  22.275  13.284   2.884
    6   2HB   ALA   1          2HB       ALA   1  21.499  12.382   4.185
    7   3HB   ALA   1          3HB       ALA   1  21.528  14.144   4.229
    8    HA   PRO   2           HA       PRO   2  16.376  13.451   4.589
    9   1HB   PRO   2          1HB       PRO   2  14.993  11.245   3.755
   10   2HB   PRO   2          2HB       PRO   2  15.054  12.750   2.827
   11   1HG   PRO   2          1HG       PRO   2  16.566  10.222   2.431
   12   2HG   PRO   2          2HG       PRO   2  15.891  11.331   1.228
   13   1HD   PRO   2          1HD       PRO   2  18.539  11.253   1.897
   14   2HD   PRO   2          2HD       PRO   2  17.720  12.703   1.275
   15    H    LYS   3           H        LYS   3  15.668  12.465   6.543
   16    HA   LYS   3           HA       LYS   3  17.320  10.134   7.432
   17   1HB   LYS   3          1HB       LYS   3  15.760  12.185   9.012
   18   2HB   LYS   3          2HB       LYS   3  16.874  10.986   9.663
   19   1HG   LYS   3          1HG       LYS   3  18.758  12.027   8.616
   20   2HG   LYS   3          2HG       LYS   3  17.722  13.063   7.634
   21   1HD   LYS   3          1HD       LYS   3  17.916  14.625   9.247
   22   2HD   LYS   3          2HD       LYS   3  16.935  13.576  10.272
   23   1HE   LYS   3          1HE       LYS   3  18.901  12.520  11.205
   24   2HE   LYS   3          2HE       LYS   3  19.955  13.340  10.035
   25   1HZ   LYS   3          1HZ       LYS   3  18.245  14.649  12.084
   26   2HZ   LYS   3          2HZ       LYS   3  19.140  15.473  10.899
   27   3HZ   LYS   3          3HZ       LYS   3  19.938  14.570  12.097
   28    H    ALA   4           H        ALA   4  15.874   8.596   6.466
   29    HA   ALA   4           HA       ALA   4  13.147   8.296   6.542
   30   1HB   ALA   4          1HB       ALA   4  14.665   5.947   7.533
   31   2HB   ALA   4          2HB       ALA   4  15.299   6.689   6.065
   32   3HB   ALA   4          3HB       ALA   4  13.638   6.096   6.108
   33    HA   PRO   5           HA       PRO   5  12.158   8.482  10.826
   34   1HB   PRO   5          1HB       PRO   5   9.527   7.744  10.622
   35   2HB   PRO   5          2HB       PRO   5  10.134   9.353  10.196
   36   1HG   PRO   5          1HG       PRO   5   9.286   7.139   8.444
   37   2HG   PRO   5          2HG       PRO   5   9.302   8.880   8.146
   38   1HD   PRO   5          1HD       PRO   5  11.168   7.010   7.190
   39   2HD   PRO   5          2HD       PRO   5  11.320   8.777   7.142
   40    H    ALA   6           H        ALA   6  11.464   7.049  12.575
   41    HA   ALA   6           HA       ALA   6  12.572   4.454  12.482
   42   1HB   ALA   6          1HB       ALA   6  10.447   5.665  14.281
   43   2HB   ALA   6          2HB       ALA   6  12.192   5.781  14.515
   44   3HB   ALA   6          3HB       ALA   6  11.384   4.218  14.658
   45    H    ASP   7           H        ASP   7  11.611   2.421  12.293
   46    HA   ASP   7           HA       ASP   7   9.470   2.064  10.457
   47   1HB   ASP   7          1HB       ASP   7  10.373   0.102  12.575
   48   2HB   ASP   7          2HB       ASP   7   9.799  -0.250  10.946
   49    H    GLY   8           H        GLY   8   7.378   1.059  10.964
   50   1HA   GLY   8          1HA       GLY   8   5.572   0.536  12.486
   51   2HA   GLY   8          2HA       GLY   8   6.379   1.501  13.722
   52    H    LEU   9           H        LEU   9   6.259   2.899  10.574
   53    HA   LEU   9           HA       LEU   9   4.798   5.201  11.463
   54   1HB   LEU   9          1HB       LEU   9   6.256   4.377   9.225
   55   2HB   LEU   9          2HB       LEU   9   4.626   4.652   8.603
   56    HG   LEU   9           HG       LEU   9   5.630   6.688  10.503
   57   1HD1  LEU   9          1HD1      LEU   9   6.781   7.767   8.393
   58   2HD1  LEU   9          2HD1      LEU   9   6.916   6.093   7.852
   59   3HD1  LEU   9          3HD1      LEU   9   7.672   6.596   9.366
   60   1HD2  LEU   9          1HD2      LEU   9   4.613   8.164   8.695
   61   2HD2  LEU   9          2HD2      LEU   9   3.486   7.036   9.462
   62   3HD2  LEU   9          3HD2      LEU   9   4.143   6.681   7.864
   63    H    LYS  10           H        LYS  10   2.661   5.245  11.940
   64    HA   LYS  10           HA       LYS  10   0.890   3.172  10.744
   65   1HB   LYS  10          1HB       LYS  10   0.956   4.878  13.179
   66   2HB   LYS  10          2HB       LYS  10  -0.633   4.451  12.543
   67   1HG   LYS  10          1HG       LYS  10   0.172   2.039  12.471
   68   2HG   LYS  10          2HG       LYS  10   1.569   2.569  13.409
   69   1HD   LYS  10          1HD       LYS  10  -0.175   3.607  15.026
   70   2HD   LYS  10          2HD       LYS  10  -1.336   2.554  14.214
   71   1HE   LYS  10          1HE       LYS  10   0.024   0.580  14.777
   72   2HE   LYS  10          2HE       LYS  10   1.228   1.623  15.561
   73   1HZ   LYS  10          1HZ       LYS  10  -0.150   2.099  17.276
   74   2HZ   LYS  10          2HZ       LYS  10  -0.815   0.585  16.883
   75   3HZ   LYS  10          3HZ       LYS  10  -1.556   2.011  16.332
   76    H    MET  11           H        MET  11   0.080   3.851   8.818
   77    HA   MET  11           HA       MET  11  -0.585   6.685   8.335
   78   1HB   MET  11          1HB       MET  11  -0.058   4.245   6.842
   79   2HB   MET  11          2HB       MET  11  -1.524   5.033   6.255
   80   1HG   MET  11          1HG       MET  11   1.172   6.372   6.614
   81   2HG   MET  11          2HG       MET  11   0.465   5.888   5.076
   82   1HE   MET  11          1HE       MET  11   0.369   9.373   7.479
   83   2HE   MET  11          2HE       MET  11   0.927   9.582   5.821
   84   3HE   MET  11          3HE       MET  11   1.556   8.255   6.793
   85    H    ASP  12           H        ASP  12  -2.434   7.295   9.413
   86    HA   ASP  12           HA       ASP  12  -4.747   5.389   9.423
   87   1HB   ASP  12          1HB       ASP  12  -5.492   7.056  11.247
   88   2HB   ASP  12          2HB       ASP  12  -4.112   6.026  11.603
   89    H    LYS  13           H        LYS  13  -3.838   7.429   7.281
   90    HA   LYS  13           HA       LYS  13  -5.553   9.625   7.048
   91   1HB   LYS  13          1HB       LYS  13  -4.393   7.615   5.124
   92   2HB   LYS  13          2HB       LYS  13  -5.350   8.974   4.542
   93   1HG   LYS  13          1HG       LYS  13  -2.872   9.168   6.280
   94   2HG   LYS  13          2HG       LYS  13  -2.952   9.552   4.558
   95   1HD   LYS  13          1HD       LYS  13  -5.003  11.076   5.514
   96   2HD   LYS  13          2HD       LYS  13  -3.892  11.118   6.884
   97   1HE   LYS  13          1HE       LYS  13  -2.055  11.801   5.312
   98   2HE   LYS  13          2HE       LYS  13  -3.266  11.909   4.019
   99   1HZ   LYS  13          1HZ       LYS  13  -3.200  14.044   4.954
  100   2HZ   LYS  13          2HZ       LYS  13  -3.144  13.451   6.544
  101   3HZ   LYS  13          3HZ       LYS  13  -4.576  13.326   5.638
  102    H    THR  14           H        THR  14  -6.266   6.212   6.696
  103    HA   THR  14           HA       THR  14  -9.119   6.878   6.018
  104    HB   THR  14           HB       THR  14  -9.075   4.493   5.114
  105    HG1  THR  14           1HG      THR  14  -7.183   3.923   6.321
  106   1HG2  THR  14          1HG2      THR  14  -8.744   6.638   3.762
  107   2HG2  THR  14          2HG2      THR  14  -8.118   5.156   3.039
  108   3HG2  THR  14          3HG2      THR  14  -7.017   6.288   3.824
  109    H    LYS  15           H        LYS  15 -10.389   4.598   6.665
  110    HA   LYS  15           HA       LYS  15 -10.437   4.600   9.573
  111   1HB   LYS  15          1HB       LYS  15 -11.858   3.308   7.280
  112   2HB   LYS  15          2HB       LYS  15 -12.023   2.556   8.866
  113   1HG   LYS  15          1HG       LYS  15 -13.736   4.065   9.073
  114   2HG   LYS  15          2HG       LYS  15 -12.423   5.140   9.552
  115   1HD   LYS  15          1HD       LYS  15 -12.357   6.207   7.475
  116   2HD   LYS  15          2HD       LYS  15 -13.119   4.851   6.643
  117   1HE   LYS  15          1HE       LYS  15 -15.229   5.593   7.121
  118   2HE   LYS  15          2HE       LYS  15 -14.777   6.099   8.762
  119   1HZ   LYS  15          1HZ       LYS  15 -15.168   7.823   6.768
  120   2HZ   LYS  15          2HZ       LYS  15 -13.503   7.541   6.582
  121   3HZ   LYS  15          3HZ       LYS  15 -14.110   8.121   8.060
  122    H    GLN  16           H        GLN  16  -8.977   2.640   7.077
  123    HA   GLN  16           HA       GLN  16  -8.164   0.562   9.058
  124   1HB   GLN  16          1HB       GLN  16  -8.356   0.793   6.058
  125   2HB   GLN  16          2HB       GLN  16  -7.376  -0.479   6.787
  126   1HG   GLN  16          1HG       GLN  16  -9.685  -0.659   8.258
  127   2HG   GLN  16          2HG       GLN  16 -10.309  -0.203   6.671
  128   1HE2  GLN  16          2HE2      GLN  16  -7.438  -2.219   7.474
  129   2HE2  GLN  16          1HE2      GLN  16  -7.987  -3.596   6.647
  130    HA   PRO  17           HA       PRO  17  -4.460   3.285   8.735
  131   1HB   PRO  17          1HB       PRO  17  -3.633   2.805  11.306
  132   2HB   PRO  17          2HB       PRO  17  -4.804   4.070  10.878
  133   1HG   PRO  17          1HG       PRO  17  -5.294   1.325  11.945
  134   2HG   PRO  17          2HG       PRO  17  -6.065   2.859  12.385
  135   1HD   PRO  17          1HD       PRO  17  -7.256   1.078  10.748
  136   2HD   PRO  17          2HD       PRO  17  -7.470   2.834  10.554
  137    H    VAL  18           H        VAL  18  -2.376   2.557   8.257
  138    HA   VAL  18           HA       VAL  18  -1.811  -0.343   8.752
  139    HB   VAL  18           HB       VAL  18  -1.411   1.494   6.390
  140   1HG1  VAL  18          1HG1      VAL  18  -0.373  -0.887   5.570
  141   2HG1  VAL  18          2HG1      VAL  18   0.177  -0.843   7.245
  142   3HG1  VAL  18          3HG1      VAL  18   0.600   0.467   6.145
  143   1HG2  VAL  18          1HG2      VAL  18  -3.396   0.457   5.949
  144   2HG2  VAL  18          2HG2      VAL  18  -3.077  -0.851   7.088
  145   3HG2  VAL  18          3HG2      VAL  18  -2.366  -0.894   5.474
  146    H    VAL  19           H        VAL  19   0.303  -0.826   9.436
  147    HA   VAL  19           HA       VAL  19   1.963   1.481  10.314
  148    HB   VAL  19           HB       VAL  19   1.877  -1.489  10.897
  149   1HG1  VAL  19          1HG1      VAL  19   4.132  -1.228  11.225
  150   2HG1  VAL  19          2HG1      VAL  19   3.592  -0.531  12.753
  151   3HG1  VAL  19          3HG1      VAL  19   4.007   0.522  11.401
  152   1HG2  VAL  19          1HG2      VAL  19   0.247   0.295  11.902
  153   2HG2  VAL  19          2HG2      VAL  19   1.643   0.770  12.870
  154   3HG2  VAL  19          3HG2      VAL  19   1.008  -0.870  12.986
  155    H    PHE  20           H        PHE  20   3.403   2.123   8.671
  156    HA   PHE  20           HA       PHE  20   4.562   0.050   6.890
  157   1HB   PHE  20          1HB       PHE  20   3.745   2.180   5.948
  158   2HB   PHE  20          2HB       PHE  20   4.855   3.074   6.986
  159    HD1  PHE  20           HD1      PHE  20   4.969   0.164   4.609
  160    HD2  PHE  20           HD2      PHE  20   6.881   3.728   6.041
  161    HE1  PHE  20           HE1      PHE  20   6.797  -0.150   2.964
  162    HE2  PHE  20           HE2      PHE  20   8.704   3.415   4.399
  163    HZ   PHE  20           HZ       PHE  20   8.668   1.476   2.859
  164    H    ASN  21           H        ASN  21   6.431  -0.939   7.528
  165    HA   ASN  21           HA       ASN  21   8.178   0.397   9.518
  166   1HB   ASN  21          1HB       ASN  21   7.290  -2.267   8.795
  167   2HB   ASN  21          2HB       ASN  21   9.042  -2.190   8.870
  168   1HD2  ASN  21          2HD2      ASN  21   9.182  -3.375  10.897
  169   2HD2  ASN  21          1HD2      ASN  21   8.650  -2.704  12.361
  170    H    HIS  22           H        HIS  22   9.450   1.840   8.248
  171    HA   HIS  22           HA       HIS  22  10.454   1.488   5.661
  172   1HB   HIS  22          1HB       HIS  22  11.371   2.857   8.164
  173   2HB   HIS  22          2HB       HIS  22  12.473   2.813   6.788
  174    HD1  HIS  22           HD1      HIS  22   9.607   4.624   8.117
  175    HD2  HIS  22           HD2      HIS  22  11.175   3.931   4.314
  176    HE1  HIS  22           HE1      HIS  22   8.642   6.409   6.609
  177    H    SER  23           H        SER  23  11.632   0.094   8.700
  178    HA   SER  23           HA       SER  23  14.150  -0.885   7.968
  179   1HB   SER  23          1HB       SER  23  13.553  -1.310  10.169
  180   2HB   SER  23          2HB       SER  23  11.902  -1.752   9.740
  181    HG   SER  23           HG       SER  23  14.267  -3.270   9.632
  182    H    THR  24           H        THR  24  10.947  -2.294   7.279
  183    HA   THR  24           HA       THR  24  12.026  -4.598   5.859
  184    HB   THR  24           HB       THR  24   9.320  -4.000   5.155
  185    HG1  THR  24           1HG      THR  24   9.862  -3.718   7.920
  186   1HG2  THR  24          1HG2      THR  24  10.885  -6.017   6.583
  187   2HG2  THR  24          2HG2      THR  24   9.482  -6.220   5.535
  188   3HG2  THR  24          3HG2      THR  24   9.260  -5.824   7.239
  189    H    HIS  25           H        HIS  25  11.747  -1.327   5.092
  190    HA   HIS  25           HA       HIS  25  11.679  -1.919   2.165
  191   1HB   HIS  25          1HB       HIS  25  10.796   0.518   3.740
  192   2HB   HIS  25          2HB       HIS  25  10.614   0.286   2.004
  193    HD1  HIS  25           HD1      HIS  25   9.321  -0.953   5.302
  194    HD2  HIS  25           HD2      HIS  25   8.571  -1.545   1.247
  195    HE1  HIS  25           HE1      HIS  25   7.183  -2.301   5.160
  196    H    LYS  26           H        LYS  26  13.648  -0.915   4.714
  197    HA   LYS  26           HA       LYS  26  15.150   1.248   3.676
  198   1HB   LYS  26          1HB       LYS  26  16.857   0.457   5.222
  199   2HB   LYS  26          2HB       LYS  26  15.278   0.165   5.954
  200   1HG   LYS  26          1HG       LYS  26  15.348  -2.175   5.127
  201   2HG   LYS  26          2HG       LYS  26  16.954  -1.876   4.463
  202   1HD   LYS  26          1HD       LYS  26  16.536  -1.184   7.329
  203   2HD   LYS  26          2HD       LYS  26  16.591  -2.900   6.922
  204   1HE   LYS  26          1HE       LYS  26  18.736  -2.275   5.566
  205   2HE   LYS  26          2HE       LYS  26  18.742  -0.815   6.576
  206   1HZ   LYS  26          1HZ       LYS  26  18.932  -2.030   8.503
  207   2HZ   LYS  26          2HZ       LYS  26  19.871  -2.972   7.447
  208   3HZ   LYS  26          3HZ       LYS  26  18.281  -3.439   7.822
  209    H    ALA  27           H        ALA  27  15.027  -2.109   2.739
  210    HA   ALA  27           HA       ALA  27  17.486  -1.918   1.093
  211   1HB   ALA  27          1HB       ALA  27  15.452  -4.150   1.418
  212   2HB   ALA  27          2HB       ALA  27  16.840  -3.923   2.483
  213   3HB   ALA  27          3HB       ALA  27  17.089  -4.301   0.778
  214    H    VAL  28           H        VAL  28  14.265  -1.062   0.799
  215    HA   VAL  28           HA       VAL  28  13.852  -1.873  -1.994
  216    HB   VAL  28           HB       VAL  28  12.395  -0.135   0.009
  217   1HG1  VAL  28          1HG1      VAL  28  10.514  -0.160  -1.628
  218   2HG1  VAL  28          2HG1      VAL  28  11.604  -0.869  -2.819
  219   3HG1  VAL  28          3HG1      VAL  28  11.907   0.753  -2.197
  220   1HG2  VAL  28          1HG2      VAL  28  11.797  -2.849  -1.202
  221   2HG2  VAL  28          2HG2      VAL  28  10.758  -1.995  -0.062
  222   3HG2  VAL  28          3HG2      VAL  28  12.351  -2.553   0.446
  223    H    LYS  29           H        LYS  29  13.128   0.092  -3.484
  224    HA   LYS  29           HA       LYS  29  15.437   1.928  -3.530
  225   1HB   LYS  29          1HB       LYS  29  13.554   0.763  -5.378
  226   2HB   LYS  29          2HB       LYS  29  13.603   2.516  -5.574
  227   1HG   LYS  29          1HG       LYS  29  15.425   2.077  -6.866
  228   2HG   LYS  29          2HG       LYS  29  16.250   1.982  -5.308
  229   1HD   LYS  29          1HD       LYS  29  15.127  -0.548  -5.619
  230   2HD   LYS  29          2HD       LYS  29  15.694  -0.138  -7.238
  231   1HE   LYS  29          1HE       LYS  29  17.916   0.515  -6.189
  232   2HE   LYS  29          2HE       LYS  29  17.325  -0.209  -4.681
  233   1HZ   LYS  29          1HZ       LYS  29  17.086  -1.690  -7.216
  234   2HZ   LYS  29          2HZ       LYS  29  17.167  -2.289  -5.628
  235   3HZ   LYS  29          3HZ       LYS  29  18.566  -1.693  -6.386
  236    H    CYS  30           H        CYS  30  15.181   3.568  -2.120
  237    HA   CYS  30           HA       CYS  30  12.898   4.761  -1.063
  238   1HB   CYS  30          1HB       CYS  30  15.633   5.745  -1.829
  239   2HB   CYS  30          2HB       CYS  30  14.451   6.904  -1.228
  240    H    GLY  31           H        GLY  31  14.130   4.959  -4.315
  241   1HA   GLY  31          1HA       GLY  31  12.378   7.231  -5.014
  242   2HA   GLY  31          2HA       GLY  31  13.513   6.428  -6.102
  243    H    ASP  32           H        ASP  32  12.169   3.814  -4.875
  244    HA   ASP  32           HA       ASP  32  10.282   3.515  -7.098
  245   1HB   ASP  32          1HB       ASP  32  11.883   1.890  -5.477
  246   2HB   ASP  32          2HB       ASP  32  10.240   1.466  -5.018
  247    H    CYS  33           H        CYS  33  10.201   4.202  -3.674
  248    HA   CYS  33           HA       CYS  33   7.227   4.025  -3.579
  249   1HB   CYS  33          1HB       CYS  33   9.485   4.379  -1.589
  250   2HB   CYS  33          2HB       CYS  33   7.806   4.629  -1.120
  251    H    HIS  34           H        HIS  34   9.788   6.336  -2.582
  252    HA   HIS  34           HA       HIS  34   7.945   8.627  -2.899
  253   1HB   HIS  34          1HB       HIS  34  10.864   8.300  -2.109
  254   2HB   HIS  34          2HB       HIS  34  10.035   9.847  -2.146
  255    HD1  HIS  34           HD1      HIS  34   7.678   9.814  -0.612
  256    HD2  HIS  34           HD2      HIS  34  10.680   7.084   0.349
  257    HE1  HIS  34           HE1      HIS  34   7.255   9.087   1.778
  258    H    HIS  35           H        HIS  35   8.351   7.225  -5.320
  259    HA   HIS  35           HA       HIS  35  10.354   7.660  -7.069
  260   1HB   HIS  35          1HB       HIS  35   8.479   8.241  -8.752
  261   2HB   HIS  35          2HB       HIS  35   8.334   6.734  -7.868
  262    HD1  HIS  35           HD1      HIS  35   7.042  10.225  -7.916
  263    HD2  HIS  35           HD2      HIS  35   6.076   6.577  -6.174
  264    HE1  HIS  35           HE1      HIS  35   4.773  10.535  -6.847
  265    HA   PRO  36           HA       PRO  36  11.486  11.837  -7.395
  266   1HB   PRO  36          1HB       PRO  36  11.980  12.072 -10.085
  267   2HB   PRO  36          2HB       PRO  36  13.058  11.216  -8.962
  268   1HG   PRO  36          1HG       PRO  36  10.976  10.109 -10.796
  269   2HG   PRO  36          2HG       PRO  36  12.615   9.520 -10.466
  270   1HD   PRO  36          1HD       PRO  36  10.452   8.388  -9.338
  271   2HD   PRO  36          2HD       PRO  36  12.001   8.520  -8.471
  272    H    VAL  37           H        VAL  37   9.704  13.101  -6.928
  273    HA   VAL  37           HA       VAL  37   7.726  13.645  -9.104
  274    HB   VAL  37           HB       VAL  37   7.779  13.862  -6.096
  275   1HG1  VAL  37          1HG1      VAL  37   6.853  15.986  -7.066
  276   2HG1  VAL  37          2HG1      VAL  37   5.668  15.061  -6.145
  277   3HG1  VAL  37          3HG1      VAL  37   5.641  15.020  -7.907
  278   1HG2  VAL  37          1HG2      VAL  37   6.981  11.757  -6.741
  279   2HG2  VAL  37          2HG2      VAL  37   6.195  12.392  -8.188
  280   3HG2  VAL  37          3HG2      VAL  37   5.488  12.685  -6.599
  281    H    ASN  38           H        ASN  38   7.261  15.902  -9.590
  282    HA   ASN  38           HA       ASN  38   7.997  18.113 -10.073
  283   1HB   ASN  38          1HB       ASN  38   7.276  17.922  -7.604
  284   2HB   ASN  38          2HB       ASN  38   8.984  17.953  -7.231
  285   1HD2  ASN  38          2HD2      ASN  38   6.504  20.024  -7.182
  286   2HD2  ASN  38          1HD2      ASN  38   7.263  21.452  -7.699
  287    H    GLY  39           H        GLY  39  10.051  15.809 -10.321
  288   1HA   GLY  39          1HA       GLY  39  12.269  15.941 -11.205
  289   2HA   GLY  39          2HA       GLY  39  12.408  17.572 -10.542
  290    H    LYS  40           H        LYS  40  11.103  16.114  -8.019
  291    HA   LYS  40           HA       LYS  40  13.657  14.879  -7.030
  292   1HB   LYS  40          1HB       LYS  40  13.311  16.227  -4.937
  293   2HB   LYS  40          2HB       LYS  40  13.626  17.221  -6.359
  294   1HG   LYS  40          1HG       LYS  40  10.840  16.837  -6.325
  295   2HG   LYS  40          2HG       LYS  40  11.285  17.176  -4.653
  296   1HD   LYS  40          1HD       LYS  40  12.627  19.146  -5.516
  297   2HD   LYS  40          2HD       LYS  40  11.884  18.868  -7.091
  298   1HE   LYS  40          1HE       LYS  40  10.263  20.288  -6.303
  299   2HE   LYS  40          2HE       LYS  40   9.683  18.853  -5.437
  300   1HZ   LYS  40          1HZ       LYS  40  11.069  19.403  -3.575
  301   2HZ   LYS  40          2HZ       LYS  40  10.120  20.762  -3.949
  302   3HZ   LYS  40          3HZ       LYS  40  11.757  20.713  -4.404
  303    H    GLU  41           H        GLU  41  13.315  13.113  -5.666
  304    HA   GLU  41           HA       GLU  41  10.718  11.874  -5.574
  305   1HB   GLU  41          1HB       GLU  41  13.377  11.456  -4.203
  306   2HB   GLU  41          2HB       GLU  41  11.988  10.440  -3.818
  307   1HG   GLU  41          1HG       GLU  41  11.861   9.586  -6.020
  308   2HG   GLU  41          2HG       GLU  41  12.869  10.877  -6.673
  309    H    ASP  42           H        ASP  42   9.057  12.719  -4.338
  310    HA   ASP  42           HA       ASP  42   9.489  14.416  -2.041
  311   1HB   ASP  42          1HB       ASP  42   7.090  12.793  -2.929
  312   2HB   ASP  42          2HB       ASP  42   7.057  14.125  -1.774
  313    H    TYR  43           H        TYR  43  10.716  13.395  -0.460
  314    HA   TYR  43           HA       TYR  43  10.159  10.640   0.379
  315   1HB   TYR  43          1HB       TYR  43  11.973  12.838   1.429
  316   2HB   TYR  43          2HB       TYR  43  12.002  11.167   1.991
  317    HD1  TYR  43           HD1      TYR  43  13.016  13.476  -0.618
  318    HD2  TYR  43           HD2      TYR  43  12.566   9.317   0.365
  319    HE1  TYR  43           HE1      TYR  43  14.500  12.868  -2.509
  320    HE2  TYR  43           HE2      TYR  43  14.048   8.710  -1.526
  321    HH   TYR  43           HH       TYR  43  15.872  11.086  -3.268
  322    H    GLN  44           H        GLN  44   7.786  11.902   0.751
  323    HA   GLN  44           HA       GLN  44   7.690  12.382   3.712
  324   1HB   GLN  44          1HB       GLN  44   5.797  13.992   3.078
  325   2HB   GLN  44          2HB       GLN  44   7.427  14.501   2.640
  326   1HG   GLN  44          1HG       GLN  44   7.093  13.658   0.353
  327   2HG   GLN  44          2HG       GLN  44   5.468  13.117   0.784
  328   1HE2  GLN  44          2HE2      GLN  44   7.015  16.173   1.830
  329   2HE2  GLN  44          1HE2      GLN  44   5.905  17.189   1.044
  330    H    LYS  45           H        LYS  45   5.291  12.157   4.467
  331    HA   LYS  45           HA       LYS  45   4.388   9.555   4.274
  332   1HB   LYS  45          1HB       LYS  45   2.075  10.727   4.702
  333   2HB   LYS  45          2HB       LYS  45   3.364  10.891   5.889
  334   1HG   LYS  45          1HG       LYS  45   3.710  12.935   3.917
  335   2HG   LYS  45          2HG       LYS  45   2.029  12.957   4.446
  336   1HD   LYS  45          1HD       LYS  45   4.253  12.772   6.463
  337   2HD   LYS  45          2HD       LYS  45   3.770  14.335   5.807
  338   1HE   LYS  45          1HE       LYS  45   2.150  14.350   7.402
  339   2HE   LYS  45          2HE       LYS  45   1.347  13.082   6.455
  340   1HZ   LYS  45          1HZ       LYS  45   3.573  12.452   8.294
  341   2HZ   LYS  45          2HZ       LYS  45   2.400  11.404   7.654
  342   3HZ   LYS  45          3HZ       LYS  45   1.974  12.527   8.855
  343    H    CYS  46           H        CYS  46   3.502   8.337   2.697
  344    HA   CYS  46           HA       CYS  46   3.220   9.008   0.013
  345   1HB   CYS  46          1HB       CYS  46   1.591   7.097   1.713
  346   2HB   CYS  46          2HB       CYS  46   1.729   7.018  -0.039
  347    H    ALA  47           H        ALA  47   0.761   9.256   2.567
  348    HA   ALA  47           HA       ALA  47  -1.125  10.537   0.648
  349   1HB   ALA  47          1HB       ALA  47  -2.271   8.925   1.828
  350   2HB   ALA  47          2HB       ALA  47  -2.507  10.285   2.925
  351   3HB   ALA  47          3HB       ALA  47  -1.246   9.098   3.253
  352    H    THR  48           H        THR  48   0.952  12.233   1.184
  353    HA   THR  48           HA       THR  48   0.971  13.886   3.413
  354    HB   THR  48           HB       THR  48   1.057  15.210   0.759
  355    HG1  THR  48           1HG      THR  48   3.114  13.419   1.297
  356   1HG2  THR  48          1HG2      THR  48   2.409  15.270   3.339
  357   2HG2  THR  48          2HG2      THR  48   2.325  16.513   2.090
  358   3HG2  THR  48          3HG2      THR  48   3.554  15.253   1.997
  359    H    ALA  49           H        ALA  49   0.171  16.376   3.014
  360    HA   ALA  49           HA       ALA  49  -2.697  16.319   3.384
  361   1HB   ALA  49          1HB       ALA  49  -2.396  18.690   3.734
  362   2HB   ALA  49          2HB       ALA  49  -0.881  18.683   2.831
  363   3HB   ALA  49          3HB       ALA  49  -0.975  17.884   4.400
  364    H    GLY  50           H        GLY  50  -0.645  16.710   0.604
  365   1HA   GLY  50          1HA       GLY  50  -3.074  17.205  -1.057
  366   2HA   GLY  50          2HA       GLY  50  -1.631  18.188  -1.315
  367    H    CYS  51           H        CYS  51  -1.660  14.766  -0.487
  368    HA   CYS  51           HA       CYS  51  -0.526  14.164  -3.195
  369   1HB   CYS  51          1HB       CYS  51   0.751  14.245  -0.766
  370   2HB   CYS  51          2HB       CYS  51   0.365  12.553  -0.884
  371    H    HIS  52           H        HIS  52  -0.474  11.353  -1.504
  372    HA   HIS  52           HA       HIS  52  -2.873  10.318  -2.818
  373   1HB   HIS  52          1HB       HIS  52  -0.830   9.188  -0.894
  374   2HB   HIS  52          2HB       HIS  52  -2.123   8.228  -1.575
  375    HD1  HIS  52           HD1      HIS  52  -2.196   8.683  -4.369
  376    HD2  HIS  52           HD2      HIS  52   1.453   8.844  -2.396
  377    HE1  HIS  52           HE1      HIS  52  -0.416   8.299  -6.139
  378    H    ASP  53           H        ASP  53  -3.903  12.257  -1.276
  379    HA   ASP  53           HA       ASP  53  -4.771  10.976   1.286
  380   1HB   ASP  53          1HB       ASP  53  -5.256  13.311   1.948
  381   2HB   ASP  53          2HB       ASP  53  -3.586  13.137   1.408
  382    H    ASN  54           H        ASN  54  -5.958  10.626  -1.576
  383    HA   ASN  54           HA       ASN  54  -8.579  11.929  -1.378
  384   1HB   ASN  54          1HB       ASN  54  -6.988  10.709  -3.341
  385   2HB   ASN  54          2HB       ASN  54  -8.380   9.646  -3.178
  386   1HD2  ASN  54          2HD2      ASN  54 -10.000  10.228  -4.607
  387   2HD2  ASN  54          1HD2      ASN  54 -10.383  11.818  -5.065
  388    H    MET  55           H        MET  55  -9.830  11.203   0.327
  389    HA   MET  55           HA       MET  55  -9.727   8.439   1.264
  390   1HB   MET  55          1HB       MET  55 -11.068  11.014   1.939
  391   2HB   MET  55          2HB       MET  55 -11.845   9.538   2.516
  392   1HG   MET  55          1HG       MET  55 -10.370   9.528   4.218
  393   2HG   MET  55          2HG       MET  55  -9.112   9.168   3.035
  394   1HE   MET  55          1HE       MET  55  -7.260  10.043   3.296
  395   2HE   MET  55          2HE       MET  55  -7.324  10.675   4.939
  396   3HE   MET  55          3HE       MET  55  -6.754  11.705   3.629
  397    H    ASP  56           H        ASP  56 -10.782   9.209  -1.571
  398    HA   ASP  56           HA       ASP  56 -13.600   8.423  -1.506
  399   1HB   ASP  56          1HB       ASP  56 -11.890   9.775  -3.215
  400   2HB   ASP  56          2HB       ASP  56 -12.115   8.231  -4.038
  401    H    LYS  57           H        LYS  57 -10.540   6.817  -1.600
  402    HA   LYS  57           HA       LYS  57  -9.987   4.524  -1.764
  403   1HB   LYS  57          1HB       LYS  57 -12.969   4.282  -1.269
  404   2HB   LYS  57          2HB       LYS  57 -11.760   3.037  -0.958
  405   1HG   LYS  57          1HG       LYS  57 -10.742   4.328   0.777
  406   2HG   LYS  57          2HG       LYS  57 -11.644   5.774   0.322
  407   1HD   LYS  57          1HD       LYS  57 -12.800   3.224   1.489
  408   2HD   LYS  57          2HD       LYS  57 -12.670   4.786   2.301
  409   1HE   LYS  57          1HE       LYS  57 -14.032   5.596   0.132
  410   2HE   LYS  57          2HE       LYS  57 -14.589   3.911   0.187
  411   1HZ   LYS  57          1HZ       LYS  57 -15.013   4.227   2.587
  412   2HZ   LYS  57          2HZ       LYS  57 -15.988   5.218   1.611
  413   3HZ   LYS  57          3HZ       LYS  57 -14.643   5.874   2.418
  414    H    LYS  58           H        LYS  58 -11.369   6.153  -4.104
  415    HA   LYS  58           HA       LYS  58 -11.698   3.764  -5.881
  416   1HB   LYS  58          1HB       LYS  58 -13.674   4.752  -6.810
  417   2HB   LYS  58          2HB       LYS  58 -13.847   4.879  -5.059
  418   1HG   LYS  58          1HG       LYS  58 -14.205   7.085  -5.403
  419   2HG   LYS  58          2HG       LYS  58 -12.472   7.193  -5.724
  420   1HD   LYS  58          1HD       LYS  58 -12.789   7.497  -7.947
  421   2HD   LYS  58          2HD       LYS  58 -14.025   6.241  -8.028
  422   1HE   LYS  58          1HE       LYS  58 -15.713   7.787  -7.157
  423   2HE   LYS  58          2HE       LYS  58 -14.482   9.050  -6.957
  424   1HZ   LYS  58          1HZ       LYS  58 -14.624   7.738  -9.558
  425   2HZ   LYS  58          2HZ       LYS  58 -14.291   9.361  -9.178
  426   3HZ   LYS  58          3HZ       LYS  58 -15.894   8.799  -9.179
  427    H    ASP  59           H        ASP  59 -10.559   7.041  -5.427
  428    HA   ASP  59           HA       ASP  59 -10.143   7.979  -8.025
  429   1HB   ASP  59          1HB       ASP  59  -9.585   9.345  -6.166
  430   2HB   ASP  59          2HB       ASP  59  -8.536   8.108  -5.470
  431    H    LYS  60           H        LYS  60  -9.363   6.719  -9.689
  432    HA   LYS  60           HA       LYS  60  -7.236   4.722  -9.189
  433   1HB   LYS  60          1HB       LYS  60  -9.401   5.195 -11.037
  434   2HB   LYS  60          2HB       LYS  60  -7.902   4.962 -11.938
  435   1HG   LYS  60          1HG       LYS  60  -8.679   3.109  -9.687
  436   2HG   LYS  60          2HG       LYS  60  -9.262   2.849 -11.332
  437   1HD   LYS  60          1HD       LYS  60  -6.405   3.403 -11.289
  438   2HD   LYS  60          2HD       LYS  60  -6.810   2.002 -10.297
  439   1HE   LYS  60          1HE       LYS  60  -8.319   1.903 -12.762
  440   2HE   LYS  60          2HE       LYS  60  -6.587   2.063 -13.114
  441   1HZ   LYS  60          1HZ       LYS  60  -7.180  -0.257 -12.741
  442   2HZ   LYS  60          2HZ       LYS  60  -7.796   0.129 -11.206
  443   3HZ   LYS  60          3HZ       LYS  60  -6.136   0.297 -11.524
  444    H    SER  61           H        SER  61  -6.998   7.884  -9.349
  445    HA   SER  61           HA       SER  61  -5.018   8.131 -11.542
  446   1HB   SER  61          1HB       SER  61  -6.882   9.789 -10.165
  447   2HB   SER  61          2HB       SER  61  -5.277  10.453  -9.871
  448    HG   SER  61           HG       SER  61  -6.365  11.160 -11.847
  449    H    ALA  62           H        ALA  62  -3.221   9.921 -10.485
  450    HA   ALA  62           HA       ALA  62  -1.636   8.202  -8.672
  451   1HB   ALA  62          1HB       ALA  62  -0.467  10.755  -9.369
  452   2HB   ALA  62          2HB       ALA  62  -1.186  10.013 -10.798
  453   3HB   ALA  62          3HB       ALA  62   0.034   9.141  -9.871
  454    H    LYS  63           H        LYS  63  -4.087   9.815  -7.753
  455    HA   LYS  63           HA       LYS  63  -2.693  11.342  -5.575
  456   1HB   LYS  63          1HB       LYS  63  -4.134  12.417  -7.625
  457   2HB   LYS  63          2HB       LYS  63  -5.407  12.171  -6.428
  458   1HG   LYS  63          1HG       LYS  63  -2.908  13.322  -5.353
  459   2HG   LYS  63          2HG       LYS  63  -3.771  14.360  -6.487
  460   1HD   LYS  63          1HD       LYS  63  -5.708  13.182  -4.758
  461   2HD   LYS  63          2HD       LYS  63  -4.408  13.820  -3.749
  462   1HE   LYS  63          1HE       LYS  63  -4.965  15.977  -4.221
  463   2HE   LYS  63          2HE       LYS  63  -5.189  15.626  -5.947
  464   1HZ   LYS  63          1HZ       LYS  63  -7.298  16.152  -4.822
  465   2HZ   LYS  63          2HZ       LYS  63  -7.072  14.819  -3.793
  466   3HZ   LYS  63          3HZ       LYS  63  -7.286  14.581  -5.461
  467    H    GLY  64           H        GLY  64  -4.911   8.873  -6.396
  468   1HA   GLY  64          1HA       GLY  64  -6.501   9.112  -3.938
  469   2HA   GLY  64          2HA       GLY  64  -6.662   7.849  -5.149
  470    H    TYR  65           H        TYR  65  -5.912   8.234  -2.042
  471    HA   TYR  65           HA       TYR  65  -3.466   6.923  -1.531
  472   1HB   TYR  65          1HB       TYR  65  -5.413   8.013  -0.066
  473   2HB   TYR  65          2HB       TYR  65  -5.937   6.337   0.069
  474    HD1  TYR  65           HD1      TYR  65  -5.500   6.465   2.519
  475    HD2  TYR  65           HD2      TYR  65  -2.365   6.961  -0.374
  476    HE1  TYR  65           HE1      TYR  65  -3.805   6.072   4.284
  477    HE2  TYR  65           HE2      TYR  65  -0.674   6.569   1.389
  478    HH   TYR  65           HH       TYR  65  -0.449   6.672   3.763
  479    H    TYR  66           H        TYR  66  -6.719   5.461  -1.664
  480    HA   TYR  66           HA       TYR  66  -6.183   2.763  -1.433
  481   1HB   TYR  66          1HB       TYR  66  -8.272   4.371  -2.107
  482   2HB   TYR  66          2HB       TYR  66  -7.983   3.564  -3.645
  483    HD1  TYR  66           HD1      TYR  66  -7.868   1.006  -3.672
  484    HD2  TYR  66           HD2      TYR  66  -9.368   3.268  -0.346
  485    HE1  TYR  66           HE1      TYR  66  -9.038  -1.012  -2.831
  486    HE2  TYR  66           HE2      TYR  66 -10.537   1.250   0.497
  487    HH   TYR  66           HH       TYR  66 -10.982  -1.536  -1.382
  488    H    HIS  67           H        HIS  67  -6.534   4.283  -4.638
  489    HA   HIS  67           HA       HIS  67  -5.683   2.320  -6.317
  490   1HB   HIS  67          1HB       HIS  67  -6.335   4.441  -7.163
  491   2HB   HIS  67          2HB       HIS  67  -5.065   5.272  -6.265
  492    HD1  HIS  67           HD1      HIS  67  -5.410   2.710  -9.053
  493    HD2  HIS  67           HD2      HIS  67  -2.708   5.574  -7.695
  494    HE1  HIS  67           HE1      HIS  67  -3.499   2.726 -10.706
  495    H    ALA  68           H        ALA  68  -3.215   4.762  -5.654
  496    HA   ALA  68           HA       ALA  68  -0.953   3.369  -6.333
  497   1HB   ALA  68          1HB       ALA  68   0.216   4.949  -4.966
  498   2HB   ALA  68          2HB       ALA  68  -1.137   5.082  -3.843
  499   3HB   ALA  68          3HB       ALA  68  -1.270   5.754  -5.469
  500    H    MET  69           H        MET  69  -2.871   2.773  -3.437
  501    HA   MET  69           HA       MET  69  -0.727   1.154  -2.206
  502   1HB   MET  69          1HB       MET  69  -3.566   1.848  -1.436
  503   2HB   MET  69          2HB       MET  69  -2.438   0.973  -0.403
  504   1HG   MET  69          1HG       MET  69  -1.214   3.367  -1.485
  505   2HG   MET  69          2HG       MET  69  -2.688   3.757  -0.598
  506   1HE   MET  69          1HE       MET  69   1.254   3.363   0.347
  507   2HE   MET  69          2HE       MET  69   0.451   4.615   1.292
  508   3HE   MET  69          3HE       MET  69   0.120   4.475  -0.433
  509    H    HIS  70           H        HIS  70  -3.883   0.590  -3.773
  510    HA   HIS  70           HA       HIS  70  -3.469  -2.330  -3.342
  511   1HB   HIS  70          1HB       HIS  70  -5.884  -0.780  -4.323
  512   2HB   HIS  70          2HB       HIS  70  -5.864  -2.456  -3.771
  513    HD1  HIS  70           HD1      HIS  70  -6.131   1.015  -2.570
  514    HD2  HIS  70           HD2      HIS  70  -5.280  -2.705  -0.900
  515    HE1  HIS  70           HE1      HIS  70  -6.354   1.291  -0.061
  516    H    ASP  71           H        ASP  71  -3.255   0.096  -5.788
  517    HA   ASP  71           HA       ASP  71  -3.815  -1.688  -8.046
  518   1HB   ASP  71          1HB       ASP  71  -2.793   1.119  -7.634
  519   2HB   ASP  71          2HB       ASP  71  -2.839   0.398  -9.241
  520    H    LYS  72           H        LYS  72  -2.207  -2.388  -9.580
  521    HA   LYS  72           HA       LYS  72   0.530  -2.669  -8.405
  522   1HB   LYS  72          1HB       LYS  72  -0.225  -4.826  -8.700
  523   2HB   LYS  72          2HB       LYS  72  -1.346  -4.361  -9.979
  524   1HG   LYS  72          1HG       LYS  72   0.391  -4.284 -11.610
  525   2HG   LYS  72          2HG       LYS  72   1.651  -4.360 -10.378
  526   1HD   LYS  72          1HD       LYS  72   0.677  -6.638  -9.730
  527   2HD   LYS  72          2HD       LYS  72  -0.248  -6.554 -11.229
  528   1HE   LYS  72          1HE       LYS  72   2.308  -5.889 -12.069
  529   2HE   LYS  72          2HE       LYS  72   2.602  -7.140 -10.845
  530   1HZ   LYS  72          1HZ       LYS  72   2.074  -8.480 -12.587
  531   2HZ   LYS  72          2HZ       LYS  72   1.106  -7.310 -13.351
  532   3HZ   LYS  72          3HZ       LYS  72   0.501  -8.186 -12.026
  533    H    GLY  73           H        GLY  73  -1.083  -2.424 -11.587
  534   1HA   GLY  73          1HA       GLY  73   1.320  -1.581 -12.956
  535   2HA   GLY  73          2HA       GLY  73  -0.319  -1.478 -13.604
  536    H    THR  74           H        THR  74   1.496   0.043 -10.920
  537    HA   THR  74           HA       THR  74   0.162   2.633 -11.570
  538    HB   THR  74           HB       THR  74   1.212   3.152  -9.260
  539    HG1  THR  74           1HG      THR  74   2.562   1.128  -9.641
  540   1HG2  THR  74          1HG2      THR  74  -0.512   1.640  -8.107
  541   2HG2  THR  74          2HG2      THR  74  -0.894   1.037  -9.721
  542   3HG2  THR  74          3HG2      THR  74  -1.127   2.743  -9.338
  543    H    LYS  75           H        LYS  75   1.548   4.600 -11.515
  544    HA   LYS  75           HA       LYS  75   3.689   4.754 -13.224
  545   1HB   LYS  75          1HB       LYS  75   2.436   6.506 -11.694
  546   2HB   LYS  75          2HB       LYS  75   3.784   6.225 -10.595
  547   1HG   LYS  75          1HG       LYS  75   4.214   8.143 -12.107
  548   2HG   LYS  75          2HG       LYS  75   5.378   6.844 -12.349
  549   1HD   LYS  75          1HD       LYS  75   3.200   6.273 -14.060
  550   2HD   LYS  75          2HD       LYS  75   3.535   7.994 -14.248
  551   1HE   LYS  75          1HE       LYS  75   5.593   5.766 -14.477
  552   2HE   LYS  75          2HE       LYS  75   4.922   6.707 -15.824
  553   1HZ   LYS  75          1HZ       LYS  75   6.681   8.035 -15.354
  554   2HZ   LYS  75          2HZ       LYS  75   6.789   7.527 -13.736
  555   3HZ   LYS  75          3HZ       LYS  75   5.617   8.668 -14.196
  556    H    PHE  76           H        PHE  76   3.805   3.792  -9.815
  557    HA   PHE  76           HA       PHE  76   6.570   2.713 -10.262
  558   1HB   PHE  76          1HB       PHE  76   5.509   4.167  -7.822
  559   2HB   PHE  76          2HB       PHE  76   7.148   3.566  -8.045
  560    HD1  PHE  76           HD1      PHE  76   8.453   4.463 -10.115
  561    HD2  PHE  76           HD2      PHE  76   4.910   6.301  -8.531
  562    HE1  PHE  76           HE1      PHE  76   9.020   6.572 -11.290
  563    HE2  PHE  76           HE2      PHE  76   5.476   8.408  -9.702
  564    HZ   PHE  76           HZ       PHE  76   7.526   8.538 -11.079
  565    H    LYS  77           H        LYS  77   7.093   1.178  -8.256
  566    HA   LYS  77           HA       LYS  77   4.976  -0.806  -8.177
  567   1HB   LYS  77          1HB       LYS  77   6.550  -1.955  -6.658
  568   2HB   LYS  77          2HB       LYS  77   7.341  -1.412  -8.135
  569   1HG   LYS  77          1HG       LYS  77   8.098   0.637  -6.892
  570   2HG   LYS  77          2HG       LYS  77   7.442  -0.077  -5.418
  571   1HD   LYS  77          1HD       LYS  77   9.893  -0.517  -5.708
  572   2HD   LYS  77          2HD       LYS  77   8.932  -1.992  -5.631
  573   1HE   LYS  77          1HE       LYS  77   9.002  -2.257  -8.037
  574   2HE   LYS  77          2HE       LYS  77   9.783  -0.676  -8.231
  575   1HZ   LYS  77          1HZ       LYS  77  11.616  -1.457  -6.853
  576   2HZ   LYS  77          2HZ       LYS  77  11.430  -2.448  -8.220
  577   3HZ   LYS  77          3HZ       LYS  77  10.880  -2.978  -6.703
  578    H    SER  78           H        SER  78   3.239  -0.456  -7.031
  579    HA   SER  78           HA       SER  78   3.056   1.364  -4.769
  580   1HB   SER  78          1HB       SER  78   0.699   0.009  -4.892
  581   2HB   SER  78          2HB       SER  78   1.104   1.356  -5.949
  582    HG   SER  78           HG       SER  78   0.520  -1.036  -6.700
  583    H    CYS  79           H        CYS  79   1.603   0.387  -2.848
  584    HA   CYS  79           HA       CYS  79   3.246  -1.404  -1.334
  585   1HB   CYS  79          1HB       CYS  79   0.302  -0.769  -0.995
  586   2HB   CYS  79          2HB       CYS  79   1.433  -1.224   0.271
  587    H    VAL  80           H        VAL  80  -0.137  -2.023  -2.307
  588    HA   VAL  80           HA       VAL  80   0.105  -4.887  -2.111
  589    HB   VAL  80           HB       VAL  80  -1.818  -3.010  -3.522
  590   1HG1  VAL  80          1HG1      VAL  80  -2.313  -4.945  -4.675
  591   2HG1  VAL  80          2HG1      VAL  80  -3.273  -5.237  -3.225
  592   3HG1  VAL  80          3HG1      VAL  80  -1.688  -5.989  -3.399
  593   1HG2  VAL  80          1HG2      VAL  80  -2.526  -4.679  -1.144
  594   2HG2  VAL  80          2HG2      VAL  80  -3.066  -3.057  -1.577
  595   3HG2  VAL  80          3HG2      VAL  80  -1.466  -3.295  -0.875
  596    H    GLY  81           H        GLY  81   0.844  -2.565  -4.610
  597   1HA   GLY  81          1HA       GLY  81   0.887  -4.464  -6.814
  598   2HA   GLY  81          2HA       GLY  81   1.569  -2.835  -6.839
  599    H    CYS  82           H        CYS  82   3.316  -3.043  -4.635
  600    HA   CYS  82           HA       CYS  82   5.533  -4.543  -5.842
  601   1HB   CYS  82          1HB       CYS  82   5.525  -2.259  -4.587
  602   2HB   CYS  82          2HB       CYS  82   5.449  -3.227  -3.118
  603    H    HIS  83           H        HIS  83   3.123  -4.971  -3.414
  604    HA   HIS  83           HA       HIS  83   4.447  -7.058  -1.893
  605   1HB   HIS  83          1HB       HIS  83   1.775  -5.737  -2.115
  606   2HB   HIS  83          2HB       HIS  83   1.850  -7.277  -1.275
  607    HD1  HIS  83           HD1      HIS  83   1.436  -6.048   1.031
  608    HD2  HIS  83           HD2      HIS  83   4.926  -4.898  -0.939
  609    HE1  HIS  83           HE1      HIS  83   2.840  -4.812   2.731
  610    H    LEU  84           H        LEU  84   1.616  -7.162  -4.135
  611    HA   LEU  84           HA       LEU  84   1.388  -9.938  -4.398
  612   1HB   LEU  84          1HB       LEU  84   0.409  -7.579  -5.548
  613   2HB   LEU  84          2HB       LEU  84   1.080  -8.485  -6.900
  614    HG   LEU  84           HG       LEU  84  -0.669  -9.834  -4.865
  615   1HD1  LEU  84          1HD1      LEU  84  -1.666  -7.689  -6.059
  616   2HD1  LEU  84          2HD1      LEU  84  -2.630  -9.158  -5.904
  617   3HD1  LEU  84          3HD1      LEU  84  -1.819  -8.791  -7.427
  618   1HD2  LEU  84          1HD2      LEU  84  -1.194 -11.013  -7.222
  619   2HD2  LEU  84          2HD2      LEU  84   0.183 -11.487  -6.229
  620   3HD2  LEU  84          3HD2      LEU  84   0.413 -10.389  -7.591
  621    H    GLU  85           H        GLU  85   3.739  -7.723  -5.811
  622    HA   GLU  85           HA       GLU  85   4.870  -9.758  -7.615
  623   1HB   GLU  85          1HB       GLU  85   4.885  -6.907  -7.247
  624   2HB   GLU  85          2HB       GLU  85   6.553  -7.481  -7.271
  625   1HG   GLU  85          1HG       GLU  85   4.606  -8.494  -9.324
  626   2HG   GLU  85          2HG       GLU  85   5.355  -6.911  -9.538
  627    H    THR  86           H        THR  86   5.938  -7.964  -4.700
  628    HA   THR  86           HA       THR  86   8.442  -9.303  -4.374
  629    HB   THR  86           HB       THR  86   6.511  -7.788  -2.628
  630    HG1  THR  86           1HG      THR  86   8.230  -6.995  -4.204
  631   1HG2  THR  86          1HG2      THR  86   8.012  -7.980  -0.727
  632   2HG2  THR  86          2HG2      THR  86   9.121  -8.985  -1.661
  633   3HG2  THR  86          3HG2      THR  86   7.526  -9.600  -1.229
  634    H    ALA  87           H        ALA  87   5.240 -10.443  -4.024
  635    HA   ALA  87           HA       ALA  87   5.795 -12.455  -1.966
  636   1HB   ALA  87          1HB       ALA  87   3.451 -13.000  -3.515
  637   2HB   ALA  87          2HB       ALA  87   3.566 -11.253  -3.305
  638   3HB   ALA  87          3HB       ALA  87   3.540 -12.310  -1.894
  639    H    GLY  88           H        GLY  88   5.566 -12.326  -5.495
  640   1HA   GLY  88          1HA       GLY  88   6.226 -13.870  -7.132
  641   2HA   GLY  88          2HA       GLY  88   7.286 -14.559  -5.904
  642    H    ALA  89           H        ALA  89   3.827 -14.496  -6.817
  643    HA   ALA  89           HA       ALA  89   2.159 -16.157  -6.429
  644   1HB   ALA  89          1HB       ALA  89   4.528 -17.162  -7.871
  645   2HB   ALA  89          2HB       ALA  89   2.830 -17.188  -8.346
  646   3HB   ALA  89          3HB       ALA  89   3.458 -18.417  -7.250
  647    H    ASP  90           H        ASP  90   2.961 -15.674  -3.975
  648    HA   ASP  90           HA       ASP  90   3.530 -18.340  -2.762
  649   1HB   ASP  90          1HB       ASP  90   5.489 -16.881  -2.718
  650   2HB   ASP  90          2HB       ASP  90   4.541 -15.586  -2.001
  651    H    ALA  91           H        ALA  91   1.234 -18.536  -2.488
  652    HA   ALA  91           HA       ALA  91  -0.701 -16.877  -1.516
  653   1HB   ALA  91          1HB       ALA  91   0.038 -19.726  -0.929
  654   2HB   ALA  91          2HB       ALA  91  -1.328 -19.101  -1.851
  655   3HB   ALA  91          3HB       ALA  91  -1.339 -19.013  -0.090
  656    H    ALA  92           H        ALA  92   2.063 -18.057   0.325
  657    HA   ALA  92           HA       ALA  92   1.094 -17.142   2.917
  658   1HB   ALA  92          1HB       ALA  92   4.003 -17.357   2.405
  659   2HB   ALA  92          2HB       ALA  92   3.076 -18.796   1.982
  660   3HB   ALA  92          3HB       ALA  92   3.022 -18.165   3.628
  661    H    LYS  93           H        LYS  93   3.405 -15.925   0.509
  662    HA   LYS  93           HA       LYS  93   3.846 -13.400   1.889
  663   1HB   LYS  93          1HB       LYS  93   4.616 -14.810  -0.609
  664   2HB   LYS  93          2HB       LYS  93   4.716 -13.054  -0.662
  665   1HG   LYS  93          1HG       LYS  93   6.195 -13.015   1.244
  666   2HG   LYS  93          2HG       LYS  93   5.935 -14.737   1.536
  667   1HD   LYS  93          1HD       LYS  93   6.838 -15.025  -0.904
  668   2HD   LYS  93          2HD       LYS  93   7.511 -13.413  -0.657
  669   1HE   LYS  93          1HE       LYS  93   8.971 -14.130   1.015
  670   2HE   LYS  93          2HE       LYS  93   7.946 -15.510   1.456
  671   1HZ   LYS  93          1HZ       LYS  93   8.656 -16.734  -0.311
  672   2HZ   LYS  93          2HZ       LYS  93  10.065 -15.821  -0.055
  673   3HZ   LYS  93          3HZ       LYS  93   8.975 -15.379  -1.280
  674    H    LYS  94           H        LYS  94   1.599 -14.650  -0.491
  675    HA   LYS  94           HA       LYS  94   0.701 -12.073  -1.501
  676   1HB   LYS  94          1HB       LYS  94   0.136 -14.934  -1.784
  677   2HB   LYS  94          2HB       LYS  94  -1.326 -13.949  -1.867
  678   1HG   LYS  94          1HG       LYS  94   0.381 -12.476  -3.412
  679   2HG   LYS  94          2HG       LYS  94   0.945 -14.113  -3.753
  680   1HD   LYS  94          1HD       LYS  94  -1.907 -14.167  -3.752
  681   2HD   LYS  94          2HD       LYS  94  -1.398 -12.807  -4.752
  682   1HE   LYS  94          1HE       LYS  94  -1.277 -14.505  -6.336
  683   2HE   LYS  94          2HE       LYS  94   0.354 -14.645  -5.651
  684   1HZ   LYS  94          1HZ       LYS  94  -0.421 -16.776  -5.372
  685   2HZ   LYS  94          2HZ       LYS  94  -2.028 -16.285  -5.119
  686   3HZ   LYS  94          3HZ       LYS  94  -0.873 -16.088  -3.888
  687    H    LYS  95           H        LYS  95  -0.136 -14.152   1.207
  688    HA   LYS  95           HA       LYS  95  -2.604 -12.686   1.854
  689   1HB   LYS  95          1HB       LYS  95  -2.834 -14.364   3.502
  690   2HB   LYS  95          2HB       LYS  95  -1.945 -15.189   2.221
  691   1HG   LYS  95          1HG       LYS  95  -0.467 -15.720   3.859
  692   2HG   LYS  95          2HG       LYS  95   0.092 -14.057   3.676
  693   1HD   LYS  95          1HD       LYS  95  -1.756 -13.440   5.365
  694   2HD   LYS  95          2HD       LYS  95  -1.833 -15.167   5.718
  695   1HE   LYS  95          1HE       LYS  95   0.902 -14.623   5.759
  696   2HE   LYS  95          2HE       LYS  95   0.173 -13.213   6.554
  697   1HZ   LYS  95          1HZ       LYS  95   0.064 -16.034   7.319
  698   2HZ   LYS  95          2HZ       LYS  95  -1.325 -15.098   7.595
  699   3HZ   LYS  95          3HZ       LYS  95   0.156 -14.653   8.299
  700    H    GLU  96           H        GLU  96   0.783 -12.534   2.609
  701    HA   GLU  96           HA       GLU  96   0.374 -10.805   4.986
  702   1HB   GLU  96          1HB       GLU  96   2.763 -11.127   5.231
  703   2HB   GLU  96          2HB       GLU  96   2.065 -12.677   4.796
  704   1HG   GLU  96          1HG       GLU  96   2.718 -12.355   2.486
  705   2HG   GLU  96          2HG       GLU  96   3.327 -10.742   2.855
  706    H    LEU  97           H        LEU  97   1.831 -10.699   1.766
  707    HA   LEU  97           HA       LEU  97   2.464  -7.851   1.893
  708   1HB   LEU  97          1HB       LEU  97   2.348  -9.826  -0.397
  709   2HB   LEU  97          2HB       LEU  97   3.177  -8.268  -0.416
  710    HG   LEU  97           HG       LEU  97   3.855 -10.724   1.199
  711   1HD1  LEU  97          1HD1      LEU  97   6.163  -9.732   0.235
  712   2HD1  LEU  97          2HD1      LEU  97   5.048  -9.111  -0.983
  713   3HD1  LEU  97          3HD1      LEU  97   5.144 -10.845  -0.678
  714   1HD2  LEU  97          1HD2      LEU  97   5.591  -9.219   2.294
  715   2HD2  LEU  97          2HD2      LEU  97   3.929  -8.938   2.814
  716   3HD2  LEU  97          3HD2      LEU  97   4.687  -7.845   1.655
  717    H    THR  98           H        THR  98   0.327  -9.649  -0.348
  718    HA   THR  98           HA       THR  98  -1.195  -7.164  -0.836
  719    HB   THR  98           HB       THR  98  -2.328  -8.698  -2.509
  720    HG1  THR  98           1HG      THR  98  -1.932 -10.639  -1.420
  721   1HG2  THR  98          1HG2      THR  98  -0.674  -8.195  -3.986
  722   2HG2  THR  98          2HG2      THR  98   0.548  -9.057  -3.050
  723   3HG2  THR  98          3HG2      THR  98   0.092  -7.412  -2.606
  724    H    GLY  99           H        GLY  99  -1.534 -10.110   0.987
  725   1HA   GLY  99          1HA       GLY  99  -4.281 -10.455   1.177
  726   2HA   GLY  99          2HA       GLY  99  -3.200 -10.657   2.560
  727    H    CYS 100           H        CYS 100  -5.916  -9.128   1.790
  728    HA   CYS 100           HA       CYS 100  -5.325  -6.432   2.734
  729   1HB   CYS 100          1HB       CYS 100  -8.085  -7.401   2.937
  730   2HB   CYS 100          2HB       CYS 100  -7.464  -6.020   2.074
  731    H    LYS 101           H        LYS 101  -7.458  -8.953   4.061
  732    HA   LYS 101           HA       LYS 101  -6.969  -7.826   6.766
  733   1HB   LYS 101          1HB       LYS 101  -8.926  -9.928   5.775
  734   2HB   LYS 101          2HB       LYS 101  -8.969  -9.126   7.346
  735   1HG   LYS 101          1HG       LYS 101  -9.632  -7.081   6.435
  736   2HG   LYS 101          2HG       LYS 101  -8.996  -7.474   4.837
  737   1HD   LYS 101          1HD       LYS 101 -10.995  -8.284   4.204
  738   2HD   LYS 101          2HD       LYS 101 -10.992  -9.414   5.558
  739   1HE   LYS 101          1HE       LYS 101 -11.812  -7.535   7.036
  740   2HE   LYS 101          2HE       LYS 101 -12.004  -6.551   5.571
  741   1HZ   LYS 101          1HZ       LYS 101 -13.251  -9.197   6.098
  742   2HZ   LYS 101          2HZ       LYS 101 -13.345  -8.364   4.620
  743   3HZ   LYS 101          3HZ       LYS 101 -14.055  -7.706   6.016
  744    H    GLY 102           H        GLY 102  -5.398  -8.800   7.982
  745   1HA   GLY 102          1HA       GLY 102  -4.612 -10.790   9.167
  746   2HA   GLY 102          2HA       GLY 102  -5.088 -11.758   7.773
  747    H    SER 103           H        SER 103  -3.774  -9.201   6.317
  748    HA   SER 103           HA       SER 103  -1.233 -10.571   5.818
  749   1HB   SER 103          1HB       SER 103  -0.986  -8.756   4.178
  750   2HB   SER 103          2HB       SER 103  -2.600  -9.442   4.075
  751    HG   SER 103           HG       SER 103  -2.525  -7.108   4.151
  752    H    LYS 104           H        LYS 104   0.324  -8.202   5.389
  753    HA   LYS 104           HA       LYS 104   1.094  -7.561   8.195
  754   1HB   LYS 104          1HB       LYS 104   2.481  -7.105   5.538
  755   2HB   LYS 104          2HB       LYS 104   3.217  -7.021   7.137
  756   1HG   LYS 104          1HG       LYS 104   1.837  -9.562   6.607
  757   2HG   LYS 104          2HG       LYS 104   3.211  -9.262   5.542
  758   1HD   LYS 104          1HD       LYS 104   4.633  -8.816   7.524
  759   2HD   LYS 104          2HD       LYS 104   3.259  -9.169   8.574
  760   1HE   LYS 104          1HE       LYS 104   3.130 -11.462   7.573
  761   2HE   LYS 104          2HE       LYS 104   4.603 -11.100   6.652
  762   1HZ   LYS 104          1HZ       LYS 104   5.406 -12.038   8.612
  763   2HZ   LYS 104          2HZ       LYS 104   4.254 -11.253   9.584
  764   3HZ   LYS 104          3HZ       LYS 104   5.537 -10.372   8.901
  765    H    CYS 105           H        CYS 105  -0.127  -6.238   5.234
  766    HA   CYS 105           HA       CYS 105   0.443  -3.443   5.824
  767   1HB   CYS 105          1HB       CYS 105  -0.032  -4.916   3.622
  768   2HB   CYS 105          2HB       CYS 105  -1.658  -4.340   3.915
  769    H    HIS 106           H        HIS 106  -2.154  -5.693   6.525
  770    HA   HIS 106           HA       HIS 106  -3.747  -3.428   7.694
  771   1HB   HIS 106          1HB       HIS 106  -4.426  -5.797   6.014
  772   2HB   HIS 106          2HB       HIS 106  -5.611  -5.301   7.222
  773    HD1  HIS 106           HD1      HIS 106  -5.087  -2.233   7.073
  774    HD2  HIS 106           HD2      HIS 106  -5.686  -4.684   3.737
  775    HE1  HIS 106           HE1      HIS 106  -5.770  -0.702   5.181
  776    H    SER 107           H        SER 107  -2.329  -4.006   9.647
  777    HA   SER 107           HA       SER 107  -3.131  -6.543  10.989
  778   1HB   SER 107          1HB       SER 107  -0.786  -6.184  10.961
  779   2HB   SER 107          2HB       SER 107  -0.962  -4.471  11.333
  780    HG   SER 107           HG       SER 107  -0.336  -5.649  13.172
  781    HHA  HEC 201           HHA      HEC 201   6.035   8.581   5.548
  782    HHB  HEC 201           HHB      HEC 201  12.156   9.876   4.798
  783    HHC  HEC 201           HHC      HEC 201  12.732   4.760   1.045
  784    HHD  HEC 201           HHD      HEC 201   6.664   3.562   1.785
  785   1HMA  HEC 201          1HMA      HEC 201  11.280  10.613   7.073
  786   2HMA  HEC 201          2HMA      HEC 201   9.735  10.746   7.919
  787   3HMA  HEC 201          3HMA      HEC 201  10.155  11.906   6.656
  788   1HAA  HEC 201          1HAA      HEC 201   6.526   9.605   7.194
  789   2HAA  HEC 201          2HAA      HEC 201   7.768  10.683   7.825
  790   1HBA  HEC 201          1HBA      HEC 201   6.747  11.475   5.190
  791   2HBA  HEC 201          2HBA      HEC 201   5.524  11.495   6.461
  792   1HMB  HEC 201          1HMB      HEC 201  14.168   9.604   4.563
  793   2HMB  HEC 201          2HMB      HEC 201  15.370   8.402   4.095
  794   3HMB  HEC 201          3HMB      HEC 201  14.816   9.598   2.923
  795    HAB  HEC 201           HAB      HEC 201  14.570   5.733   1.097
  796   1HBB  HEC 201          1HBB      HEC 201  16.808   5.865   2.355
  797   2HBB  HEC 201          2HBB      HEC 201  15.531   4.913   3.113
  798   3HBB  HEC 201          3HBB      HEC 201  15.883   6.540   3.696
  799   1HMC  HEC 201          1HMC      HEC 201  12.434   3.206  -0.099
  800   2HMC  HEC 201          2HMC      HEC 201  11.694   1.720   0.497
  801   3HMC  HEC 201          3HMC      HEC 201  11.110   2.458  -0.995
  802    HAC  HEC 201           HAC      HEC 201   7.376   2.186   0.577
  803   1HBC  HEC 201          1HBC      HEC 201  10.003   0.802  -0.026
  804   2HBC  HEC 201          2HBC      HEC 201   8.411   0.102  -0.325
  805   3HBC  HEC 201          3HBC      HEC 201   8.922   0.458   1.324
  806   1HMD  HEC 201          1HMD      HEC 201   4.264   3.669   4.117
  807   2HMD  HEC 201          2HMD      HEC 201   3.582   4.581   2.770
  808   3HMD  HEC 201          3HMD      HEC 201   4.918   3.464   2.493
  809   1HAD  HEC 201          1HAD      HEC 201   4.357   7.672   5.597
  810   2HAD  HEC 201          2HAD      HEC 201   3.345   7.200   4.238
  811   1HBD  HEC 201          1HBD      HEC 201   4.264   5.084   6.149
  812   2HBD  HEC 201          2HBD      HEC 201   2.951   6.155   6.636
  813    HHA  HEC 202           HHA      HEC 202   1.548   7.650  -9.468
  814    HHB  HEC 202           HHB      HEC 202   2.838   4.057  -4.830
  815    HHC  HEC 202           HHC      HEC 202   4.568   8.874  -1.212
  816    HHD  HEC 202           HHD      HEC 202   2.789  12.861  -5.686
  817   1HMA  HEC 202          1HMA      HEC 202   2.099   2.792  -7.210
  818   2HMA  HEC 202          2HMA      HEC 202   0.420   3.215  -7.548
  819   3HMA  HEC 202          3HMA      HEC 202   1.001   3.180  -5.884
  820   1HAA  HEC 202          1HAA      HEC 202   1.071   5.208  -9.997
  821   2HAA  HEC 202          2HAA      HEC 202  -0.039   4.389  -8.941
  822   1HBA  HEC 202          1HBA      HEC 202  -1.403   6.339  -8.711
  823   2HBA  HEC 202          2HBA      HEC 202  -0.211   7.342  -9.529
  824   1HMB  HEC 202          1HMB      HEC 202   2.902   3.550  -1.952
  825   2HMB  HEC 202          2HMB      HEC 202   4.035   3.225  -3.265
  826   3HMB  HEC 202          3HMB      HEC 202   4.641   3.627  -1.657
  827    HAB  HEC 202           HAB      HEC 202   4.174   6.790   0.121
  828   1HBB  HEC 202          1HBB      HEC 202   6.416   6.812   0.359
  829   2HBB  HEC 202          2HBB      HEC 202   6.597   6.282  -1.315
  830   3HBB  HEC 202          3HBB      HEC 202   6.462   5.090  -0.023
  831   1HMC  HEC 202          1HMC      HEC 202   5.587  12.492  -1.382
  832   2HMC  HEC 202          2HMC      HEC 202   4.116  12.055  -0.511
  833   3HMC  HEC 202          3HMC      HEC 202   5.383  10.853  -0.762
  834    HAC  HEC 202           HAC      HEC 202   2.362  13.751  -3.451
  835   1HBC  HEC 202          1HBC      HEC 202   3.628  15.330  -2.229
  836   2HBC  HEC 202          2HBC      HEC 202   5.136  14.455  -2.493
  837   3HBC  HEC 202          3HBC      HEC 202   3.927  13.812  -1.382
  838   1HMD  HEC 202          1HMD      HEC 202   1.136  13.381  -8.219
  839   2HMD  HEC 202          2HMD      HEC 202   2.013  12.957  -9.689
  840   3HMD  HEC 202          3HMD      HEC 202   2.896  13.487  -8.256
  841   1HAD  HEC 202          1HAD      HEC 202   1.911   9.243 -10.708
  842   2HAD  HEC 202          2HAD      HEC 202   1.205  10.846 -10.859
  843   1HBD  HEC 202          1HBD      HEC 202   3.662  11.659 -10.403
  844   2HBD  HEC 202          2HBD      HEC 202   4.087  10.032 -10.931
  845    HHA  HEC 203           HHA      HEC 203   7.184  -6.876   4.544
  846    HHB  HEC 203           HHB      HEC 203   2.812  -2.087   4.885
  847    HHC  HEC 203           HHC      HEC 203   4.657   0.043  -0.485
  848    HHD  HEC 203           HHD      HEC 203   9.057  -4.432  -0.959
  849   1HMA  HEC 203          1HMA      HEC 203   2.328  -3.950   6.548
  850   2HMA  HEC 203          2HMA      HEC 203   3.632  -3.475   7.635
  851   3HMA  HEC 203          3HMA      HEC 203   3.197  -5.176   7.473
  852   1HAA  HEC 203          1HAA      HEC 203   4.908  -6.143   7.667
  853   2HAA  HEC 203          2HAA      HEC 203   4.892  -7.351   6.392
  854   1HBA  HEC 203          1HBA      HEC 203   7.200  -7.493   6.305
  855   2HBA  HEC 203          2HBA      HEC 203   7.427  -5.836   6.866
  856   1HMB  HEC 203          1HMB      HEC 203   2.258  -0.111   5.040
  857   2HMB  HEC 203          2HMB      HEC 203   1.902   1.147   3.857
  858   3HMB  HEC 203          3HMB      HEC 203   1.016  -0.377   3.817
  859    HAB  HEC 203           HAB      HEC 203   3.034   1.049   0.115
  860   1HBB  HEC 203          1HBB      HEC 203   2.048   2.937   1.963
  861   2HBB  HEC 203          2HBB      HEC 203   3.571   3.029   1.075
  862   3HBB  HEC 203          3HBB      HEC 203   3.526   2.293   2.681
  863   1HMC  HEC 203          1HMC      HEC 203   5.995  -0.735  -3.517
  864   2HMC  HEC 203          2HMC      HEC 203   5.642   0.392  -2.207
  865   3HMC  HEC 203          3HMC      HEC 203   7.289   0.239  -2.818
  866    HAC  HEC 203           HAC      HEC 203   9.241  -3.322  -2.578
  867   1HBC  HEC 203          1HBC      HEC 203   9.887  -1.562  -3.989
  868   2HBC  HEC 203          2HBC      HEC 203   9.181  -0.692  -2.627
  869   3HBC  HEC 203          3HBC      HEC 203   8.247  -0.925  -4.103
  870   1HMD  HEC 203          1HMD      HEC 203  10.385  -5.940  -0.465
  871   2HMD  HEC 203          2HMD      HEC 203  10.038  -7.606  -0.002
  872   3HMD  HEC 203          3HMD      HEC 203  11.113  -6.621   0.990
  873   1HAD  HEC 203          1HAD      HEC 203  10.308  -7.813   2.957
  874   2HAD  HEC 203          2HAD      HEC 203   9.049  -7.683   4.177
  875   1HBD  HEC 203          1HBD      HEC 203   8.080  -8.984   1.752
  876   2HBD  HEC 203          2HBD      HEC 203   9.453  -9.837   2.460
  877    HHA  HEC 204           HHA      HEC 204  -6.989   2.287   3.948
  878    HHB  HEC 204           HHB      HEC 204 -10.131  -2.404   1.127
  879    HHC  HEC 204           HHC      HEC 204  -4.810  -5.777   0.903
  880    HHD  HEC 204           HHD      HEC 204  -1.564  -0.714   2.560
  881   1HMA  HEC 204          1HMA      HEC 204 -11.603   0.889   1.918
  882   2HMA  HEC 204          2HMA      HEC 204 -11.787  -0.387   3.124
  883   3HMA  HEC 204          3HMA      HEC 204 -11.492  -0.805   1.436
  884   1HAA  HEC 204          1HAA      HEC 204 -10.267   1.969   4.523
  885   2HAA  HEC 204          2HAA      HEC 204  -8.770   2.784   4.088
  886   1HBA  HEC 204          1HBA      HEC 204  -9.807   3.052   1.743
  887   2HBA  HEC 204          2HBA      HEC 204 -11.329   2.615   2.513
  888   1HMB  HEC 204          1HMB      HEC 204  -9.699  -4.889  -1.418
  889   2HMB  HEC 204          2HMB      HEC 204 -10.524  -3.963  -0.165
  890   3HMB  HEC 204          3HMB      HEC 204 -10.147  -5.665   0.100
  891    HAB  HEC 204           HAB      HEC 204  -6.304  -6.914   0.320
  892   1HBB  HEC 204          1HBB      HEC 204  -5.744  -6.298  -1.892
  893   2HBB  HEC 204          2HBB      HEC 204  -7.415  -5.895  -2.293
  894   3HBB  HEC 204          3HBB      HEC 204  -6.939  -7.581  -2.084
  895   1HMC  HEC 204          1HMC      HEC 204  -2.698  -6.264   0.989
  896   2HMC  HEC 204          2HMC      HEC 204  -1.206  -5.524   0.408
  897   3HMC  HEC 204          3HMC      HEC 204  -1.437  -5.806   2.134
  898    HAC  HEC 204           HAC      HEC 204  -0.217  -2.145   2.554
  899   1HBC  HEC 204          1HBC      HEC 204   0.786  -3.492   0.121
  900   2HBC  HEC 204          2HBC      HEC 204   0.197  -4.597   1.366
  901   3HBC  HEC 204          3HBC      HEC 204   1.479  -3.445   1.743
  902   1HMD  HEC 204          1HMD      HEC 204  -1.771   3.002   3.306
  903   2HMD  HEC 204          2HMD      HEC 204  -1.518   1.823   4.592
  904   3HMD  HEC 204          3HMD      HEC 204  -1.089   1.420   2.931
  905   1HAD  HEC 204          1HAD      HEC 204  -4.001   4.098   3.671
  906   2HAD  HEC 204          2HAD      HEC 204  -5.594   3.618   4.243
  907   1HBD  HEC 204          1HBD      HEC 204  -4.238   2.438   6.158
  908   2HBD  HEC 204          2HBD      HEC 204  -2.977   3.575   5.692
  Start of MODEL   17
    1   1H    ALA   1          1H        ALA   1  20.869  14.537   3.911
    2   2H    ALA   1          2H        ALA   1  20.141  15.438   2.668
    3   3H    ALA   1          3H        ALA   1  21.545  14.534   2.356
    4    HA   ALA   1           HA       ALA   1  19.472  13.466   1.512
    5   1HB   ALA   1          1HB       ALA   1  21.698  12.401   2.217
    6   2HB   ALA   1          2HB       ALA   1  20.302  11.324   2.183
    7   3HB   ALA   1          3HB       ALA   1  20.890  11.957   3.720
    8    HA   PRO   2           HA       PRO   2  16.047  13.308   4.259
    9   1HB   PRO   2          1HB       PRO   2  14.780  11.046   3.389
   10   2HB   PRO   2          2HB       PRO   2  14.781  12.562   2.474
   11   1HG   PRO   2          1HG       PRO   2  16.406  10.107   2.072
   12   2HG   PRO   2          2HG       PRO   2  15.703  11.205   0.873
   13   1HD   PRO   2          1HD       PRO   2  18.345  11.221   1.593
   14   2HD   PRO   2          2HD       PRO   2  17.482  12.636   0.952
   15    H    LYS   3           H        LYS   3  15.720  12.509   6.325
   16    HA   LYS   3           HA       LYS   3  17.315  10.128   7.134
   17   1HB   LYS   3          1HB       LYS   3  15.773  12.161   8.756
   18   2HB   LYS   3          2HB       LYS   3  16.930  10.985   9.372
   19   1HG   LYS   3          1HG       LYS   3  18.584  12.102   7.679
   20   2HG   LYS   3          2HG       LYS   3  17.446  13.449   7.727
   21   1HD   LYS   3          1HD       LYS   3  17.626  13.328  10.274
   22   2HD   LYS   3          2HD       LYS   3  19.004  12.256  10.027
   23   1HE   LYS   3          1HE       LYS   3  19.920  14.121   8.465
   24   2HE   LYS   3          2HE       LYS   3  18.735  15.167   9.271
   25   1HZ   LYS   3          1HZ       LYS   3  19.608  14.460  11.410
   26   2HZ   LYS   3          2HZ       LYS   3  20.844  15.152  10.472
   27   3HZ   LYS   3          3HZ       LYS   3  20.749  13.465  10.644
   28    H    ALA   4           H        ALA   4  15.857   8.571   6.213
   29    HA   ALA   4           HA       ALA   4  13.137   8.238   6.385
   30   1HB   ALA   4          1HB       ALA   4  14.777   5.923   7.295
   31   2HB   ALA   4          2HB       ALA   4  15.251   6.668   5.769
   32   3HB   ALA   4          3HB       ALA   4  13.621   6.023   5.966
   33    HA   PRO   5           HA       PRO   5  12.297   8.381  10.704
   34   1HB   PRO   5          1HB       PRO   5   9.669   7.614  10.581
   35   2HB   PRO   5          2HB       PRO   5  10.242   9.235  10.151
   36   1HG   PRO   5          1HG       PRO   5   9.369   7.026   8.402
   37   2HG   PRO   5          2HG       PRO   5   9.344   8.769   8.128
   38   1HD   PRO   5          1HD       PRO   5  11.205   6.954   7.076
   39   2HD   PRO   5          2HD       PRO   5  11.334   8.723   7.066
   40    H    ALA   6           H        ALA   6  11.625   6.908  12.458
   41    HA   ALA   6           HA       ALA   6  12.786   4.336  12.301
   42   1HB   ALA   6          1HB       ALA   6  12.292   5.788  14.319
   43   2HB   ALA   6          2HB       ALA   6  11.862   4.089  14.520
   44   3HB   ALA   6          3HB       ALA   6  10.607   5.283  14.183
   45    H    ASP   7           H        ASP   7  11.675   2.266  12.519
   46    HA   ASP   7           HA       ASP   7   9.613   1.844  10.550
   47   1HB   ASP   7          1HB       ASP   7  10.478  -0.020  12.770
   48   2HB   ASP   7          2HB       ASP   7   9.932  -0.444  11.150
   49    H    GLY   8           H        GLY   8   7.506   0.851  11.090
   50   1HA   GLY   8          1HA       GLY   8   5.666   0.429  12.587
   51   2HA   GLY   8          2HA       GLY   8   6.484   1.394  13.815
   52    H    LEU   9           H        LEU   9   6.466   2.795  10.684
   53    HA   LEU   9           HA       LEU   9   5.007   5.114  11.521
   54   1HB   LEU   9          1HB       LEU   9   6.540   4.292   9.353
   55   2HB   LEU   9          2HB       LEU   9   4.935   4.516   8.654
   56    HG   LEU   9           HG       LEU   9   5.858   6.614  10.542
   57   1HD1  LEU   9          1HD1      LEU   9   7.036   7.706   8.511
   58   2HD1  LEU   9          2HD1      LEU   9   7.095   6.074   7.841
   59   3HD1  LEU   9          3HD1      LEU   9   7.908   6.432   9.365
   60   1HD2  LEU   9          1HD2      LEU   9   4.850   7.998   8.594
   61   2HD2  LEU   9          2HD2      LEU   9   3.742   7.002   9.548
   62   3HD2  LEU   9          3HD2      LEU   9   4.291   6.447   7.967
   63    H    LYS  10           H        LYS  10   2.839   5.225  11.886
   64    HA   LYS  10           HA       LYS  10   1.104   3.121  10.699
   65   1HB   LYS  10          1HB       LYS  10   1.229   4.687  13.136
   66   2HB   LYS  10          2HB       LYS  10  -0.374   4.769  12.405
   67   1HG   LYS  10          1HG       LYS  10   0.111   2.131  12.101
   68   2HG   LYS  10          2HG       LYS  10   1.056   2.435  13.559
   69   1HD   LYS  10          1HD       LYS  10  -0.980   3.578  14.532
   70   2HD   LYS  10          2HD       LYS  10  -1.890   2.993  13.138
   71   1HE   LYS  10          1HE       LYS  10  -1.819   0.789  13.845
   72   2HE   LYS  10          2HE       LYS  10  -0.266   1.000  14.679
   73   1HZ   LYS  10          1HZ       LYS  10  -1.269   2.134  16.431
   74   2HZ   LYS  10          2HZ       LYS  10  -2.363   0.874  16.113
   75   3HZ   LYS  10          3HZ       LYS  10  -2.688   2.446  15.557
   76    H    MET  11           H        MET  11   0.148   3.624   8.822
   77    HA   MET  11           HA       MET  11  -0.386   6.448   8.085
   78   1HB   MET  11          1HB       MET  11  -1.177   5.168   5.945
   79   2HB   MET  11          2HB       MET  11   0.546   5.189   6.310
   80   1HG   MET  11          1HG       MET  11  -0.925   2.986   7.588
   81   2HG   MET  11          2HG       MET  11  -0.923   2.925   5.828
   82   1HE   MET  11          1HE       MET  11   1.519   3.989   4.696
   83   2HE   MET  11          2HE       MET  11   0.923   2.363   4.374
   84   3HE   MET  11          3HE       MET  11   2.630   2.612   4.729
   85    H    ASP  12           H        ASP  12  -2.185   7.070   9.301
   86    HA   ASP  12           HA       ASP  12  -4.577   5.270   9.243
   87   1HB   ASP  12          1HB       ASP  12  -5.271   6.970  11.074
   88   2HB   ASP  12          2HB       ASP  12  -3.971   5.843  11.442
   89    H    LYS  13           H        LYS  13  -3.531   7.348   7.172
   90    HA   LYS  13           HA       LYS  13  -5.177   9.592   6.947
   91   1HB   LYS  13          1HB       LYS  13  -4.010   7.611   5.001
   92   2HB   LYS  13          2HB       LYS  13  -4.904   9.017   4.430
   93   1HG   LYS  13          1HG       LYS  13  -2.533   9.132   6.318
   94   2HG   LYS  13          2HG       LYS  13  -2.443   9.436   4.584
   95   1HD   LYS  13          1HD       LYS  13  -4.189  11.240   4.903
   96   2HD   LYS  13          2HD       LYS  13  -3.995  11.021   6.642
   97   1HE   LYS  13          1HE       LYS  13  -1.892  11.982   6.667
   98   2HE   LYS  13          2HE       LYS  13  -1.513  11.434   5.021
   99   1HZ   LYS  13          1HZ       LYS  13  -1.955  13.782   4.968
  100   2HZ   LYS  13          2HZ       LYS  13  -3.431  13.574   5.783
  101   3HZ   LYS  13          3HZ       LYS  13  -3.237  12.976   4.204
  102    H    THR  14           H        THR  14  -5.977   6.211   6.404
  103    HA   THR  14           HA       THR  14  -8.778   7.014   5.667
  104    HB   THR  14           HB       THR  14  -8.786   4.647   4.691
  105    HG1  THR  14           1HG      THR  14  -7.105   3.537   5.220
  106   1HG2  THR  14          1HG2      THR  14  -6.918   6.789   3.661
  107   2HG2  THR  14          2HG2      THR  14  -8.598   6.511   3.199
  108   3HG2  THR  14          3HG2      THR  14  -7.350   5.357   2.725
  109    H    LYS  15           H        LYS  15 -10.365   5.141   6.321
  110    HA   LYS  15           HA       LYS  15 -10.450   4.929   9.164
  111   1HB   LYS  15          1HB       LYS  15 -11.881   3.909   6.785
  112   2HB   LYS  15          2HB       LYS  15 -12.047   2.906   8.227
  113   1HG   LYS  15          1HG       LYS  15 -13.492   4.379   9.120
  114   2HG   LYS  15          2HG       LYS  15 -12.297   5.668   8.978
  115   1HD   LYS  15          1HD       LYS  15 -13.438   6.584   7.270
  116   2HD   LYS  15          2HD       LYS  15 -13.352   5.069   6.370
  117   1HE   LYS  15          1HE       LYS  15 -15.610   4.959   6.643
  118   2HE   LYS  15          2HE       LYS  15 -15.271   4.563   8.339
  119   1HZ   LYS  15          1HZ       LYS  15 -16.698   6.591   7.963
  120   2HZ   LYS  15          2HZ       LYS  15 -15.317   7.348   7.325
  121   3HZ   LYS  15          3HZ       LYS  15 -15.332   6.825   8.941
  122    H    GLN  16           H        GLN  16  -8.881   2.981   6.735
  123    HA   GLN  16           HA       GLN  16  -8.332   0.820   8.724
  124   1HB   GLN  16          1HB       GLN  16  -8.315   1.095   5.724
  125   2HB   GLN  16          2HB       GLN  16  -7.425  -0.221   6.491
  126   1HG   GLN  16          1HG       GLN  16  -9.330  -1.377   6.782
  127   2HG   GLN  16          2HG       GLN  16 -10.024  -0.038   7.697
  128   1HE2  GLN  16          2HE2      GLN  16 -10.219  -1.766   4.727
  129   2HE2  GLN  16          1HE2      GLN  16 -11.277  -0.712   3.923
  130    HA   PRO  17           HA       PRO  17  -4.505   3.407   8.659
  131   1HB   PRO  17          1HB       PRO  17  -3.919   2.976  11.305
  132   2HB   PRO  17          2HB       PRO  17  -4.987   4.277  10.741
  133   1HG   PRO  17          1HG       PRO  17  -5.694   1.599  11.850
  134   2HG   PRO  17          2HG       PRO  17  -6.430   3.178  12.168
  135   1HD   PRO  17          1HD       PRO  17  -7.553   1.385  10.495
  136   2HD   PRO  17          2HD       PRO  17  -7.678   3.140  10.227
  137    H    VAL  18           H        VAL  18  -2.509   2.546   8.235
  138    HA   VAL  18           HA       VAL  18  -2.019  -0.315   8.977
  139    HB   VAL  18           HB       VAL  18  -1.501   1.331   6.494
  140   1HG1  VAL  18          1HG1      VAL  18   0.563   0.096   7.110
  141   2HG1  VAL  18          2HG1      VAL  18  -0.166  -0.525   5.631
  142   3HG1  VAL  18          3HG1      VAL  18  -0.366  -1.402   7.148
  143   1HG2  VAL  18          1HG2      VAL  18  -3.487   0.288   6.060
  144   2HG2  VAL  18          2HG2      VAL  18  -3.232  -0.931   7.310
  145   3HG2  VAL  18          3HG2      VAL  18  -2.464  -1.110   5.733
  146    H    VAL  19           H        VAL  19   0.337  -0.823   9.170
  147    HA   VAL  19           HA       VAL  19   1.887   1.530  10.192
  148    HB   VAL  19           HB       VAL  19   1.934  -1.429  10.871
  149   1HG1  VAL  19          1HG1      VAL  19   4.101  -0.888  11.403
  150   2HG1  VAL  19          2HG1      VAL  19   3.330  -0.246  12.854
  151   3HG1  VAL  19          3HG1      VAL  19   3.749   0.835  11.526
  152   1HG2  VAL  19          1HG2      VAL  19   0.069   0.338  11.648
  153   2HG2  VAL  19          2HG2      VAL  19   1.308   0.720  12.844
  154   3HG2  VAL  19          3HG2      VAL  19   0.670  -0.919  12.730
  155    H    PHE  20           H        PHE  20   3.566   2.081   8.809
  156    HA   PHE  20           HA       PHE  20   4.625  -0.005   6.960
  157   1HB   PHE  20          1HB       PHE  20   3.847   2.167   6.049
  158   2HB   PHE  20          2HB       PHE  20   5.020   3.007   7.062
  159    HD1  PHE  20           HD1      PHE  20   4.987   0.057   4.739
  160    HD2  PHE  20           HD2      PHE  20   7.007   3.624   6.009
  161    HE1  PHE  20           HE1      PHE  20   6.754  -0.333   3.043
  162    HE2  PHE  20           HE2      PHE  20   8.766   3.234   4.312
  163    HZ   PHE  20           HZ       PHE  20   8.642   1.256   2.830
  164    H    ASN  21           H        ASN  21   6.503  -1.003   7.540
  165    HA   ASN  21           HA       ASN  21   8.253   0.272   9.575
  166   1HB   ASN  21          1HB       ASN  21   7.304  -2.354   8.884
  167   2HB   ASN  21          2HB       ASN  21   9.060  -2.335   8.801
  168   1HD2  ASN  21          2HD2      ASN  21   6.595  -0.858  10.993
  169   2HD2  ASN  21          1HD2      ASN  21   7.374  -1.334  12.424
  170    H    HIS  22           H        HIS  22   9.470   1.754   8.271
  171    HA   HIS  22           HA       HIS  22  10.474   1.408   5.688
  172   1HB   HIS  22          1HB       HIS  22  11.405   2.788   8.185
  173   2HB   HIS  22          2HB       HIS  22  12.468   2.779   6.780
  174    HD1  HIS  22           HD1      HIS  22   9.632   4.543   8.208
  175    HD2  HIS  22           HD2      HIS  22  11.042   3.859   4.341
  176    HE1  HIS  22           HE1      HIS  22   8.587   6.320   6.741
  177    H    SER  23           H        SER  23  11.595  -0.049   8.699
  178    HA   SER  23           HA       SER  23  14.161  -0.962   7.966
  179   1HB   SER  23          1HB       SER  23  13.270  -2.969   9.504
  180   2HB   SER  23          2HB       SER  23  13.589  -1.372  10.173
  181    HG   SER  23           HG       SER  23  11.108  -2.443   9.304
  182    H    THR  24           H        THR  24  10.965  -2.378   7.277
  183    HA   THR  24           HA       THR  24  12.043  -4.711   5.901
  184    HB   THR  24           HB       THR  24   9.327  -3.978   5.203
  185    HG1  THR  24           1HG      THR  24   8.612  -3.981   7.429
  186   1HG2  THR  24          1HG2      THR  24  10.843  -6.216   6.099
  187   2HG2  THR  24          2HG2      THR  24   9.189  -6.201   5.486
  188   3HG2  THR  24          3HG2      THR  24   9.491  -6.009   7.213
  189    H    HIS  25           H        HIS  25  11.774  -1.441   5.080
  190    HA   HIS  25           HA       HIS  25  11.741  -2.077   2.160
  191   1HB   HIS  25          1HB       HIS  25  10.880   0.396   3.690
  192   2HB   HIS  25          2HB       HIS  25  10.701   0.134   1.958
  193    HD1  HIS  25           HD1      HIS  25   9.396  -1.056   5.277
  194    HD2  HIS  25           HD2      HIS  25   8.621  -1.652   1.226
  195    HE1  HIS  25           HE1      HIS  25   7.244  -2.384   5.148
  196    H    LYS  26           H        LYS  26  13.657  -0.976   4.740
  197    HA   LYS  26           HA       LYS  26  15.213   1.123   3.722
  198   1HB   LYS  26          1HB       LYS  26  16.958   0.203   5.197
  199   2HB   LYS  26          2HB       LYS  26  15.378   0.056   5.969
  200   1HG   LYS  26          1HG       LYS  26  15.252  -2.295   5.024
  201   2HG   LYS  26          2HG       LYS  26  16.945  -2.118   4.560
  202   1HD   LYS  26          1HD       LYS  26  17.271  -1.397   7.063
  203   2HD   LYS  26          2HD       LYS  26  15.741  -2.241   7.310
  204   1HE   LYS  26          1HE       LYS  26  16.643  -4.319   6.560
  205   2HE   LYS  26          2HE       LYS  26  18.070  -3.529   5.860
  206   1HZ   LYS  26          1HZ       LYS  26  18.618  -2.722   8.114
  207   2HZ   LYS  26          2HZ       LYS  26  18.662  -4.416   7.995
  208   3HZ   LYS  26          3HZ       LYS  26  17.341  -3.647   8.739
  209    H    ALA  27           H        ALA  27  15.026  -2.196   2.676
  210    HA   ALA  27           HA       ALA  27  17.484  -1.983   1.024
  211   1HB   ALA  27          1HB       ALA  27  15.446  -4.197   1.448
  212   2HB   ALA  27          2HB       ALA  27  16.967  -4.027   2.325
  213   3HB   ALA  27          3HB       ALA  27  16.981  -4.372   0.595
  214    H    VAL  28           H        VAL  28  14.231  -1.176   0.779
  215    HA   VAL  28           HA       VAL  28  13.802  -1.912  -2.026
  216    HB   VAL  28           HB       VAL  28  12.378  -0.241   0.052
  217   1HG1  VAL  28          1HG1      VAL  28  11.903   0.783  -2.103
  218   2HG1  VAL  28          2HG1      VAL  28  10.490  -0.122  -1.567
  219   3HG1  VAL  28          3HG1      VAL  28  11.549  -0.796  -2.806
  220   1HG2  VAL  28          1HG2      VAL  28  11.645  -2.835  -1.337
  221   2HG2  VAL  28          2HG2      VAL  28  10.739  -2.057  -0.038
  222   3HG2  VAL  28          3HG2      VAL  28  12.341  -2.720   0.280
  223    H    LYS  29           H        LYS  29  13.053   0.105  -3.458
  224    HA   LYS  29           HA       LYS  29  15.378   1.930  -3.473
  225   1HB   LYS  29          1HB       LYS  29  13.534   0.778  -5.358
  226   2HB   LYS  29          2HB       LYS  29  13.540   2.535  -5.518
  227   1HG   LYS  29          1HG       LYS  29  15.350   2.067  -6.856
  228   2HG   LYS  29          2HG       LYS  29  16.173   2.165  -5.297
  229   1HD   LYS  29          1HD       LYS  29  16.633  -0.057  -5.268
  230   2HD   LYS  29          2HD       LYS  29  15.034  -0.486  -5.876
  231   1HE   LYS  29          1HE       LYS  29  17.040  -0.983  -7.433
  232   2HE   LYS  29          2HE       LYS  29  15.687  -0.085  -8.150
  233   1HZ   LYS  29          1HZ       LYS  29  16.849   1.832  -8.184
  234   2HZ   LYS  29          2HZ       LYS  29  18.200   0.801  -8.186
  235   3HZ   LYS  29          3HZ       LYS  29  17.665   1.504  -6.734
  236    H    CYS  30           H        CYS  30  15.097   3.536  -2.026
  237    HA   CYS  30           HA       CYS  30  12.790   4.703  -0.986
  238   1HB   CYS  30          1HB       CYS  30  15.527   5.747  -1.695
  239   2HB   CYS  30          2HB       CYS  30  14.326   6.837  -1.007
  240    H    GLY  31           H        GLY  31  14.103   4.982  -4.199
  241   1HA   GLY  31          1HA       GLY  31  12.380   7.273  -4.893
  242   2HA   GLY  31          2HA       GLY  31  13.521   6.471  -5.976
  243    H    ASP  32           H        ASP  32  12.125   3.862  -4.792
  244    HA   ASP  32           HA       ASP  32  10.267   3.605  -7.043
  245   1HB   ASP  32          1HB       ASP  32  11.828   1.952  -5.401
  246   2HB   ASP  32          2HB       ASP  32  10.170   1.527  -5.002
  247    H    CYS  33           H        CYS  33  10.129   4.134  -3.568
  248    HA   CYS  33           HA       CYS  33   7.157   4.023  -3.540
  249   1HB   CYS  33          1HB       CYS  33   9.368   4.399  -1.495
  250   2HB   CYS  33          2HB       CYS  33   7.665   4.575  -1.073
  251    H    HIS  34           H        HIS  34   9.714   6.316  -2.495
  252    HA   HIS  34           HA       HIS  34   7.885   8.617  -2.819
  253   1HB   HIS  34          1HB       HIS  34  10.793   8.281  -1.995
  254   2HB   HIS  34          2HB       HIS  34   9.958   9.824  -2.019
  255    HD1  HIS  34           HD1      HIS  34   7.567   9.734  -0.529
  256    HD2  HIS  34           HD2      HIS  34  10.599   7.049   0.457
  257    HE1  HIS  34           HE1      HIS  34   7.114   8.975   1.845
  258    H    HIS  35           H        HIS  35   8.338   7.217  -5.243
  259    HA   HIS  35           HA       HIS  35  10.389   7.706  -6.939
  260   1HB   HIS  35          1HB       HIS  35   8.569   8.145  -8.687
  261   2HB   HIS  35          2HB       HIS  35   8.394   6.684  -7.733
  262    HD1  HIS  35           HD1      HIS  35   7.058  10.135  -8.074
  263    HD2  HIS  35           HD2      HIS  35   6.105   6.627  -6.059
  264    HE1  HIS  35           HE1      HIS  35   4.758  10.493  -7.093
  265    HA   PRO  36           HA       PRO  36  11.338  11.914  -7.374
  266   1HB   PRO  36          1HB       PRO  36  11.696  12.168 -10.084
  267   2HB   PRO  36          2HB       PRO  36  12.853  11.349  -9.015
  268   1HG   PRO  36          1HG       PRO  36  10.728  10.174 -10.753
  269   2HG   PRO  36          2HG       PRO  36  12.399   9.639 -10.501
  270   1HD   PRO  36          1HD       PRO  36  10.326   8.437  -9.278
  271   2HD   PRO  36          2HD       PRO  36  11.911   8.615  -8.486
  272    H    VAL  37           H        VAL  37   9.607  13.198  -6.858
  273    HA   VAL  37           HA       VAL  37   7.521  13.686  -8.954
  274    HB   VAL  37           HB       VAL  37   7.592  13.780  -5.936
  275   1HG1  VAL  37          1HG1      VAL  37   6.472  15.816  -6.464
  276   2HG1  VAL  37          2HG1      VAL  37   5.187  14.642  -6.179
  277   3HG1  VAL  37          3HG1      VAL  37   5.628  15.084  -7.828
  278   1HG2  VAL  37          1HG2      VAL  37   6.827  11.682  -6.455
  279   2HG2  VAL  37          2HG2      VAL  37   6.296  12.165  -8.066
  280   3HG2  VAL  37          3HG2      VAL  37   5.296  12.534  -6.661
  281    H    ASN  38           H        ASN  38   6.918  15.952  -9.277
  282    HA   ASN  38           HA       ASN  38   7.534  18.222  -9.636
  283   1HB   ASN  38          1HB       ASN  38   6.930  17.833  -7.157
  284   2HB   ASN  38          2HB       ASN  38   8.648  17.925  -6.855
  285   1HD2  ASN  38          2HD2      ASN  38   8.618  19.907  -9.349
  286   2HD2  ASN  38          1HD2      ASN  38   8.214  21.383  -8.617
  287    H    GLY  39           H        GLY  39   9.708  15.977  -9.988
  288   1HA   GLY  39          1HA       GLY  39  11.867  16.296 -10.997
  289   2HA   GLY  39          2HA       GLY  39  11.965  17.878 -10.219
  290    H    LYS  40           H        LYS  40  10.814  16.199  -7.764
  291    HA   LYS  40           HA       LYS  40  13.418  14.940  -6.970
  292   1HB   LYS  40          1HB       LYS  40  13.124  16.186  -4.766
  293   2HB   LYS  40          2HB       LYS  40  13.523  17.200  -6.153
  294   1HG   LYS  40          1HG       LYS  40  11.136  17.743  -6.450
  295   2HG   LYS  40          2HG       LYS  40  10.731  16.726  -5.066
  296   1HD   LYS  40          1HD       LYS  40  12.194  18.160  -3.637
  297   2HD   LYS  40          2HD       LYS  40  12.461  19.216  -5.024
  298   1HE   LYS  40          1HE       LYS  40  10.396  20.176  -4.839
  299   2HE   LYS  40          2HE       LYS  40   9.614  18.631  -4.447
  300   1HZ   LYS  40          1HZ       LYS  40  11.501  19.873  -2.553
  301   2HZ   LYS  40          2HZ       LYS  40  10.259  18.757  -2.245
  302   3HZ   LYS  40          3HZ       LYS  40   9.883  20.378  -2.586
  303    H    GLU  41           H        GLU  41  13.162  13.207  -5.493
  304    HA   GLU  41           HA       GLU  41  10.585  11.910  -5.398
  305   1HB   GLU  41          1HB       GLU  41  13.257  11.522  -4.042
  306   2HB   GLU  41          2HB       GLU  41  11.888  10.467  -3.694
  307   1HG   GLU  41          1HG       GLU  41  11.841   9.594  -5.863
  308   2HG   GLU  41          2HG       GLU  41  12.675  10.988  -6.549
  309    H    ASP  42           H        ASP  42   8.933  12.748  -4.152
  310    HA   ASP  42           HA       ASP  42   9.348  14.431  -1.853
  311   1HB   ASP  42          1HB       ASP  42   6.980  12.741  -2.696
  312   2HB   ASP  42          2HB       ASP  42   6.932  14.081  -1.553
  313    H    TYR  43           H        TYR  43  10.644  13.422  -0.310
  314    HA   TYR  43           HA       TYR  43  10.169  10.663   0.542
  315   1HB   TYR  43          1HB       TYR  43  11.904  12.924   1.595
  316   2HB   TYR  43          2HB       TYR  43  11.997  11.252   2.149
  317    HD1  TYR  43           HD1      TYR  43  13.024  13.616  -0.370
  318    HD2  TYR  43           HD2      TYR  43  12.511   9.425   0.425
  319    HE1  TYR  43           HE1      TYR  43  14.517  13.071  -2.273
  320    HE2  TYR  43           HE2      TYR  43  14.003   8.881  -1.477
  321    HH   TYR  43           HH       TYR  43  15.078   9.706  -3.263
  322    H    GLN  44           H        GLN  44   7.770  11.919   0.879
  323    HA   GLN  44           HA       GLN  44   7.608  12.348   3.846
  324   1HB   GLN  44          1HB       GLN  44   5.829  14.011   3.309
  325   2HB   GLN  44          2HB       GLN  44   7.381  14.451   2.594
  326   1HG   GLN  44          1HG       GLN  44   6.622  13.300   0.472
  327   2HG   GLN  44          2HG       GLN  44   5.023  13.155   1.203
  328   1HE2  GLN  44          2HE2      GLN  44   5.597  15.860   2.627
  329   2HE2  GLN  44          1HE2      GLN  44   5.278  17.015   1.424
  330    H    LYS  45           H        LYS  45   5.240  12.004   4.591
  331    HA   LYS  45           HA       LYS  45   4.379   9.396   4.259
  332   1HB   LYS  45          1HB       LYS  45   3.100  12.000   4.952
  333   2HB   LYS  45          2HB       LYS  45   2.044  10.607   4.720
  334   1HG   LYS  45          1HG       LYS  45   2.778   9.577   6.614
  335   2HG   LYS  45          2HG       LYS  45   4.447  10.083   6.356
  336   1HD   LYS  45          1HD       LYS  45   3.621  12.454   6.971
  337   2HD   LYS  45          2HD       LYS  45   2.190  11.644   7.609
  338   1HE   LYS  45          1HE       LYS  45   3.458  10.445   9.233
  339   2HE   LYS  45          2HE       LYS  45   4.991  10.822   8.421
  340   1HZ   LYS  45          1HZ       LYS  45   4.725  12.344  10.229
  341   2HZ   LYS  45          2HZ       LYS  45   3.146  12.741   9.741
  342   3HZ   LYS  45          3HZ       LYS  45   4.475  13.206   8.789
  343    H    CYS  46           H        CYS  46   3.435   8.260   2.633
  344    HA   CYS  46           HA       CYS  46   3.213   9.052  -0.014
  345   1HB   CYS  46          1HB       CYS  46   1.442   7.142   1.537
  346   2HB   CYS  46          2HB       CYS  46   1.692   7.116  -0.203
  347    H    ALA  47           H        ALA  47   0.674   9.262   2.471
  348    HA   ALA  47           HA       ALA  47  -1.116  10.679   0.572
  349   1HB   ALA  47          1HB       ALA  47  -1.318   9.010   2.922
  350   2HB   ALA  47          2HB       ALA  47  -2.572   9.443   1.761
  351   3HB   ALA  47          3HB       ALA  47  -2.245  10.493   3.137
  352    H    THR  48           H        THR  48   0.987  12.316   1.015
  353    HA   THR  48           HA       THR  48   1.148  13.967   3.252
  354    HB   THR  48           HB       THR  48   1.177  15.204   0.531
  355    HG1  THR  48           1HG      THR  48   2.216  13.564  -0.235
  356   1HG2  THR  48          1HG2      THR  48   2.177  15.899   2.979
  357   2HG2  THR  48          2HG2      THR  48   2.811  16.492   1.444
  358   3HG2  THR  48          3HG2      THR  48   3.576  15.119   2.243
  359    H    ALA  49           H        ALA  49   0.406  16.499   2.811
  360    HA   ALA  49           HA       ALA  49  -2.445  16.516   3.308
  361   1HB   ALA  49          1HB       ALA  49  -2.081  18.871   3.622
  362   2HB   ALA  49          2HB       ALA  49  -0.639  18.843   2.606
  363   3HB   ALA  49          3HB       ALA  49  -0.618  18.067   4.189
  364    H    GLY  50           H        GLY  50  -0.440  17.125   0.477
  365   1HA   GLY  50          1HA       GLY  50  -2.944  17.440  -1.126
  366   2HA   GLY  50          2HA       GLY  50  -1.547  18.473  -1.424
  367    H    CYS  51           H        CYS  51  -1.932  14.987  -0.837
  368    HA   CYS  51           HA       CYS  51  -0.660  14.440  -3.479
  369   1HB   CYS  51          1HB       CYS  51   0.773  14.605  -1.214
  370   2HB   CYS  51          2HB       CYS  51   0.285  12.939  -1.075
  371    H    HIS  52           H        HIS  52  -0.508  11.669  -1.697
  372    HA   HIS  52           HA       HIS  52  -2.871  10.509  -2.977
  373   1HB   HIS  52          1HB       HIS  52  -0.778   9.538  -1.024
  374   2HB   HIS  52          2HB       HIS  52  -2.059   8.503  -1.608
  375    HD1  HIS  52           HD1      HIS  52  -2.197   8.906  -4.459
  376    HD2  HIS  52           HD2      HIS  52   1.472   9.020  -2.517
  377    HE1  HIS  52           HE1      HIS  52  -0.445   8.382  -6.224
  378    H    ASP  53           H        ASP  53  -3.816  12.563  -1.382
  379    HA   ASP  53           HA       ASP  53  -4.671  11.334   1.195
  380   1HB   ASP  53          1HB       ASP  53  -5.309  13.688   1.704
  381   2HB   ASP  53          2HB       ASP  53  -3.617  13.547   1.225
  382    H    ASN  54           H        ASN  54  -5.878  10.754  -1.620
  383    HA   ASN  54           HA       ASN  54  -8.562  11.928  -1.451
  384   1HB   ASN  54          1HB       ASN  54  -7.030  10.957  -3.451
  385   2HB   ASN  54          2HB       ASN  54  -7.968   9.509  -3.093
  386   1HD2  ASN  54          2HD2      ASN  54  -9.673   9.427  -4.567
  387   2HD2  ASN  54          1HD2      ASN  54 -10.651  10.747  -4.994
  388    H    MET  55           H        MET  55  -9.685  11.241   0.373
  389    HA   MET  55           HA       MET  55  -9.458   8.521   1.412
  390   1HB   MET  55          1HB       MET  55 -10.750  11.102   2.065
  391   2HB   MET  55          2HB       MET  55 -11.616   9.675   2.636
  392   1HG   MET  55          1HG       MET  55 -10.145   9.463   4.322
  393   2HG   MET  55          2HG       MET  55  -8.843   9.259   3.151
  394   1HE   MET  55          1HE       MET  55  -6.705  11.451   4.628
  395   2HE   MET  55          2HE       MET  55  -6.834  11.597   2.877
  396   3HE   MET  55          3HE       MET  55  -7.130  10.042   3.648
  397    H    ASP  56           H        ASP  56 -10.863   9.499  -1.341
  398    HA   ASP  56           HA       ASP  56 -13.527   8.316  -1.069
  399   1HB   ASP  56          1HB       ASP  56 -12.211  10.081  -2.767
  400   2HB   ASP  56          2HB       ASP  56 -12.404   8.635  -3.759
  401    H    LYS  57           H        LYS  57 -10.378   7.080  -1.459
  402    HA   LYS  57           HA       LYS  57  -9.560   4.996  -2.253
  403   1HB   LYS  57          1HB       LYS  57 -10.636   4.413  -0.164
  404   2HB   LYS  57          2HB       LYS  57 -12.222   4.392  -0.933
  405   1HG   LYS  57          1HG       LYS  57 -10.326   2.642  -2.295
  406   2HG   LYS  57          2HG       LYS  57 -10.539   2.197  -0.603
  407   1HD   LYS  57          1HD       LYS  57 -12.901   2.770  -2.394
  408   2HD   LYS  57          2HD       LYS  57 -12.183   1.162  -2.295
  409   1HE   LYS  57          1HE       LYS  57 -13.041   0.780  -0.210
  410   2HE   LYS  57          2HE       LYS  57 -12.724   2.442   0.324
  411   1HZ   LYS  57          1HZ       LYS  57 -14.738   1.940  -1.762
  412   2HZ   LYS  57          2HZ       LYS  57 -14.633   3.228  -0.658
  413   3HZ   LYS  57          3HZ       LYS  57 -15.155   1.699  -0.136
  414    H    LYS  58           H        LYS  58 -11.334   6.566  -4.149
  415    HA   LYS  58           HA       LYS  58 -12.170   4.252  -5.865
  416   1HB   LYS  58          1HB       LYS  58 -14.119   5.547  -6.499
  417   2HB   LYS  58          2HB       LYS  58 -14.035   5.537  -4.737
  418   1HG   LYS  58          1HG       LYS  58 -14.146   7.790  -4.854
  419   2HG   LYS  58          2HG       LYS  58 -12.485   7.733  -5.445
  420   1HD   LYS  58          1HD       LYS  58 -13.879   7.167  -7.730
  421   2HD   LYS  58          2HD       LYS  58 -14.987   8.271  -6.916
  422   1HE   LYS  58          1HE       LYS  58 -13.357  10.014  -6.831
  423   2HE   LYS  58          2HE       LYS  58 -12.039   8.898  -7.243
  424   1HZ   LYS  58          1HZ       LYS  58 -14.297   9.754  -8.965
  425   2HZ   LYS  58          2HZ       LYS  58 -13.319   8.415  -9.334
  426   3HZ   LYS  58          3HZ       LYS  58 -12.640   9.969  -9.248
  427    H    ASP  59           H        ASP  59 -10.639   7.390  -5.607
  428    HA   ASP  59           HA       ASP  59 -10.507   8.143  -8.348
  429   1HB   ASP  59          1HB       ASP  59  -9.882   9.688  -6.645
  430   2HB   ASP  59          2HB       ASP  59  -8.740   8.550  -5.928
  431    H    LYS  60           H        LYS  60  -9.754   6.779  -9.937
  432    HA   LYS  60           HA       LYS  60  -7.639   4.803  -9.357
  433   1HB   LYS  60          1HB       LYS  60  -9.816   5.190 -11.187
  434   2HB   LYS  60          2HB       LYS  60  -8.336   4.965 -12.121
  435   1HG   LYS  60          1HG       LYS  60  -9.276   3.139  -9.889
  436   2HG   LYS  60          2HG       LYS  60  -9.442   2.800 -11.611
  437   1HD   LYS  60          1HD       LYS  60  -6.758   3.413 -10.371
  438   2HD   LYS  60          2HD       LYS  60  -7.405   1.773 -10.413
  439   1HE   LYS  60          1HE       LYS  60  -7.784   2.780 -13.022
  440   2HE   LYS  60          2HE       LYS  60  -6.141   3.263 -12.551
  441   1HZ   LYS  60          1HZ       LYS  60  -7.278   0.540 -12.196
  442   2HZ   LYS  60          2HZ       LYS  60  -5.692   1.024 -11.827
  443   3HZ   LYS  60          3HZ       LYS  60  -6.218   0.986 -13.443
  444    H    SER  61           H        SER  61  -7.161   7.848  -9.461
  445    HA   SER  61           HA       SER  61  -5.279   8.024 -11.763
  446   1HB   SER  61          1HB       SER  61  -7.101   9.750 -10.673
  447   2HB   SER  61          2HB       SER  61  -5.622  10.277  -9.874
  448    HG   SER  61           HG       SER  61  -6.403  10.847 -12.301
  449    H    ALA  62           H        ALA  62  -3.503   9.902 -10.551
  450    HA   ALA  62           HA       ALA  62  -1.927   8.058  -8.821
  451   1HB   ALA  62          1HB       ALA  62  -0.156   8.932  -9.947
  452   2HB   ALA  62          2HB       ALA  62  -0.726  10.584  -9.716
  453   3HB   ALA  62          3HB       ALA  62  -1.358   9.611 -11.043
  454    H    LYS  63           H        LYS  63  -4.251   9.991  -8.022
  455    HA   LYS  63           HA       LYS  63  -2.727  11.497  -5.917
  456   1HB   LYS  63          1HB       LYS  63  -4.389  12.421  -7.920
  457   2HB   LYS  63          2HB       LYS  63  -5.486  12.310  -6.542
  458   1HG   LYS  63          1HG       LYS  63  -4.629  14.419  -6.161
  459   2HG   LYS  63          2HG       LYS  63  -3.429  13.465  -5.288
  460   1HD   LYS  63          1HD       LYS  63  -1.860  14.387  -6.617
  461   2HD   LYS  63          2HD       LYS  63  -2.549  13.459  -7.950
  462   1HE   LYS  63          1HE       LYS  63  -4.103  15.306  -8.460
  463   2HE   LYS  63          2HE       LYS  63  -3.434  16.244  -7.109
  464   1HZ   LYS  63          1HZ       LYS  63  -2.418  16.602  -9.419
  465   2HZ   LYS  63          2HZ       LYS  63  -1.676  15.090  -9.185
  466   3HZ   LYS  63          3HZ       LYS  63  -1.358  16.372  -8.115
  467    H    GLY  64           H        GLY  64  -4.885   8.937  -6.475
  468   1HA   GLY  64          1HA       GLY  64  -6.468   9.247  -4.058
  469   2HA   GLY  64          2HA       GLY  64  -6.437   7.825  -5.093
  470    H    TYR  65           H        TYR  65  -6.247   8.017  -2.165
  471    HA   TYR  65           HA       TYR  65  -3.483   7.331  -1.463
  472   1HB   TYR  65          1HB       TYR  65  -5.214   8.556  -0.045
  473   2HB   TYR  65          2HB       TYR  65  -6.028   7.005   0.145
  474    HD1  TYR  65           HD1      TYR  65  -2.375   7.774  -0.010
  475    HD2  TYR  65           HD2      TYR  65  -5.649   6.356   2.377
  476    HE1  TYR  65           HE1      TYR  65  -0.788   7.142   1.785
  477    HE2  TYR  65           HE2      TYR  65  -4.062   5.725   4.175
  478    HH   TYR  65           HH       TYR  65  -0.748   6.707   4.127
  479    H    TYR  66           H        TYR  66  -6.607   5.597  -1.644
  480    HA   TYR  66           HA       TYR  66  -5.498   3.032  -0.927
  481   1HB   TYR  66          1HB       TYR  66  -7.756   3.181  -0.510
  482   2HB   TYR  66          2HB       TYR  66  -8.039   4.242  -1.887
  483    HD1  TYR  66           HD1      TYR  66  -8.335   0.922  -0.637
  484    HD2  TYR  66           HD2      TYR  66  -7.795   3.183  -4.243
  485    HE1  TYR  66           HE1      TYR  66  -9.126  -1.016  -1.965
  486    HE2  TYR  66           HE2      TYR  66  -8.587   1.244  -5.580
  487    HH   TYR  66           HH       TYR  66  -9.185  -0.902  -5.526
  488    H    HIS  67           H        HIS  67  -6.179   4.650  -4.028
  489    HA   HIS  67           HA       HIS  67  -5.833   2.482  -5.809
  490   1HB   HIS  67          1HB       HIS  67  -6.563   4.552  -6.678
  491   2HB   HIS  67          2HB       HIS  67  -5.257   5.440  -5.894
  492    HD1  HIS  67           HD1      HIS  67  -5.850   2.999  -8.729
  493    HD2  HIS  67           HD2      HIS  67  -2.910   5.640  -7.409
  494    HE1  HIS  67           HE1      HIS  67  -4.061   3.030 -10.517
  495    H    ALA  68           H        ALA  68  -3.279   4.909  -5.247
  496    HA   ALA  68           HA       ALA  68  -1.105   3.533  -6.278
  497   1HB   ALA  68          1HB       ALA  68  -0.344   5.544  -5.583
  498   2HB   ALA  68          2HB       ALA  68  -0.162   4.835  -3.979
  499   3HB   ALA  68          3HB       ALA  68  -1.645   5.690  -4.401
  500    H    MET  69           H        MET  69  -2.826   2.769  -3.322
  501    HA   MET  69           HA       MET  69  -0.616   1.132  -2.260
  502   1HB   MET  69          1HB       MET  69  -3.464   1.665  -1.395
  503   2HB   MET  69          2HB       MET  69  -2.287   0.759  -0.446
  504   1HG   MET  69          1HG       MET  69  -1.223   3.313  -1.374
  505   2HG   MET  69          2HG       MET  69  -2.654   3.510  -0.365
  506   1HE   MET  69          1HE       MET  69   1.416   3.279   0.886
  507   2HE   MET  69          2HE       MET  69   0.272   4.616   0.971
  508   3HE   MET  69          3HE       MET  69   0.565   3.815  -0.571
  509    H    HIS  70           H        HIS  70  -3.888   0.553  -3.597
  510    HA   HIS  70           HA       HIS  70  -3.340  -2.364  -3.490
  511   1HB   HIS  70          1HB       HIS  70  -5.846  -0.879  -4.305
  512   2HB   HIS  70          2HB       HIS  70  -5.723  -2.558  -3.771
  513    HD1  HIS  70           HD1      HIS  70  -6.065   0.895  -2.532
  514    HD2  HIS  70           HD2      HIS  70  -5.057  -2.818  -0.935
  515    HE1  HIS  70           HE1      HIS  70  -6.232   1.131  -0.018
  516    H    ASP  71           H        ASP  71  -3.369   0.249  -5.753
  517    HA   ASP  71           HA       ASP  71  -3.981  -1.398  -8.096
  518   1HB   ASP  71          1HB       ASP  71  -3.057   1.424  -7.554
  519   2HB   ASP  71          2HB       ASP  71  -3.228   0.807  -9.192
  520    H    LYS  72           H        LYS  72  -2.500  -2.687  -9.087
  521    HA   LYS  72           HA       LYS  72   0.354  -2.510  -8.395
  522   1HB   LYS  72          1HB       LYS  72  -1.046  -4.285 -10.410
  523   2HB   LYS  72          2HB       LYS  72   0.465  -4.610  -9.560
  524   1HG   LYS  72          1HG       LYS  72  -0.712  -5.629  -7.938
  525   2HG   LYS  72          2HG       LYS  72  -1.472  -4.082  -7.564
  526   1HD   LYS  72          1HD       LYS  72  -2.832  -4.884  -9.830
  527   2HD   LYS  72          2HD       LYS  72  -2.572  -6.407  -8.980
  528   1HE   LYS  72          1HE       LYS  72  -3.416  -5.159  -6.870
  529   2HE   LYS  72          2HE       LYS  72  -4.039  -3.950  -8.010
  530   1HZ   LYS  72          1HZ       LYS  72  -5.013  -5.869  -9.271
  531   2HZ   LYS  72          2HZ       LYS  72  -5.735  -5.560  -7.764
  532   3HZ   LYS  72          3HZ       LYS  72  -4.646  -6.852  -7.939
  533    H    GLY  73           H        GLY  73  -1.642  -2.194 -11.334
  534   1HA   GLY  73          1HA       GLY  73   0.576  -1.466 -13.039
  535   2HA   GLY  73          2HA       GLY  73  -1.131  -1.238 -13.427
  536    H    THR  74           H        THR  74   1.090   0.072 -10.950
  537    HA   THR  74           HA       THR  74  -0.066   2.782 -11.458
  538    HB   THR  74           HB       THR  74   1.132   3.129  -9.179
  539    HG1  THR  74           1HG      THR  74   2.413   1.254  -9.348
  540   1HG2  THR  74          1HG2      THR  74  -0.707   1.823  -7.990
  541   2HG2  THR  74          2HG2      THR  74  -1.195   1.243  -9.583
  542   3HG2  THR  74          3HG2      THR  74  -1.253   2.967  -9.218
  543    H    LYS  75           H        LYS  75   1.457   4.605 -11.564
  544    HA   LYS  75           HA       LYS  75   3.568   4.529 -13.309
  545   1HB   LYS  75          1HB       LYS  75   2.531   6.485 -11.970
  546   2HB   LYS  75          2HB       LYS  75   3.689   6.080 -10.706
  547   1HG   LYS  75          1HG       LYS  75   4.138   7.374 -13.332
  548   2HG   LYS  75          2HG       LYS  75   5.022   7.556 -11.820
  549   1HD   LYS  75          1HD       LYS  75   6.189   5.450 -12.197
  550   2HD   LYS  75          2HD       LYS  75   5.241   5.153 -13.655
  551   1HE   LYS  75          1HE       LYS  75   6.344   6.820 -14.873
  552   2HE   LYS  75          2HE       LYS  75   6.837   7.697 -13.411
  553   1HZ   LYS  75          1HZ       LYS  75   7.866   5.103 -14.409
  554   2HZ   LYS  75          2HZ       LYS  75   8.126   5.634 -12.817
  555   3HZ   LYS  75          3HZ       LYS  75   8.741   6.528 -14.125
  556    H    PHE  76           H        PHE  76   3.911   4.094  -9.768
  557    HA   PHE  76           HA       PHE  76   6.550   2.758 -10.272
  558   1HB   PHE  76          1HB       PHE  76   5.474   4.159  -7.809
  559   2HB   PHE  76          2HB       PHE  76   7.111   3.551  -8.029
  560    HD1  PHE  76           HD1      PHE  76   8.497   4.521  -9.973
  561    HD2  PHE  76           HD2      PHE  76   4.837   6.275  -8.571
  562    HE1  PHE  76           HE1      PHE  76   9.082   6.652 -11.103
  563    HE2  PHE  76           HE2      PHE  76   5.422   8.402  -9.696
  564    HZ   PHE  76           HZ       PHE  76   7.538   8.584 -10.960
  565    H    LYS  77           H        LYS  77   7.023   1.254  -8.173
  566    HA   LYS  77           HA       LYS  77   4.913  -0.760  -8.200
  567   1HB   LYS  77          1HB       LYS  77   6.468  -1.949  -6.713
  568   2HB   LYS  77          2HB       LYS  77   7.304  -1.329  -8.133
  569   1HG   LYS  77          1HG       LYS  77   7.911   0.705  -6.719
  570   2HG   LYS  77          2HG       LYS  77   7.331  -0.208  -5.325
  571   1HD   LYS  77          1HD       LYS  77   9.809  -0.432  -5.712
  572   2HD   LYS  77          2HD       LYS  77   8.946  -1.968  -5.729
  573   1HE   LYS  77          1HE       LYS  77   9.107  -0.651  -8.370
  574   2HE   LYS  77          2HE       LYS  77  10.663  -1.191  -7.710
  575   1HZ   LYS  77          1HZ       LYS  77   9.830  -3.355  -7.366
  576   2HZ   LYS  77          2HZ       LYS  77   9.357  -2.934  -8.942
  577   3HZ   LYS  77          3HZ       LYS  77   8.230  -2.882  -7.672
  578    H    SER  78           H        SER  78   3.165  -0.468  -7.042
  579    HA   SER  78           HA       SER  78   2.955   1.356  -4.786
  580   1HB   SER  78          1HB       SER  78   0.609   0.065  -4.855
  581   2HB   SER  78          2HB       SER  78   1.033   1.280  -6.057
  582    HG   SER  78           HG       SER  78   0.392  -1.170  -6.532
  583    H    CYS  79           H        CYS  79   1.652   0.438  -2.801
  584    HA   CYS  79           HA       CYS  79   3.296  -1.340  -1.313
  585   1HB   CYS  79          1HB       CYS  79   0.347  -0.716  -0.981
  586   2HB   CYS  79          2HB       CYS  79   1.458  -1.215   0.290
  587    H    VAL  80           H        VAL  80  -0.052  -2.009  -2.376
  588    HA   VAL  80           HA       VAL  80   0.196  -4.872  -2.111
  589    HB   VAL  80           HB       VAL  80  -1.691  -2.969  -3.502
  590   1HG1  VAL  80          1HG1      VAL  80  -1.376  -5.807  -3.962
  591   2HG1  VAL  80          2HG1      VAL  80  -2.464  -4.666  -4.754
  592   3HG1  VAL  80          3HG1      VAL  80  -2.957  -5.464  -3.259
  593   1HG2  VAL  80          1HG2      VAL  80  -2.720  -2.939  -1.486
  594   2HG2  VAL  80          2HG2      VAL  80  -1.392  -3.901  -0.840
  595   3HG2  VAL  80          3HG2      VAL  80  -2.827  -4.700  -1.481
  596    H    GLY  81           H        GLY  81   0.832  -2.583  -4.708
  597   1HA   GLY  81          1HA       GLY  81   0.967  -4.511  -6.852
  598   2HA   GLY  81          2HA       GLY  81   1.668  -2.891  -6.884
  599    H    CYS  82           H        CYS  82   3.384  -3.091  -4.659
  600    HA   CYS  82           HA       CYS  82   5.600  -4.625  -5.822
  601   1HB   CYS  82          1HB       CYS  82   5.530  -2.327  -4.531
  602   2HB   CYS  82          2HB       CYS  82   5.554  -3.343  -3.092
  603    H    HIS  83           H        HIS  83   3.157  -5.020  -3.420
  604    HA   HIS  83           HA       HIS  83   4.453  -7.100  -1.863
  605   1HB   HIS  83          1HB       HIS  83   1.786  -5.777  -2.138
  606   2HB   HIS  83          2HB       HIS  83   1.853  -7.298  -1.268
  607    HD1  HIS  83           HD1      HIS  83   1.365  -5.946   0.973
  608    HD2  HIS  83           HD2      HIS  83   4.964  -4.996  -0.904
  609    HE1  HIS  83           HE1      HIS  83   2.746  -4.684   2.675
  610    H    LEU  84           H        LEU  84   1.664  -7.199  -4.153
  611    HA   LEU  84           HA       LEU  84   1.387  -9.974  -4.383
  612   1HB   LEU  84          1HB       LEU  84   0.483  -7.606  -5.584
  613   2HB   LEU  84          2HB       LEU  84   1.150  -8.552  -6.910
  614    HG   LEU  84           HG       LEU  84  -0.646  -9.847  -4.885
  615   1HD1  LEU  84          1HD1      LEU  84  -1.621  -8.508  -7.420
  616   2HD1  LEU  84          2HD1      LEU  84  -1.736  -7.755  -5.828
  617   3HD1  LEU  84          3HD1      LEU  84  -2.598  -9.259  -6.158
  618   1HD2  LEU  84          1HD2      LEU  84  -0.378 -11.607  -6.268
  619   2HD2  LEU  84          2HD2      LEU  84   0.730 -10.642  -7.244
  620   3HD2  LEU  84          3HD2      LEU  84  -0.993 -10.659  -7.622
  621    H    GLU  85           H        GLU  85   3.790  -7.820  -5.819
  622    HA   GLU  85           HA       GLU  85   4.916  -9.930  -7.544
  623   1HB   GLU  85          1HB       GLU  85   4.855  -7.109  -7.415
  624   2HB   GLU  85          2HB       GLU  85   6.543  -7.560  -7.173
  625   1HG   GLU  85          1HG       GLU  85   4.760  -8.419  -9.470
  626   2HG   GLU  85          2HG       GLU  85   6.133  -7.315  -9.560
  627    H    THR  86           H        THR  86   5.937  -8.057  -4.665
  628    HA   THR  86           HA       THR  86   8.460  -9.342  -4.282
  629    HB   THR  86           HB       THR  86   6.465  -7.872  -2.561
  630    HG1  THR  86           1HG      THR  86   8.956  -7.415  -3.754
  631   1HG2  THR  86          1HG2      THR  86   7.594  -9.628  -1.162
  632   2HG2  THR  86          2HG2      THR  86   7.973  -7.978  -0.668
  633   3HG2  THR  86          3HG2      THR  86   9.144  -8.912  -1.600
  634    H    ALA  87           H        ALA  87   5.275 -10.544  -3.953
  635    HA   ALA  87           HA       ALA  87   5.854 -12.510  -1.856
  636   1HB   ALA  87          1HB       ALA  87   3.582 -12.700  -1.877
  637   2HB   ALA  87          2HB       ALA  87   3.538 -12.920  -3.626
  638   3HB   ALA  87          3HB       ALA  87   3.619 -11.296  -2.945
  639    H    GLY  88           H        GLY  88   5.682 -12.438  -5.388
  640   1HA   GLY  88          1HA       GLY  88   6.352 -14.013  -6.991
  641   2HA   GLY  88          2HA       GLY  88   7.444 -14.633  -5.753
  642    H    ALA  89           H        ALA  89   3.969 -14.702  -6.613
  643    HA   ALA  89           HA       ALA  89   2.367 -16.414  -6.196
  644   1HB   ALA  89          1HB       ALA  89   4.292 -18.499  -6.862
  645   2HB   ALA  89          2HB       ALA  89   4.438 -17.101  -7.926
  646   3HB   ALA  89          3HB       ALA  89   2.893 -17.940  -7.778
  647    H    ASP  90           H        ASP  90   3.169 -15.797  -3.754
  648    HA   ASP  90           HA       ASP  90   3.804 -18.399  -2.438
  649   1HB   ASP  90          1HB       ASP  90   5.713 -16.871  -2.436
  650   2HB   ASP  90          2HB       ASP  90   4.716 -15.588  -1.766
  651    H    ALA  91           H        ALA  91   1.505 -18.650  -2.189
  652    HA   ALA  91           HA       ALA  91  -0.485 -17.020  -1.285
  653   1HB   ALA  91          1HB       ALA  91   0.224 -19.752  -0.167
  654   2HB   ALA  91          2HB       ALA  91  -0.644 -19.460  -1.674
  655   3HB   ALA  91          3HB       ALA  91  -1.380 -19.017  -0.134
  656    H    ALA  92           H        ALA  92   2.295 -18.055   0.612
  657    HA   ALA  92           HA       ALA  92   1.261 -17.091   3.163
  658   1HB   ALA  92          1HB       ALA  92   4.183 -17.321   2.611
  659   2HB   ALA  92          2HB       ALA  92   3.224 -18.785   2.394
  660   3HB   ALA  92          3HB       ALA  92   3.246 -17.970   3.958
  661    H    LYS  93           H        LYS  93   3.572 -15.904   0.743
  662    HA   LYS  93           HA       LYS  93   3.956 -13.334   2.063
  663   1HB   LYS  93          1HB       LYS  93   4.815 -14.820  -0.356
  664   2HB   LYS  93          2HB       LYS  93   4.862 -13.064  -0.494
  665   1HG   LYS  93          1HG       LYS  93   6.111 -13.061   1.731
  666   2HG   LYS  93          2HG       LYS  93   6.257 -14.809   1.541
  667   1HD   LYS  93          1HD       LYS  93   8.051 -14.488   0.223
  668   2HD   LYS  93          2HD       LYS  93   7.019 -13.647  -0.935
  669   1HE   LYS  93          1HE       LYS  93   7.353 -11.526   0.330
  670   2HE   LYS  93          2HE       LYS  93   8.458 -12.382   1.424
  671   1HZ   LYS  93          1HZ       LYS  93   9.783 -11.452  -0.293
  672   2HZ   LYS  93          2HZ       LYS  93   8.740 -12.020  -1.508
  673   3HZ   LYS  93          3HZ       LYS  93   9.681 -13.114  -0.612
  674    H    LYS  94           H        LYS  94   1.780 -14.681  -0.335
  675    HA   LYS  94           HA       LYS  94   0.874 -12.129  -1.412
  676   1HB   LYS  94          1HB       LYS  94   0.339 -15.009  -1.665
  677   2HB   LYS  94          2HB       LYS  94  -1.106 -14.015  -1.858
  678   1HG   LYS  94          1HG       LYS  94   0.435 -12.559  -3.407
  679   2HG   LYS  94          2HG       LYS  94   1.413 -14.025  -3.495
  680   1HD   LYS  94          1HD       LYS  94  -1.236 -14.893  -3.842
  681   2HD   LYS  94          2HD       LYS  94  -1.100 -13.428  -4.815
  682   1HE   LYS  94          1HE       LYS  94   1.248 -14.622  -5.467
  683   2HE   LYS  94          2HE       LYS  94   0.242 -16.054  -5.172
  684   1HZ   LYS  94          1HZ       LYS  94  -0.230 -13.828  -7.057
  685   2HZ   LYS  94          2HZ       LYS  94  -1.520 -14.779  -6.494
  686   3HZ   LYS  94          3HZ       LYS  94  -0.249 -15.496  -7.363
  687    H    LYS  95           H        LYS  95   0.040 -14.162   1.317
  688    HA   LYS  95           HA       LYS  95  -2.491 -12.760   1.870
  689   1HB   LYS  95          1HB       LYS  95  -2.717 -14.415   3.546
  690   2HB   LYS  95          2HB       LYS  95  -1.801 -15.241   2.286
  691   1HG   LYS  95          1HG       LYS  95  -0.294 -15.712   3.902
  692   2HG   LYS  95          2HG       LYS  95   0.176 -14.017   3.791
  693   1HD   LYS  95          1HD       LYS  95  -0.296 -14.250   6.074
  694   2HD   LYS  95          2HD       LYS  95  -1.817 -13.619   5.439
  695   1HE   LYS  95          1HE       LYS  95  -2.242 -15.549   6.927
  696   2HE   LYS  95          2HE       LYS  95  -2.674 -15.964   5.257
  697   1HZ   LYS  95          1HZ       LYS  95   0.080 -16.387   6.206
  698   2HZ   LYS  95          2HZ       LYS  95  -0.759 -17.182   4.961
  699   3HZ   LYS  95          3HZ       LYS  95  -1.112 -17.532   6.586
  700    H    GLU  96           H        GLU  96   0.867 -12.485   2.668
  701    HA   GLU  96           HA       GLU  96   0.364 -10.741   5.021
  702   1HB   GLU  96          1HB       GLU  96   2.753 -11.012   5.328
  703   2HB   GLU  96          2HB       GLU  96   2.098 -12.582   4.906
  704   1HG   GLU  96          1HG       GLU  96   2.800 -12.296   2.610
  705   2HG   GLU  96          2HG       GLU  96   3.358 -10.659   2.954
  706    H    LEU  97           H        LEU  97   1.872 -10.677   1.829
  707    HA   LEU  97           HA       LEU  97   2.493  -7.827   1.902
  708   1HB   LEU  97          1HB       LEU  97   2.393  -9.870  -0.328
  709   2HB   LEU  97          2HB       LEU  97   3.178  -8.293  -0.420
  710    HG   LEU  97           HG       LEU  97   3.936 -10.645   1.315
  711   1HD1  LEU  97          1HD1      LEU  97   4.977 -10.729  -0.808
  712   2HD1  LEU  97          2HD1      LEU  97   6.187 -10.022   0.262
  713   3HD1  LEU  97          3HD1      LEU  97   5.258  -8.990  -0.826
  714   1HD2  LEU  97          1HD2      LEU  97   5.769  -8.757   1.952
  715   2HD2  LEU  97          2HD2      LEU  97   4.317  -9.039   2.912
  716   3HD2  LEU  97          3HD2      LEU  97   4.353  -7.730   1.731
  717    H    THR  98           H        THR  98   0.370  -9.671  -0.313
  718    HA   THR  98           HA       THR  98  -1.177  -7.205  -0.827
  719    HB   THR  98           HB       THR  98  -2.263  -8.739  -2.515
  720    HG1  THR  98           1HG      THR  98  -0.935 -10.726  -2.767
  721   1HG2  THR  98          1HG2      THR  98   0.164  -7.467  -2.572
  722   2HG2  THR  98          2HG2      THR  98  -0.577  -8.255  -3.964
  723   3HG2  THR  98          3HG2      THR  98   0.622  -9.116  -2.997
  724    H    GLY  99           H        GLY  99  -1.443 -10.089   1.074
  725   1HA   GLY  99          1HA       GLY  99  -4.189 -10.525   1.231
  726   2HA   GLY  99          2HA       GLY  99  -3.117 -10.671   2.626
  727    H    CYS 100           H        CYS 100  -5.859  -9.208   1.754
  728    HA   CYS 100           HA       CYS 100  -5.341  -6.500   2.723
  729   1HB   CYS 100          1HB       CYS 100  -8.095  -7.507   2.771
  730   2HB   CYS 100          2HB       CYS 100  -7.450  -6.102   1.968
  731    H    LYS 101           H        LYS 101  -7.516  -9.043   3.938
  732    HA   LYS 101           HA       LYS 101  -7.151  -7.917   6.666
  733   1HB   LYS 101          1HB       LYS 101  -9.091  -9.952   5.513
  734   2HB   LYS 101          2HB       LYS 101  -9.172  -9.280   7.143
  735   1HG   LYS 101          1HG       LYS 101  -9.355  -6.994   6.136
  736   2HG   LYS 101          2HG       LYS 101  -9.435  -7.745   4.542
  737   1HD   LYS 101          1HD       LYS 101 -11.410  -9.094   5.398
  738   2HD   LYS 101          2HD       LYS 101 -11.400  -8.054   6.823
  739   1HE   LYS 101          1HE       LYS 101 -11.445  -6.087   5.095
  740   2HE   LYS 101          2HE       LYS 101 -12.030  -7.326   3.968
  741   1HZ   LYS 101          1HZ       LYS 101 -13.996  -6.775   4.942
  742   2HZ   LYS 101          2HZ       LYS 101 -13.278  -6.298   6.407
  743   3HZ   LYS 101          3HZ       LYS 101 -13.488  -7.947   6.057
  744    H    GLY 102           H        GLY 102  -5.476  -8.862   7.778
  745   1HA   GLY 102          1HA       GLY 102  -4.816 -10.872   9.062
  746   2HA   GLY 102          2HA       GLY 102  -5.252 -11.840   7.653
  747    H    SER 103           H        SER 103  -3.839  -9.223   6.327
  748    HA   SER 103           HA       SER 103  -1.320 -10.641   5.841
  749   1HB   SER 103          1HB       SER 103  -0.976  -8.753   4.294
  750   2HB   SER 103          2HB       SER 103  -2.587  -9.426   4.100
  751    HG   SER 103           HG       SER 103  -3.421  -7.643   4.880
  752    H    LYS 104           H        LYS 104   0.259  -8.221   5.563
  753    HA   LYS 104           HA       LYS 104   0.988  -7.785   8.426
  754   1HB   LYS 104          1HB       LYS 104   2.361  -7.372   5.752
  755   2HB   LYS 104          2HB       LYS 104   3.099  -6.984   7.304
  756   1HG   LYS 104          1HG       LYS 104   1.959  -9.722   6.975
  757   2HG   LYS 104          2HG       LYS 104   3.474  -9.364   6.145
  758   1HD   LYS 104          1HD       LYS 104   3.923  -8.278   8.630
  759   2HD   LYS 104          2HD       LYS 104   2.947  -9.694   9.022
  760   1HE   LYS 104          1HE       LYS 104   4.505 -11.083   7.606
  761   2HE   LYS 104          2HE       LYS 104   5.543  -9.651   7.448
  762   1HZ   LYS 104          1HZ       LYS 104   5.175  -9.564  10.025
  763   2HZ   LYS 104          2HZ       LYS 104   6.391 -10.545   9.358
  764   3HZ   LYS 104          3HZ       LYS 104   4.912 -11.229   9.839
  765    H    CYS 105           H        CYS 105  -0.087  -6.296   5.499
  766    HA   CYS 105           HA       CYS 105   0.410  -3.539   6.278
  767   1HB   CYS 105          1HB       CYS 105  -0.062  -5.035   3.995
  768   2HB   CYS 105          2HB       CYS 105  -1.556  -4.154   4.201
  769    H    HIS 106           H        HIS 106  -2.234  -5.830   6.628
  770    HA   HIS 106           HA       HIS 106  -3.930  -3.636   7.785
  771   1HB   HIS 106          1HB       HIS 106  -4.440  -5.959   5.984
  772   2HB   HIS 106          2HB       HIS 106  -5.722  -5.517   7.111
  773    HD1  HIS 106           HD1      HIS 106  -5.125  -2.418   7.063
  774    HD2  HIS 106           HD2      HIS 106  -5.660  -4.818   3.676
  775    HE1  HIS 106           HE1      HIS 106  -5.719  -0.852   5.171
  776    H    SER 107           H        SER 107  -3.028  -4.054   9.930
  777    HA   SER 107           HA       SER 107  -2.928  -6.637  11.166
  778   1HB   SER 107          1HB       SER 107  -3.109  -3.780  12.131
  779   2HB   SER 107          2HB       SER 107  -3.008  -5.125  13.264
  780    HG   SER 107           HG       SER 107  -1.184  -4.543  11.162
  781    HHA  HEC 201           HHA      HEC 201   5.984   8.557   5.694
  782    HHB  HEC 201           HHB      HEC 201  12.086   9.789   4.830
  783    HHC  HEC 201           HHC      HEC 201  12.609   4.680   1.121
  784    HHD  HEC 201           HHD      HEC 201   6.482   3.587   1.778
  785   1HMA  HEC 201          1HMA      HEC 201  11.306  10.573   7.023
  786   2HMA  HEC 201          2HMA      HEC 201   9.781  10.869   7.864
  787   3HMA  HEC 201          3HMA      HEC 201  10.257  11.895   6.508
  788   1HAA  HEC 201          1HAA      HEC 201   6.516   9.677   7.282
  789   2HAA  HEC 201          2HAA      HEC 201   7.828  10.667   7.918
  790   1HBA  HEC 201          1HBA      HEC 201   6.738  11.511   5.298
  791   2HBA  HEC 201          2HBA      HEC 201   5.653  11.702   6.676
  792   1HMB  HEC 201          1HMB      HEC 201  15.176   8.224   4.401
  793   2HMB  HEC 201          2HMB      HEC 201  14.919   9.244   2.984
  794   3HMB  HEC 201          3HMB      HEC 201  14.048   9.578   4.482
  795    HAB  HEC 201           HAB      HEC 201  14.466   5.466   1.291
  796   1HBB  HEC 201          1HBB      HEC 201  15.890   4.711   2.865
  797   2HBB  HEC 201          2HBB      HEC 201  15.342   5.947   3.998
  798   3HBB  HEC 201          3HBB      HEC 201  16.658   6.299   2.877
  799   1HMC  HEC 201          1HMC      HEC 201  11.528   1.658   0.551
  800   2HMC  HEC 201          2HMC      HEC 201  10.891   2.369  -0.933
  801   3HMC  HEC 201          3HMC      HEC 201  12.227   3.148  -0.085
  802    HAC  HEC 201           HAC      HEC 201   7.188   2.141   0.622
  803   1HBC  HEC 201          1HBC      HEC 201   8.211   0.111  -0.402
  804   2HBC  HEC 201          2HBC      HEC 201   8.766   0.383   1.248
  805   3HBC  HEC 201          3HBC      HEC 201   9.806   0.803  -0.111
  806   1HMD  HEC 201          1HMD      HEC 201   4.663   3.338   3.044
  807   2HMD  HEC 201          2HMD      HEC 201   3.824   4.015   4.438
  808   3HMD  HEC 201          3HMD      HEC 201   3.438   4.587   2.813
  809   1HAD  HEC 201          1HAD      HEC 201   4.252   7.863   5.576
  810   2HAD  HEC 201          2HAD      HEC 201   3.258   7.344   4.220
  811   1HBD  HEC 201          1HBD      HEC 201   2.743   5.268   5.261
  812   2HBD  HEC 201          2HBD      HEC 201   4.021   5.470   6.460
  813    HHA  HEC 202           HHA      HEC 202   1.422   7.611  -9.509
  814    HHB  HEC 202           HHB      HEC 202   2.777   4.136  -4.754
  815    HHC  HEC 202           HHC      HEC 202   4.468   9.048  -1.283
  816    HHD  HEC 202           HHD      HEC 202   2.784  12.901  -5.921
  817   1HMA  HEC 202          1HMA      HEC 202   0.952   3.240  -5.774
  818   2HMA  HEC 202          2HMA      HEC 202   1.949   2.771  -7.151
  819   3HMA  HEC 202          3HMA      HEC 202   0.280   3.278  -7.404
  820   1HAA  HEC 202          1HAA      HEC 202   1.056   5.046  -9.965
  821   2HAA  HEC 202          2HAA      HEC 202  -0.108   4.377  -8.855
  822   1HBA  HEC 202          1HBA      HEC 202  -1.569   6.025  -9.242
  823   2HBA  HEC 202          2HBA      HEC 202  -0.338   7.264  -9.019
  824   1HMB  HEC 202          1HMB      HEC 202   4.833   3.791  -1.728
  825   2HMB  HEC 202          2HMB      HEC 202   3.081   3.655  -1.872
  826   3HMB  HEC 202          3HMB      HEC 202   4.106   3.364  -3.277
  827    HAB  HEC 202           HAB      HEC 202   4.222   7.069   0.072
  828   1HBB  HEC 202          1HBB      HEC 202   6.617   6.283  -1.309
  829   2HBB  HEC 202          2HBB      HEC 202   6.388   5.222   0.080
  830   3HBB  HEC 202          3HBB      HEC 202   6.465   6.969   0.309
  831   1HMC  HEC 202          1HMC      HEC 202   5.200  12.871  -1.477
  832   2HMC  HEC 202          2HMC      HEC 202   3.934  12.007  -0.605
  833   3HMC  HEC 202          3HMC      HEC 202   5.450  11.193  -0.993
  834    HAC  HEC 202           HAC      HEC 202   2.240  13.816  -3.778
  835   1HBC  HEC 202          1HBC      HEC 202   4.897  14.654  -2.627
  836   2HBC  HEC 202          2HBC      HEC 202   3.646  13.960  -1.596
  837   3HBC  HEC 202          3HBC      HEC 202   3.334  15.454  -2.480
  838   1HMD  HEC 202          1HMD      HEC 202   2.856  13.449  -8.506
  839   2HMD  HEC 202          2HMD      HEC 202   1.097  13.333  -8.433
  840   3HMD  HEC 202          3HMD      HEC 202   1.951  12.877  -9.909
  841   1HAD  HEC 202          1HAD      HEC 202   1.733   9.123 -10.802
  842   2HAD  HEC 202          2HAD      HEC 202   1.022  10.717 -10.958
  843   1HBD  HEC 202          1HBD      HEC 202   3.723  11.249 -10.573
  844   2HBD  HEC 202          2HBD      HEC 202   3.720   9.814 -11.601
  845    HHA  HEC 203           HHA      HEC 203   7.141  -6.888   4.601
  846    HHB  HEC 203           HHB      HEC 203   2.826  -2.061   4.856
  847    HHC  HEC 203           HHC      HEC 203   4.767  -0.004  -0.534
  848    HHD  HEC 203           HHD      HEC 203   9.073  -4.558  -0.939
  849   1HMA  HEC 203          1HMA      HEC 203   3.139  -5.050   7.491
  850   2HMA  HEC 203          2HMA      HEC 203   2.310  -3.817   6.540
  851   3HMA  HEC 203          3HMA      HEC 203   3.643  -3.362   7.602
  852   1HAA  HEC 203          1HAA      HEC 203   4.891  -6.114   7.687
  853   2HAA  HEC 203          2HAA      HEC 203   4.694  -7.316   6.419
  854   1HBA  HEC 203          1HBA      HEC 203   6.918  -7.780   6.339
  855   2HBA  HEC 203          2HBA      HEC 203   7.375  -6.087   6.532
  856   1HMB  HEC 203          1HMB      HEC 203   1.522   0.915   3.397
  857   2HMB  HEC 203          2HMB      HEC 203   1.509  -0.553   4.374
  858   3HMB  HEC 203          3HMB      HEC 203   2.621   0.759   4.767
  859    HAB  HEC 203           HAB      HEC 203   2.909   0.838   0.015
  860   1HBB  HEC 203          1HBB      HEC 203   4.667   2.376   1.577
  861   2HBB  HEC 203          2HBB      HEC 203   3.118   3.209   1.698
  862   3HBB  HEC 203          3HBB      HEC 203   3.834   2.910   0.116
  863   1HMC  HEC 203          1HMC      HEC 203   7.412   0.116  -2.858
  864   2HMC  HEC 203          2HMC      HEC 203   6.127  -0.858  -3.572
  865   3HMC  HEC 203          3HMC      HEC 203   5.754   0.282  -2.280
  866    HAC  HEC 203           HAC      HEC 203   9.300  -3.496  -2.574
  867   1HBC  HEC 203          1HBC      HEC 203   8.327  -1.054  -4.064
  868   2HBC  HEC 203          2HBC      HEC 203   9.914  -1.818  -4.143
  869   3HBC  HEC 203          3HBC      HEC 203   9.434  -0.925  -2.702
  870   1HMD  HEC 203          1HMD      HEC 203   9.960  -7.779   0.067
  871   2HMD  HEC 203          2HMD      HEC 203  11.039  -6.831   1.090
  872   3HMD  HEC 203          3HMD      HEC 203  10.379  -6.128  -0.387
  873   1HAD  HEC 203          1HAD      HEC 203  10.177  -7.898   3.155
  874   2HAD  HEC 203          2HAD      HEC 203   8.721  -7.967   4.142
  875   1HBD  HEC 203          1HBD      HEC 203   7.645  -9.459   2.620
  876   2HBD  HEC 203          2HBD      HEC 203   8.868  -9.185   1.379
  877    HHA  HEC 204           HHA      HEC 204  -6.683   2.298   3.725
  878    HHB  HEC 204           HHB      HEC 204  -9.976  -2.238   0.873
  879    HHC  HEC 204           HHC      HEC 204  -4.702  -5.897   0.923
  880    HHD  HEC 204           HHD      HEC 204  -1.389  -0.926   2.662
  881   1HMA  HEC 204          1HMA      HEC 204 -11.588   0.554   2.467
  882   2HMA  HEC 204          2HMA      HEC 204 -11.310  -0.747   1.308
  883   3HMA  HEC 204          3HMA      HEC 204 -10.980   0.926   0.853
  884   1HAA  HEC 204          1HAA      HEC 204 -10.119   2.299   3.935
  885   2HAA  HEC 204          2HAA      HEC 204  -8.510   2.959   3.644
  886   1HBA  HEC 204          1HBA      HEC 204  -9.060   3.185   1.236
  887   2HBA  HEC 204          2HBA      HEC 204 -10.676   2.573   1.562
  888   1HMB  HEC 204          1HMB      HEC 204  -9.617  -4.742  -1.601
  889   2HMB  HEC 204          2HMB      HEC 204 -10.444  -3.873  -0.307
  890   3HMB  HEC 204          3HMB      HEC 204 -10.102  -5.595  -0.137
  891    HAB  HEC 204           HAB      HEC 204  -6.349  -6.976   0.248
  892   1HBB  HEC 204          1HBB      HEC 204  -6.820  -7.564  -2.213
  893   2HBB  HEC 204          2HBB      HEC 204  -5.603  -6.327  -1.895
  894   3HBB  HEC 204          3HBB      HEC 204  -7.224  -5.858  -2.413
  895   1HMC  HEC 204          1HMC      HEC 204  -1.449  -6.152   2.285
  896   2HMC  HEC 204          2HMC      HEC 204  -2.930  -6.621   1.450
  897   3HMC  HEC 204          3HMC      HEC 204  -1.535  -6.070   0.525
  898    HAC  HEC 204           HAC      HEC 204  -0.302  -2.438   2.884
  899   1HBC  HEC 204          1HBC      HEC 204   0.507  -4.339   0.659
  900   2HBC  HEC 204          2HBC      HEC 204   1.530  -3.165   1.488
  901   3HBC  HEC 204          3HBC      HEC 204   0.252  -2.612   0.407
  902   1HMD  HEC 204          1HMD      HEC 204  -0.817   1.078   3.021
  903   2HMD  HEC 204          2HMD      HEC 204  -1.441   2.691   3.368
  904   3HMD  HEC 204          3HMD      HEC 204  -1.291   1.506   4.665
  905   1HAD  HEC 204          1HAD      HEC 204  -3.549   3.888   3.610
  906   2HAD  HEC 204          2HAD      HEC 204  -5.224   3.554   4.035
  907   1HBD  HEC 204          1HBD      HEC 204  -4.059   2.275   6.067
  908   2HBD  HEC 204          2HBD      HEC 204  -2.782   3.442   5.734
  Start of MODEL   18
    1   1H    ALA   1          1H        ALA   1  19.467  13.118   0.319
    2   2H    ALA   1          2H        ALA   1  20.568  14.320   0.800
    3   3H    ALA   1          3H        ALA   1  18.972  14.344   1.382
    4    HA   ALA   1           HA       ALA   1  20.396  11.886   1.944
    5   1HB   ALA   1          1HB       ALA   1  22.309  13.099   2.360
    6   2HB   ALA   1          2HB       ALA   1  21.481  13.428   3.881
    7   3HB   ALA   1          3HB       ALA   1  21.424  14.609   2.573
    8    HA   PRO   2           HA       PRO   2  16.585  13.205   4.325
    9   1HB   PRO   2          1HB       PRO   2  15.009  11.103   3.562
   10   2HB   PRO   2          2HB       PRO   2  15.085  12.624   2.662
   11   1HG   PRO   2          1HG       PRO   2  16.404  10.023   2.094
   12   2HG   PRO   2          2HG       PRO   2  15.708  11.202   0.973
   13   1HD   PRO   2          1HD       PRO   2  18.390  10.945   1.428
   14   2HD   PRO   2          2HD       PRO   2  17.619  12.456   0.901
   15    H    LYS   3           H        LYS   3  15.999  12.236   6.318
   16    HA   LYS   3           HA       LYS   3  17.571   9.798   7.042
   17   1HB   LYS   3          1HB       LYS   3  16.131  11.718   8.864
   18   2HB   LYS   3          2HB       LYS   3  17.454  10.624   9.260
   19   1HG   LYS   3          1HG       LYS   3  18.982  11.915   7.832
   20   2HG   LYS   3          2HG       LYS   3  17.663  12.998   7.384
   21   1HD   LYS   3          1HD       LYS   3  17.679  14.079   9.406
   22   2HD   LYS   3          2HD       LYS   3  18.141  12.627  10.296
   23   1HE   LYS   3          1HE       LYS   3  20.452  12.823   9.357
   24   2HE   LYS   3          2HE       LYS   3  19.972  14.348   8.586
   25   1HZ   LYS   3          1HZ       LYS   3  19.126  14.980  10.892
   26   2HZ   LYS   3          2HZ       LYS   3  20.808  15.003  10.650
   27   3HZ   LYS   3          3HZ       LYS   3  20.083  13.704  11.470
   28    H    ALA   4           H        ALA   4  16.014   8.348   6.113
   29    HA   ALA   4           HA       ALA   4  13.284   8.156   6.333
   30   1HB   ALA   4          1HB       ALA   4  13.757   6.054   5.628
   31   2HB   ALA   4          2HB       ALA   4  14.540   5.660   7.159
   32   3HB   ALA   4          3HB       ALA   4  15.460   6.443   5.873
   33    HA   PRO   5           HA       PRO   5  12.545   8.329  10.669
   34   1HB   PRO   5          1HB       PRO   5   9.887   7.662  10.611
   35   2HB   PRO   5          2HB       PRO   5  10.510   9.265  10.184
   36   1HG   PRO   5          1HG       PRO   5   9.557   7.083   8.425
   37   2HG   PRO   5          2HG       PRO   5   9.503   8.834   8.195
   38   1HD   PRO   5          1HD       PRO   5  11.319   7.116   6.988
   39   2HD   PRO   5          2HD       PRO   5  11.509   8.874   7.143
   40    H    ALA   6           H        ALA   6  11.919   6.876  12.431
   41    HA   ALA   6           HA       ALA   6  12.983   4.283  12.268
   42   1HB   ALA   6          1HB       ALA   6  12.524   5.660  14.308
   43   2HB   ALA   6          2HB       ALA   6  11.924   4.008  14.456
   44   3HB   ALA   6          3HB       ALA   6  10.804   5.325  14.106
   45    H    ASP   7           H        ASP   7  11.564   2.294  12.860
   46    HA   ASP   7           HA       ASP   7   9.608   1.909  10.701
   47   1HB   ASP   7          1HB       ASP   7  10.432  -0.004  12.891
   48   2HB   ASP   7          2HB       ASP   7   9.893  -0.387  11.261
   49    H    GLY   8           H        GLY   8   7.466   1.010  11.220
   50   1HA   GLY   8          1HA       GLY   8   5.644   0.578  12.753
   51   2HA   GLY   8          2HA       GLY   8   6.483   1.543  13.967
   52    H    LEU   9           H        LEU   9   6.414   2.901  10.805
   53    HA   LEU   9           HA       LEU   9   5.000   5.244  11.654
   54   1HB   LEU   9          1HB       LEU   9   6.428   4.306   9.403
   55   2HB   LEU   9          2HB       LEU   9   4.823   4.736   8.806
   56    HG   LEU   9           HG       LEU   9   6.071   6.639  10.713
   57   1HD1  LEU   9          1HD1      LEU   9   7.157   5.992   7.983
   58   2HD1  LEU   9          2HD1      LEU   9   8.037   6.362   9.468
   59   3HD1  LEU   9          3HD1      LEU   9   7.224   7.652   8.580
   60   1HD2  LEU   9          1HD2      LEU   9   4.772   7.154   8.029
   61   2HD2  LEU   9          2HD2      LEU   9   4.912   8.255   9.398
   62   3HD2  LEU   9          3HD2      LEU   9   3.815   6.872   9.487
   63    H    LYS  10           H        LYS  10   2.823   5.565  11.797
   64    HA   LYS  10           HA       LYS  10   1.055   3.363  10.827
   65   1HB   LYS  10          1HB       LYS  10   1.115   5.268  13.071
   66   2HB   LYS  10          2HB       LYS  10  -0.480   5.027  12.359
   67   1HG   LYS  10          1HG       LYS  10   0.098   2.493  12.478
   68   2HG   LYS  10          2HG       LYS  10   1.331   2.991  13.638
   69   1HD   LYS  10          1HD       LYS  10  -0.333   3.998  15.077
   70   2HD   LYS  10          2HD       LYS  10  -1.596   3.737  13.874
   71   1HE   LYS  10          1HE       LYS  10  -1.898   1.575  14.520
   72   2HE   LYS  10          2HE       LYS  10  -0.150   1.273  14.590
   73   1HZ   LYS  10          1HZ       LYS  10  -0.065   2.564  16.650
   74   2HZ   LYS  10          2HZ       LYS  10  -1.090   1.219  16.809
   75   3HZ   LYS  10          3HZ       LYS  10  -1.747   2.772  16.601
   76    H    MET  11           H        MET  11   0.271   3.767   8.827
   77    HA   MET  11           HA       MET  11  -0.273   6.520   7.899
   78   1HB   MET  11          1HB       MET  11   0.328   3.948   6.788
   79   2HB   MET  11          2HB       MET  11  -1.244   4.445   6.161
   80   1HG   MET  11          1HG       MET  11   1.384   5.927   5.955
   81   2HG   MET  11          2HG       MET  11   0.374   5.333   4.642
   82   1HE   MET  11          1HE       MET  11   0.329   8.879   3.981
   83   2HE   MET  11          2HE       MET  11  -0.847   7.775   3.273
   84   3HE   MET  11          3HE       MET  11   0.789   7.213   3.604
   85    H    ASP  12           H        ASP  12  -2.047   7.167   9.225
   86    HA   ASP  12           HA       ASP  12  -4.456   5.396   9.203
   87   1HB   ASP  12          1HB       ASP  12  -5.143   7.170  10.967
   88   2HB   ASP  12          2HB       ASP  12  -3.853   6.044  11.370
   89    H    LYS  13           H        LYS  13  -3.534   7.214   6.954
   90    HA   LYS  13           HA       LYS  13  -5.116   9.517   6.649
   91   1HB   LYS  13          1HB       LYS  13  -4.188   7.340   4.767
   92   2HB   LYS  13          2HB       LYS  13  -4.955   8.816   4.193
   93   1HG   LYS  13          1HG       LYS  13  -2.510   8.761   5.981
   94   2HG   LYS  13          2HG       LYS  13  -2.443   8.941   4.228
   95   1HD   LYS  13          1HD       LYS  13  -3.829  10.982   4.388
   96   2HD   LYS  13          2HD       LYS  13  -3.882  10.801   6.143
   97   1HE   LYS  13          1HE       LYS  13  -1.291  11.055   4.578
   98   2HE   LYS  13          2HE       LYS  13  -2.113  12.425   5.352
   99   1HZ   LYS  13          1HZ       LYS  13  -2.167  10.986   7.412
  100   2HZ   LYS  13          2HZ       LYS  13  -0.644  11.596   6.971
  101   3HZ   LYS  13          3HZ       LYS  13  -1.044   9.979   6.637
  102    H    THR  14           H        THR  14  -5.987   6.126   6.403
  103    HA   THR  14           HA       THR  14  -8.831   6.904   5.816
  104    HB   THR  14           HB       THR  14  -8.909   4.509   4.928
  105    HG1  THR  14           1HG      THR  14  -7.209   3.425   5.485
  106   1HG2  THR  14          1HG2      THR  14  -7.906   5.119   2.813
  107   2HG2  THR  14          2HG2      THR  14  -6.901   6.341   3.595
  108   3HG2  THR  14          3HG2      THR  14  -8.649   6.562   3.507
  109    H    LYS  15           H        LYS  15 -10.342   5.001   6.641
  110    HA   LYS  15           HA       LYS  15 -10.214   4.928   9.498
  111   1HB   LYS  15          1HB       LYS  15 -11.846   3.885   7.285
  112   2HB   LYS  15          2HB       LYS  15 -11.856   2.843   8.710
  113   1HG   LYS  15          1HG       LYS  15 -13.196   4.277   9.809
  114   2HG   LYS  15          2HG       LYS  15 -12.071   5.605   9.519
  115   1HD   LYS  15          1HD       LYS  15 -13.044   5.764   7.175
  116   2HD   LYS  15          2HD       LYS  15 -14.305   4.653   7.713
  117   1HE   LYS  15          1HE       LYS  15 -14.804   6.266   9.604
  118   2HE   LYS  15          2HE       LYS  15 -13.704   7.416   8.817
  119   1HZ   LYS  15          1HZ       LYS  15 -15.991   7.713   8.048
  120   2HZ   LYS  15          2HZ       LYS  15 -16.034   6.099   7.520
  121   3HZ   LYS  15          3HZ       LYS  15 -14.980   7.211   6.782
  122    H    GLN  16           H        GLN  16  -8.811   2.902   7.040
  123    HA   GLN  16           HA       GLN  16  -8.108   0.810   9.058
  124   1HB   GLN  16          1HB       GLN  16  -8.136   0.963   6.031
  125   2HB   GLN  16          2HB       GLN  16  -7.425  -0.397   6.901
  126   1HG   GLN  16          1HG       GLN  16  -9.810  -0.252   8.166
  127   2HG   GLN  16          2HG       GLN  16 -10.280   0.359   6.579
  128   1HE2  GLN  16          2HE2      GLN  16  -8.331  -1.218   5.056
  129   2HE2  GLN  16          1HE2      GLN  16  -8.836  -2.836   5.133
  130    HA   PRO  17           HA       PRO  17  -4.343   3.454   8.642
  131   1HB   PRO  17          1HB       PRO  17  -3.571   3.129  11.254
  132   2HB   PRO  17          2HB       PRO  17  -4.707   4.386  10.723
  133   1HG   PRO  17          1HG       PRO  17  -5.273   1.729  11.958
  134   2HG   PRO  17          2HG       PRO  17  -6.017   3.303  12.285
  135   1HD   PRO  17          1HD       PRO  17  -7.222   1.447  10.747
  136   2HD   PRO  17          2HD       PRO  17  -7.391   3.190  10.433
  137    H    VAL  18           H        VAL  18  -2.558   2.461   7.825
  138    HA   VAL  18           HA       VAL  18  -1.892  -0.301   8.764
  139    HB   VAL  18           HB       VAL  18  -1.559   1.237   6.182
  140   1HG1  VAL  18          1HG1      VAL  18  -0.407  -1.500   6.761
  141   2HG1  VAL  18          2HG1      VAL  18   0.548  -0.020   6.837
  142   3HG1  VAL  18          3HG1      VAL  18  -0.181  -0.522   5.312
  143   1HG2  VAL  18          1HG2      VAL  18  -3.169  -1.048   7.196
  144   2HG2  VAL  18          2HG2      VAL  18  -2.549  -1.207   5.553
  145   3HG2  VAL  18          3HG2      VAL  18  -3.576   0.162   5.979
  146    H    VAL  19           H        VAL  19   0.104  -0.591   9.722
  147    HA   VAL  19           HA       VAL  19   1.789   1.775  10.183
  148    HB   VAL  19           HB       VAL  19   1.906  -1.130  11.048
  149   1HG1  VAL  19          1HG1      VAL  19   3.633  -0.480  12.604
  150   2HG1  VAL  19          2HG1      VAL  19   3.472   1.217  12.153
  151   3HG1  VAL  19          3HG1      VAL  19   4.139   0.060  11.003
  152   1HG2  VAL  19          1HG2      VAL  19   1.369   1.165  12.887
  153   2HG2  VAL  19          2HG2      VAL  19   0.753  -0.486  12.946
  154   3HG2  VAL  19          3HG2      VAL  19   0.072   0.668  11.800
  155    H    PHE  20           H        PHE  20   3.537   2.259   8.869
  156    HA   PHE  20           HA       PHE  20   4.519   0.130   7.019
  157   1HB   PHE  20          1HB       PHE  20   3.772   2.276   6.050
  158   2HB   PHE  20          2HB       PHE  20   4.928   3.144   7.058
  159    HD1  PHE  20           HD1      PHE  20   4.914   0.164   4.781
  160    HD2  PHE  20           HD2      PHE  20   6.950   3.727   6.045
  161    HE1  PHE  20           HE1      PHE  20   6.695  -0.259   3.111
  162    HE2  PHE  20           HE2      PHE  20   8.725   3.301   4.369
  163    HZ   PHE  20           HZ       PHE  20   8.601   1.309   2.905
  164    H    ASN  21           H        ASN  21   6.297  -0.951   7.790
  165    HA   ASN  21           HA       ASN  21   8.121   0.384   9.701
  166   1HB   ASN  21          1HB       ASN  21   7.128  -2.245   9.111
  167   2HB   ASN  21          2HB       ASN  21   8.882  -2.259   8.989
  168   1HD2  ASN  21          2HD2      ASN  21   6.516  -0.640  11.184
  169   2HD2  ASN  21          1HD2      ASN  21   7.309  -1.099  12.614
  170    H    HIS  22           H        HIS  22   9.372   1.804   8.375
  171    HA   HIS  22           HA       HIS  22  10.356   1.387   5.793
  172   1HB   HIS  22          1HB       HIS  22  11.334   2.786   8.263
  173   2HB   HIS  22          2HB       HIS  22  12.385   2.730   6.849
  174    HD1  HIS  22           HD1      HIS  22   9.590   4.568   8.273
  175    HD2  HIS  22           HD2      HIS  22  10.976   3.826   4.408
  176    HE1  HIS  22           HE1      HIS  22   8.597   6.367   6.800
  177    H    SER  23           H        SER  23  11.549   0.054   8.857
  178    HA   SER  23           HA       SER  23  14.053  -0.964   8.125
  179   1HB   SER  23          1HB       SER  23  13.238  -2.894   9.722
  180   2HB   SER  23          2HB       SER  23  13.382  -1.257  10.353
  181    HG   SER  23           HG       SER  23  11.368  -2.067  10.897
  182    H    THR  24           H        THR  24  10.831  -2.330   7.467
  183    HA   THR  24           HA       THR  24  11.863  -4.694   6.110
  184    HB   THR  24           HB       THR  24   9.148  -3.894   5.442
  185    HG1  THR  24           1HG      THR  24   9.869  -3.938   8.184
  186   1HG2  THR  24          1HG2      THR  24   9.194  -6.150   5.527
  187   2HG2  THR  24          2HG2      THR  24   9.056  -5.969   7.276
  188   3HG2  THR  24          3HG2      THR  24  10.644  -6.159   6.531
  189    H    HIS  25           H        HIS  25  11.715  -1.444   5.271
  190    HA   HIS  25           HA       HIS  25  11.638  -2.090   2.355
  191   1HB   HIS  25          1HB       HIS  25  10.779   0.386   3.876
  192   2HB   HIS  25          2HB       HIS  25  10.617   0.133   2.143
  193    HD1  HIS  25           HD1      HIS  25   9.246  -1.025   5.439
  194    HD2  HIS  25           HD2      HIS  25   8.544  -1.654   1.382
  195    HE1  HIS  25           HE1      HIS  25   7.078  -2.321   5.282
  196    H    LYS  26           H        LYS  26  13.545  -0.954   4.932
  197    HA   LYS  26           HA       LYS  26  15.086   1.148   3.912
  198   1HB   LYS  26          1HB       LYS  26  16.870   0.180   5.350
  199   2HB   LYS  26          2HB       LYS  26  15.301   0.137   6.152
  200   1HG   LYS  26          1HG       LYS  26  15.056  -2.235   5.210
  201   2HG   LYS  26          2HG       LYS  26  16.776  -2.144   4.832
  202   1HD   LYS  26          1HD       LYS  26  16.014  -1.321   7.578
  203   2HD   LYS  26          2HD       LYS  26  15.833  -3.037   7.211
  204   1HE   LYS  26          1HE       LYS  26  18.091  -3.367   7.118
  205   2HE   LYS  26          2HE       LYS  26  18.364  -1.845   6.245
  206   1HZ   LYS  26          1HZ       LYS  26  19.239  -1.627   8.457
  207   2HZ   LYS  26          2HZ       LYS  26  17.777  -2.150   9.143
  208   3HZ   LYS  26          3HZ       LYS  26  17.853  -0.659   8.332
  209    H    ALA  27           H        ALA  27  14.924  -2.166   2.850
  210    HA   ALA  27           HA       ALA  27  17.385  -1.932   1.210
  211   1HB   ALA  27          1HB       ALA  27  17.173  -4.269   1.011
  212   2HB   ALA  27          2HB       ALA  27  15.423  -4.220   1.230
  213   3HB   ALA  27          3HB       ALA  27  16.493  -3.961   2.608
  214    H    VAL  28           H        VAL  28  14.186  -1.023   0.931
  215    HA   VAL  28           HA       VAL  28  13.767  -1.785  -1.880
  216    HB   VAL  28           HB       VAL  28  12.308  -0.063   0.138
  217   1HG1  VAL  28          1HG1      VAL  28  11.518  -0.818  -2.686
  218   2HG1  VAL  28          2HG1      VAL  28  11.816   0.810  -2.076
  219   3HG1  VAL  28          3HG1      VAL  28  10.426  -0.106  -1.499
  220   1HG2  VAL  28          1HG2      VAL  28  10.953  -1.906   0.517
  221   2HG2  VAL  28          2HG2      VAL  28  12.482  -2.712   0.168
  222   3HG2  VAL  28          3HG2      VAL  28  11.248  -2.579  -1.086
  223    H    LYS  29           H        LYS  29  13.075   0.177  -3.349
  224    HA   LYS  29           HA       LYS  29  15.351   2.063  -3.313
  225   1HB   LYS  29          1HB       LYS  29  13.630   0.821  -5.240
  226   2HB   LYS  29          2HB       LYS  29  13.523   2.574  -5.413
  227   1HG   LYS  29          1HG       LYS  29  15.377   2.119  -6.740
  228   2HG   LYS  29          2HG       LYS  29  16.138   2.468  -5.186
  229   1HD   LYS  29          1HD       LYS  29  16.871   0.340  -4.944
  230   2HD   LYS  29          2HD       LYS  29  15.331  -0.339  -5.473
  231   1HE   LYS  29          1HE       LYS  29  16.038  -0.560  -7.638
  232   2HE   LYS  29          2HE       LYS  29  16.914   0.984  -7.606
  233   1HZ   LYS  29          1HZ       LYS  29  18.365  -0.302  -5.868
  234   2HZ   LYS  29          2HZ       LYS  29  18.661  -0.469  -7.532
  235   3HZ   LYS  29          3HZ       LYS  29  17.789  -1.665  -6.697
  236    H    CYS  30           H        CYS  30  14.980   3.681  -1.895
  237    HA   CYS  30           HA       CYS  30  12.614   4.800  -0.948
  238   1HB   CYS  30          1HB       CYS  30  15.280   6.047  -1.671
  239   2HB   CYS  30          2HB       CYS  30  14.032   6.927  -0.791
  240    H    GLY  31           H        GLY  31  14.006   5.063  -4.127
  241   1HA   GLY  31          1HA       GLY  31  12.278   7.314  -4.912
  242   2HA   GLY  31          2HA       GLY  31  13.428   6.477  -5.959
  243    H    ASP  32           H        ASP  32  12.073   3.887  -4.765
  244    HA   ASP  32           HA       ASP  32  10.188   3.583  -6.990
  245   1HB   ASP  32          1HB       ASP  32  11.817   1.964  -5.401
  246   2HB   ASP  32          2HB       ASP  32  10.185   1.531  -4.900
  247    H    CYS  33           H        CYS  33  10.093   4.242  -3.554
  248    HA   CYS  33           HA       CYS  33   7.117   4.039  -3.485
  249   1HB   CYS  33          1HB       CYS  33   9.393   4.190  -1.523
  250   2HB   CYS  33          2HB       CYS  33   7.793   4.702  -0.993
  251    H    HIS  34           H        HIS  34   9.690   6.331  -2.490
  252    HA   HIS  34           HA       HIS  34   7.825   8.622  -2.677
  253   1HB   HIS  34          1HB       HIS  34  10.736   8.232  -1.913
  254   2HB   HIS  34          2HB       HIS  34   9.958   9.809  -1.932
  255    HD1  HIS  34           HD1      HIS  34   7.500   9.703  -0.477
  256    HD2  HIS  34           HD2      HIS  34  10.583   7.105   0.579
  257    HE1  HIS  34           HE1      HIS  34   7.041   8.968   1.907
  258    H    HIS  35           H        HIS  35   8.378   7.202  -5.153
  259    HA   HIS  35           HA       HIS  35  10.350   7.894  -6.865
  260   1HB   HIS  35          1HB       HIS  35   8.526   8.126  -8.599
  261   2HB   HIS  35          2HB       HIS  35   8.373   6.717  -7.567
  262    HD1  HIS  35           HD1      HIS  35   7.053  10.199  -7.915
  263    HD2  HIS  35           HD2      HIS  35   6.010   6.621  -6.084
  264    HE1  HIS  35           HE1      HIS  35   4.715  10.531  -7.012
  265    HA   PRO  36           HA       PRO  36  10.804  12.219  -7.283
  266   1HB   PRO  36          1HB       PRO  36  11.074  12.549  -9.995
  267   2HB   PRO  36          2HB       PRO  36  12.346  11.857  -8.966
  268   1HG   PRO  36          1HG       PRO  36  10.353  10.469 -10.697
  269   2HG   PRO  36          2HG       PRO  36  12.073  10.122 -10.457
  270   1HD   PRO  36          1HD       PRO  36  10.128   8.696  -9.244
  271   2HD   PRO  36          2HD       PRO  36  11.708   8.986  -8.484
  272    H    VAL  37           H        VAL  37   9.232  13.760  -7.109
  273    HA   VAL  37           HA       VAL  37   6.773  13.467  -8.791
  274    HB   VAL  37           HB       VAL  37   7.382  14.284  -5.973
  275   1HG1  VAL  37          1HG1      VAL  37   5.123  15.346  -7.672
  276   2HG1  VAL  37          2HG1      VAL  37   6.189  16.234  -6.583
  277   3HG1  VAL  37          3HG1      VAL  37   4.947  15.168  -5.926
  278   1HG2  VAL  37          1HG2      VAL  37   6.278  12.358  -5.616
  279   2HG2  VAL  37          2HG2      VAL  37   6.023  12.178  -7.352
  280   3HG2  VAL  37          3HG2      VAL  37   4.839  13.044  -6.371
  281    H    ASN  38           H        ASN  38   9.412  15.004  -9.252
  282    HA   ASN  38           HA       ASN  38   8.369  17.233 -10.684
  283   1HB   ASN  38          1HB       ASN  38   7.894  17.779  -8.187
  284   2HB   ASN  38          2HB       ASN  38   9.613  18.057  -8.056
  285   1HD2  ASN  38          2HD2      ASN  38   7.119  19.955  -8.127
  286   2HD2  ASN  38          1HD2      ASN  38   7.586  21.148  -9.241
  287    H    GLY  39           H        GLY  39  11.050  17.709  -8.496
  288   1HA   GLY  39          1HA       GLY  39  12.955  17.155 -10.728
  289   2HA   GLY  39          2HA       GLY  39  13.188  18.480  -9.577
  290    H    LYS  40           H        LYS  40  11.765  16.111  -7.838
  291    HA   LYS  40           HA       LYS  40  14.106  14.398  -7.337
  292   1HB   LYS  40          1HB       LYS  40  14.348  15.249  -4.999
  293   2HB   LYS  40          2HB       LYS  40  14.713  16.488  -6.201
  294   1HG   LYS  40          1HG       LYS  40  11.935  16.660  -5.766
  295   2HG   LYS  40          2HG       LYS  40  12.653  16.482  -4.164
  296   1HD   LYS  40          1HD       LYS  40  13.779  18.426  -6.180
  297   2HD   LYS  40          2HD       LYS  40  12.449  18.878  -5.113
  298   1HE   LYS  40          1HE       LYS  40  14.026  17.903  -3.224
  299   2HE   LYS  40          2HE       LYS  40  15.300  18.246  -4.412
  300   1HZ   LYS  40          1HZ       LYS  40  14.604  20.145  -2.881
  301   2HZ   LYS  40          2HZ       LYS  40  13.178  20.213  -3.801
  302   3HZ   LYS  40          3HZ       LYS  40  14.684  20.479  -4.542
  303    H    GLU  41           H        GLU  41  13.541  13.103  -5.163
  304    HA   GLU  41           HA       GLU  41  10.796  12.066  -5.531
  305   1HB   GLU  41          1HB       GLU  41  13.306  11.237  -4.090
  306   2HB   GLU  41          2HB       GLU  41  11.784  10.393  -3.816
  307   1HG   GLU  41          1HG       GLU  41  11.851   9.379  -5.850
  308   2HG   GLU  41          2HG       GLU  41  12.411  10.845  -6.656
  309    H    ASP  42           H        ASP  42   9.191  13.024  -4.321
  310    HA   ASP  42           HA       ASP  42   9.618  14.667  -2.030
  311   1HB   ASP  42          1HB       ASP  42   7.313  13.134  -3.207
  312   2HB   ASP  42          2HB       ASP  42   7.121  13.979  -1.670
  313    H    TYR  43           H        TYR  43  10.759  13.771  -0.327
  314    HA   TYR  43           HA       TYR  43  10.364  10.988   0.504
  315   1HB   TYR  43          1HB       TYR  43  11.924  13.336   1.633
  316   2HB   TYR  43          2HB       TYR  43  12.042  11.686   2.240
  317    HD1  TYR  43           HD1      TYR  43  12.274   9.892   0.153
  318    HD2  TYR  43           HD2      TYR  43  13.635  13.968   0.198
  319    HE1  TYR  43           HE1      TYR  43  13.928   9.361  -1.615
  320    HE2  TYR  43           HE2      TYR  43  15.289  13.436  -1.571
  321    HH   TYR  43           HH       TYR  43  16.078  11.882  -2.939
  322    H    GLN  44           H        GLN  44   7.870  11.931   0.749
  323    HA   GLN  44           HA       GLN  44   7.540  12.417   3.690
  324   1HB   GLN  44          1HB       GLN  44   5.606  13.926   2.942
  325   2HB   GLN  44          2HB       GLN  44   7.228  14.538   2.616
  326   1HG   GLN  44          1HG       GLN  44   7.104  13.733   0.309
  327   2HG   GLN  44          2HG       GLN  44   5.516  13.032   0.618
  328   1HE2  GLN  44          2HE2      GLN  44   6.708  16.211   1.767
  329   2HE2  GLN  44          1HE2      GLN  44   5.551  17.124   0.926
  330    H    LYS  45           H        LYS  45   5.266  11.865   4.398
  331    HA   LYS  45           HA       LYS  45   4.496   9.268   3.972
  332   1HB   LYS  45          1HB       LYS  45   3.047  11.800   4.636
  333   2HB   LYS  45          2HB       LYS  45   2.106  10.325   4.419
  334   1HG   LYS  45          1HG       LYS  45   3.165   9.232   6.207
  335   2HG   LYS  45          2HG       LYS  45   4.547  10.328   6.179
  336   1HD   LYS  45          1HD       LYS  45   2.707  12.150   6.725
  337   2HD   LYS  45          2HD       LYS  45   1.815  10.755   7.332
  338   1HE   LYS  45          1HE       LYS  45   4.405  10.399   8.342
  339   2HE   LYS  45          2HE       LYS  45   4.078  12.132   8.539
  340   1HZ   LYS  45          1HZ       LYS  45   3.136  11.008  10.404
  341   2HZ   LYS  45          2HZ       LYS  45   2.356   9.874   9.408
  342   3HZ   LYS  45          3HZ       LYS  45   1.854  11.496   9.408
  343    H    CYS  46           H        CYS  46   3.145   8.154   2.536
  344    HA   CYS  46           HA       CYS  46   3.174   8.840  -0.194
  345   1HB   CYS  46          1HB       CYS  46   1.270   7.082   1.365
  346   2HB   CYS  46          2HB       CYS  46   1.559   6.980  -0.365
  347    H    ALA  47           H        ALA  47   0.566   9.274   2.185
  348    HA   ALA  47           HA       ALA  47  -1.012  10.792   0.160
  349   1HB   ALA  47          1HB       ALA  47  -1.696   9.761   2.918
  350   2HB   ALA  47          2HB       ALA  47  -2.004   8.892   1.415
  351   3HB   ALA  47          3HB       ALA  47  -2.837  10.411   1.745
  352    H    THR  48           H        THR  48   1.075  12.325   0.877
  353    HA   THR  48           HA       THR  48   1.060  13.820   3.232
  354    HB   THR  48           HB       THR  48   1.471  15.169   0.589
  355    HG1  THR  48           1HG      THR  48   2.749  12.858   1.538
  356   1HG2  THR  48          1HG2      THR  48   2.722  15.119   3.310
  357   2HG2  THR  48          2HG2      THR  48   2.260  16.501   2.315
  358   3HG2  THR  48          3HG2      THR  48   3.715  15.583   1.928
  359    H    ALA  49           H        ALA  49   0.492  16.399   2.913
  360    HA   ALA  49           HA       ALA  49  -2.418  16.518   2.998
  361   1HB   ALA  49          1HB       ALA  49  -1.214  17.915   4.480
  362   2HB   ALA  49          2HB       ALA  49  -1.792  19.022   3.235
  363   3HB   ALA  49          3HB       ALA  49  -0.121  18.460   3.208
  364    H    GLY  50           H        GLY  50  -2.175  15.602   0.590
  365   1HA   GLY  50          1HA       GLY  50  -3.505  16.971  -1.270
  366   2HA   GLY  50          2HA       GLY  50  -1.948  17.800  -1.393
  367    H    CYS  51           H        CYS  51  -0.921  14.987  -0.462
  368    HA   CYS  51           HA       CYS  51  -0.171  14.050  -3.105
  369   1HB   CYS  51          1HB       CYS  51   0.481  13.845  -0.273
  370   2HB   CYS  51          2HB       CYS  51   0.606  12.299  -1.052
  371    H    HIS  52           H        HIS  52  -0.464  11.205  -1.543
  372    HA   HIS  52           HA       HIS  52  -2.898  10.441  -2.970
  373   1HB   HIS  52          1HB       HIS  52  -0.990   9.058  -1.071
  374   2HB   HIS  52          2HB       HIS  52  -2.333   8.234  -1.833
  375    HD1  HIS  52           HD1      HIS  52  -2.323   8.634  -4.568
  376    HD2  HIS  52           HD2      HIS  52   1.310   8.876  -2.578
  377    HE1  HIS  52           HE1      HIS  52  -0.527   8.326  -6.337
  378    H    ASP  53           H        ASP  53  -3.813  12.374  -1.353
  379    HA   ASP  53           HA       ASP  53  -4.727  11.134   1.198
  380   1HB   ASP  53          1HB       ASP  53  -5.286  13.482   1.756
  381   2HB   ASP  53          2HB       ASP  53  -3.609  13.331   1.230
  382    H    ASN  54           H        ASN  54  -5.963  10.550  -1.589
  383    HA   ASN  54           HA       ASN  54  -8.594  11.842  -1.448
  384   1HB   ASN  54          1HB       ASN  54  -7.353  11.018  -3.522
  385   2HB   ASN  54          2HB       ASN  54  -7.762   9.389  -3.005
  386   1HD2  ASN  54          2HD2      ASN  54  -8.827  11.768  -5.036
  387   2HD2  ASN  54          1HD2      ASN  54 -10.487  11.415  -5.048
  388    H    MET  55           H        MET  55  -9.702  11.260   0.426
  389    HA   MET  55           HA       MET  55  -9.608   8.540   1.488
  390   1HB   MET  55          1HB       MET  55 -11.061  11.113   2.103
  391   2HB   MET  55          2HB       MET  55 -11.446   9.626   2.972
  392   1HG   MET  55          1HG       MET  55  -9.734  10.174   4.348
  393   2HG   MET  55          2HG       MET  55  -8.680   9.669   3.028
  394   1HE   MET  55          1HE       MET  55  -6.832  10.810   2.878
  395   2HE   MET  55          2HE       MET  55  -6.926  11.557   4.470
  396   3HE   MET  55          3HE       MET  55  -6.515  12.540   3.067
  397    H    ASP  56           H        ASP  56 -10.960   9.457  -1.273
  398    HA   ASP  56           HA       ASP  56 -13.722   8.554  -0.920
  399   1HB   ASP  56          1HB       ASP  56 -12.458  10.156  -2.675
  400   2HB   ASP  56          2HB       ASP  56 -12.368   8.644  -3.580
  401    H    LYS  57           H        LYS  57 -10.659   7.063  -1.388
  402    HA   LYS  57           HA       LYS  57 -10.061   4.798  -1.715
  403   1HB   LYS  57          1HB       LYS  57 -12.997   4.416  -1.078
  404   2HB   LYS  57          2HB       LYS  57 -11.720   3.219  -0.874
  405   1HG   LYS  57          1HG       LYS  57 -10.698   4.464   0.881
  406   2HG   LYS  57          2HG       LYS  57 -11.645   5.904   0.513
  407   1HD   LYS  57          1HD       LYS  57 -12.627   3.308   1.721
  408   2HD   LYS  57          2HD       LYS  57 -12.653   4.913   2.451
  409   1HE   LYS  57          1HE       LYS  57 -14.206   5.645   0.583
  410   2HE   LYS  57          2HE       LYS  57 -14.315   3.939   0.106
  411   1HZ   LYS  57          1HZ       LYS  57 -15.991   4.031   1.641
  412   2HZ   LYS  57          2HZ       LYS  57 -15.240   5.241   2.568
  413   3HZ   LYS  57          3HZ       LYS  57 -14.698   3.634   2.664
  414    H    LYS  58           H        LYS  58 -11.531   6.515  -3.900
  415    HA   LYS  58           HA       LYS  58 -12.014   4.203  -5.748
  416   1HB   LYS  58          1HB       LYS  58 -13.618   6.758  -5.411
  417   2HB   LYS  58          2HB       LYS  58 -13.907   5.551  -6.666
  418   1HG   LYS  58          1HG       LYS  58 -13.888   4.838  -3.728
  419   2HG   LYS  58          2HG       LYS  58 -15.355   5.363  -4.557
  420   1HD   LYS  58          1HD       LYS  58 -13.922   3.324  -6.073
  421   2HD   LYS  58          2HD       LYS  58 -14.370   2.756  -4.465
  422   1HE   LYS  58          1HE       LYS  58 -16.428   2.357  -5.361
  423   2HE   LYS  58          2HE       LYS  58 -16.648   4.118  -5.329
  424   1HZ   LYS  58          1HZ       LYS  58 -15.301   2.635  -7.524
  425   2HZ   LYS  58          2HZ       LYS  58 -15.665   4.295  -7.491
  426   3HZ   LYS  58          3HZ       LYS  58 -16.916   3.150  -7.577
  427    H    ASP  59           H        ASP  59 -10.338   7.093  -5.142
  428    HA   ASP  59           HA       ASP  59 -10.148   8.220  -7.777
  429   1HB   ASP  59          1HB       ASP  59  -9.494   9.515  -5.885
  430   2HB   ASP  59          2HB       ASP  59  -8.431   8.241  -5.288
  431    H    LYS  60           H        LYS  60  -9.569   6.816  -9.438
  432    HA   LYS  60           HA       LYS  60  -7.407   4.838  -9.044
  433   1HB   LYS  60          1HB       LYS  60  -9.724   5.191 -10.667
  434   2HB   LYS  60          2HB       LYS  60  -8.335   5.098 -11.751
  435   1HG   LYS  60          1HG       LYS  60  -8.747   3.126  -9.498
  436   2HG   LYS  60          2HG       LYS  60  -9.422   2.867 -11.107
  437   1HD   LYS  60          1HD       LYS  60  -6.502   3.524 -10.764
  438   2HD   LYS  60          2HD       LYS  60  -7.076   1.867 -10.577
  439   1HE   LYS  60          1HE       LYS  60  -7.753   3.534 -13.017
  440   2HE   LYS  60          2HE       LYS  60  -6.315   2.496 -12.939
  441   1HZ   LYS  60          1HZ       LYS  60  -9.157   1.707 -12.674
  442   2HZ   LYS  60          2HZ       LYS  60  -7.896   0.711 -12.120
  443   3HZ   LYS  60          3HZ       LYS  60  -8.002   1.115 -13.767
  444    H    SER  61           H        SER  61  -7.030   7.924  -9.173
  445    HA   SER  61           HA       SER  61  -5.269   8.132 -11.564
  446   1HB   SER  61          1HB       SER  61  -6.954   9.856  -9.992
  447   2HB   SER  61          2HB       SER  61  -5.314  10.499  -9.984
  448    HG   SER  61           HG       SER  61  -5.532   9.903 -12.392
  449    H    ALA  62           H        ALA  62  -3.441  10.015 -10.526
  450    HA   ALA  62           HA       ALA  62  -1.714   8.233  -8.904
  451   1HB   ALA  62          1HB       ALA  62  -1.440  10.253 -10.943
  452   2HB   ALA  62          2HB       ALA  62  -0.215   9.143 -10.326
  453   3HB   ALA  62          3HB       ALA  62  -0.467  10.703  -9.543
  454    H    LYS  63           H        LYS  63  -4.109  10.046  -7.942
  455    HA   LYS  63           HA       LYS  63  -2.587  11.377  -5.720
  456   1HB   LYS  63          1HB       LYS  63  -4.143  12.517  -7.705
  457   2HB   LYS  63          2HB       LYS  63  -5.277  12.364  -6.359
  458   1HG   LYS  63          1HG       LYS  63  -4.333  14.394  -5.800
  459   2HG   LYS  63          2HG       LYS  63  -3.185  13.325  -4.993
  460   1HD   LYS  63          1HD       LYS  63  -2.326  13.519  -7.680
  461   2HD   LYS  63          2HD       LYS  63  -2.715  15.161  -7.168
  462   1HE   LYS  63          1HE       LYS  63  -1.373  14.499  -4.993
  463   2HE   LYS  63          2HE       LYS  63  -0.652  13.276  -6.058
  464   1HZ   LYS  63          1HZ       LYS  63   0.306  14.831  -7.362
  465   2HZ   LYS  63          2HZ       LYS  63   0.205  15.791  -5.964
  466   3HZ   LYS  63          3HZ       LYS  63  -0.967  15.937  -7.185
  467    H    GLY  64           H        GLY  64  -4.857   8.998  -6.571
  468   1HA   GLY  64          1HA       GLY  64  -6.429   9.224  -4.111
  469   2HA   GLY  64          2HA       GLY  64  -6.634   7.996  -5.349
  470    H    TYR  65           H        TYR  65  -5.979   8.209  -2.256
  471    HA   TYR  65           HA       TYR  65  -3.553   6.844  -1.738
  472   1HB   TYR  65          1HB       TYR  65  -5.465   7.963  -0.268
  473   2HB   TYR  65          2HB       TYR  65  -6.076   6.312  -0.199
  474    HD1  TYR  65           HD1      TYR  65  -2.468   6.922  -0.539
  475    HD2  TYR  65           HD2      TYR  65  -5.673   6.182   2.224
  476    HE1  TYR  65           HE1      TYR  65  -0.822   6.372   1.225
  477    HE2  TYR  65           HE2      TYR  65  -4.021   5.634   3.988
  478    HH   TYR  65           HH       TYR  65  -1.009   4.808   3.484
  479    H    TYR  66           H        TYR  66  -6.818   5.394  -1.752
  480    HA   TYR  66           HA       TYR  66  -6.300   2.709  -1.660
  481   1HB   TYR  66          1HB       TYR  66  -8.417   4.275  -2.175
  482   2HB   TYR  66          2HB       TYR  66  -8.143   3.655  -3.802
  483    HD1  TYR  66           HD1      TYR  66  -9.156   2.849  -0.394
  484    HD2  TYR  66           HD2      TYR  66  -8.254   1.227  -4.262
  485    HE1  TYR  66           HE1      TYR  66 -10.245   0.715   0.243
  486    HE2  TYR  66           HE2      TYR  66  -9.340  -0.909  -3.625
  487    HH   TYR  66           HH       TYR  66 -11.413  -1.265  -1.220
  488    H    HIS  67           H        HIS  67  -6.734   4.271  -4.836
  489    HA   HIS  67           HA       HIS  67  -5.889   2.331  -6.547
  490   1HB   HIS  67          1HB       HIS  67  -6.597   4.498  -7.306
  491   2HB   HIS  67          2HB       HIS  67  -5.221   5.280  -6.522
  492    HD1  HIS  67           HD1      HIS  67  -5.792   2.571  -9.139
  493    HD2  HIS  67           HD2      HIS  67  -3.091   5.620  -8.256
  494    HE1  HIS  67           HE1      HIS  67  -4.043   2.523 -10.962
  495    H    ALA  68           H        ALA  68  -3.450   4.806  -5.910
  496    HA   ALA  68           HA       ALA  68  -1.178   3.409  -6.612
  497   1HB   ALA  68          1HB       ALA  68  -1.907   5.670  -4.902
  498   2HB   ALA  68          2HB       ALA  68  -0.580   5.522  -6.052
  499   3HB   ALA  68          3HB       ALA  68  -0.393   4.911  -4.407
  500    H    MET  69           H        MET  69  -3.030   2.954  -3.642
  501    HA   MET  69           HA       MET  69  -0.870   1.413  -2.364
  502   1HB   MET  69          1HB       MET  69  -3.724   2.087  -1.634
  503   2HB   MET  69          2HB       MET  69  -2.600   1.248  -0.568
  504   1HG   MET  69          1HG       MET  69  -1.397   3.634  -1.706
  505   2HG   MET  69          2HG       MET  69  -2.875   4.020  -0.826
  506   1HE   MET  69          1HE       MET  69   0.231   5.021   0.565
  507   2HE   MET  69          2HE       MET  69   0.339   4.096  -0.932
  508   3HE   MET  69          3HE       MET  69   1.161   3.518   0.517
  509    H    HIS  70           H        HIS  70  -3.900   0.706  -4.076
  510    HA   HIS  70           HA       HIS  70  -3.415  -2.194  -3.503
  511   1HB   HIS  70          1HB       HIS  70  -5.925  -0.730  -4.382
  512   2HB   HIS  70          2HB       HIS  70  -5.826  -2.422  -3.890
  513    HD1  HIS  70           HD1      HIS  70  -5.918   1.049  -2.535
  514    HD2  HIS  70           HD2      HIS  70  -5.357  -2.811  -1.068
  515    HE1  HIS  70           HE1      HIS  70  -6.114   1.207  -0.014
  516    H    ASP  71           H        ASP  71  -3.231   0.164  -5.970
  517    HA   ASP  71           HA       ASP  71  -3.839  -1.699  -8.181
  518   1HB   ASP  71          1HB       ASP  71  -2.999   1.184  -7.884
  519   2HB   ASP  71          2HB       ASP  71  -3.073   0.412  -9.468
  520    H    LYS  72           H        LYS  72  -2.296  -2.876  -9.248
  521    HA   LYS  72           HA       LYS  72   0.506  -2.713  -8.344
  522   1HB   LYS  72          1HB       LYS  72   0.700  -4.794  -9.614
  523   2HB   LYS  72          2HB       LYS  72  -0.772  -4.845  -8.643
  524   1HG   LYS  72          1HG       LYS  72  -1.988  -3.934 -10.707
  525   2HG   LYS  72          2HG       LYS  72  -0.520  -4.313 -11.609
  526   1HD   LYS  72          1HD       LYS  72  -2.116  -6.297  -9.959
  527   2HD   LYS  72          2HD       LYS  72  -2.158  -6.169 -11.718
  528   1HE   LYS  72          1HE       LYS  72   0.418  -6.485 -11.605
  529   2HE   LYS  72          2HE       LYS  72   0.122  -7.078  -9.959
  530   1HZ   LYS  72          1HZ       LYS  72  -1.624  -8.537 -10.923
  531   2HZ   LYS  72          2HZ       LYS  72  -0.051  -8.929 -11.434
  532   3HZ   LYS  72          3HZ       LYS  72  -1.100  -8.085 -12.472
  533    H    GLY  73           H        GLY  73  -1.319  -2.338 -11.381
  534   1HA   GLY  73          1HA       GLY  73   1.047  -1.617 -12.917
  535   2HA   GLY  73          2HA       GLY  73  -0.624  -1.477 -13.469
  536    H    THR  74           H        THR  74   1.440   0.015 -10.953
  537    HA   THR  74           HA       THR  74   0.135   2.637 -11.570
  538    HB   THR  74           HB       THR  74   1.128   3.159  -9.269
  539    HG1  THR  74           1HG      THR  74   2.671   1.512  -9.263
  540   1HG2  THR  74          1HG2      THR  74  -1.197   2.674  -9.350
  541   2HG2  THR  74          2HG2      THR  74  -0.552   1.604  -8.104
  542   3HG2  THR  74          3HG2      THR  74  -0.908   0.972  -9.712
  543    H    LYS  75           H        LYS  75   1.566   4.549 -11.541
  544    HA   LYS  75           HA       LYS  75   3.714   4.643 -13.239
  545   1HB   LYS  75          1HB       LYS  75   2.487   6.445 -11.796
  546   2HB   LYS  75          2HB       LYS  75   3.751   6.132 -10.611
  547   1HG   LYS  75          1HG       LYS  75   4.405   8.010 -12.024
  548   2HG   LYS  75          2HG       LYS  75   5.462   6.638 -12.340
  549   1HD   LYS  75          1HD       LYS  75   3.713   6.071 -14.216
  550   2HD   LYS  75          2HD       LYS  75   3.274   7.771 -14.057
  551   1HE   LYS  75          1HE       LYS  75   6.125   7.640 -14.111
  552   2HE   LYS  75          2HE       LYS  75   5.512   6.666 -15.462
  553   1HZ   LYS  75          1HZ       LYS  75   5.681   9.092 -15.956
  554   2HZ   LYS  75          2HZ       LYS  75   4.487   9.368 -14.779
  555   3HZ   LYS  75          3HZ       LYS  75   4.124   8.450 -16.162
  556    H    PHE  76           H        PHE  76   3.889   3.895  -9.759
  557    HA   PHE  76           HA       PHE  76   6.620   2.728 -10.215
  558   1HB   PHE  76          1HB       PHE  76   5.550   4.176  -7.776
  559   2HB   PHE  76          2HB       PHE  76   7.193   3.594  -8.006
  560    HD1  PHE  76           HD1      PHE  76   8.479   4.518 -10.084
  561    HD2  PHE  76           HD2      PHE  76   4.928   6.308  -8.462
  562    HE1  PHE  76           HE1      PHE  76   9.019   6.643 -11.242
  563    HE2  PHE  76           HE2      PHE  76   5.468   8.431  -9.616
  564    HZ   PHE  76           HZ       PHE  76   7.508   8.594 -11.003
  565    H    LYS  77           H        LYS  77   7.136   1.142  -8.277
  566    HA   LYS  77           HA       LYS  77   4.999  -0.802  -8.166
  567   1HB   LYS  77          1HB       LYS  77   6.545  -1.949  -6.615
  568   2HB   LYS  77          2HB       LYS  77   7.359  -1.430  -8.087
  569   1HG   LYS  77          1HG       LYS  77   8.132   0.618  -6.867
  570   2HG   LYS  77          2HG       LYS  77   7.435  -0.050  -5.392
  571   1HD   LYS  77          1HD       LYS  77   9.909  -0.522  -5.692
  572   2HD   LYS  77          2HD       LYS  77   8.907  -1.953  -5.468
  573   1HE   LYS  77          1HE       LYS  77   9.310  -1.035  -8.278
  574   2HE   LYS  77          2HE       LYS  77  10.683  -1.818  -7.469
  575   1HZ   LYS  77          1HZ       LYS  77   9.657  -3.758  -7.726
  576   2HZ   LYS  77          2HZ       LYS  77   8.305  -3.005  -8.424
  577   3HZ   LYS  77          3HZ       LYS  77   8.390  -3.212  -6.740
  578    H    SER  78           H        SER  78   3.253  -0.414  -7.040
  579    HA   SER  78           HA       SER  78   3.073   1.477  -4.844
  580   1HB   SER  78          1HB       SER  78   0.713   0.107  -4.929
  581   2HB   SER  78          2HB       SER  78   1.117   1.438  -6.005
  582    HG   SER  78           HG       SER  78   0.426  -0.647  -6.974
  583    H    CYS  79           H        CYS  79   1.595   0.608  -2.924
  584    HA   CYS  79           HA       CYS  79   3.173  -1.074  -1.253
  585   1HB   CYS  79          1HB       CYS  79   0.255  -0.245  -1.225
  586   2HB   CYS  79          2HB       CYS  79   1.074  -0.984   0.147
  587    H    VAL  80           H        VAL  80  -0.132  -1.814  -2.390
  588    HA   VAL  80           HA       VAL  80   0.201  -4.676  -2.056
  589    HB   VAL  80           HB       VAL  80  -1.800  -2.859  -3.400
  590   1HG1  VAL  80          1HG1      VAL  80  -3.018  -5.342  -3.095
  591   2HG1  VAL  80          2HG1      VAL  80  -1.423  -5.736  -3.733
  592   3HG1  VAL  80          3HG1      VAL  80  -2.480  -4.636  -4.619
  593   1HG2  VAL  80          1HG2      VAL  80  -3.206  -3.446  -1.517
  594   2HG2  VAL  80          2HG2      VAL  80  -1.628  -2.993  -0.872
  595   3HG2  VAL  80          3HG2      VAL  80  -2.074  -4.694  -0.999
  596    H    GLY  81           H        GLY  81   0.918  -2.396  -4.571
  597   1HA   GLY  81          1HA       GLY  81   0.935  -4.284  -6.781
  598   2HA   GLY  81          2HA       GLY  81   1.651  -2.670  -6.796
  599    H    CYS  82           H        CYS  82   3.379  -2.937  -4.578
  600    HA   CYS  82           HA       CYS  82   5.579  -4.453  -5.790
  601   1HB   CYS  82          1HB       CYS  82   5.616  -2.200  -4.510
  602   2HB   CYS  82          2HB       CYS  82   5.456  -3.171  -3.049
  603    H    HIS  83           H        HIS  83   3.167  -4.853  -3.353
  604    HA   HIS  83           HA       HIS  83   4.408  -6.988  -1.850
  605   1HB   HIS  83          1HB       HIS  83   1.745  -5.659  -2.157
  606   2HB   HIS  83          2HB       HIS  83   1.802  -7.190  -1.302
  607    HD1  HIS  83           HD1      HIS  83   1.289  -5.894   0.956
  608    HD2  HIS  83           HD2      HIS  83   4.884  -4.845  -0.875
  609    HE1  HIS  83           HE1      HIS  83   2.635  -4.645   2.695
  610    H    LEU  84           H        LEU  84   1.649  -7.048  -4.184
  611    HA   LEU  84           HA       LEU  84   1.429  -9.831  -4.483
  612   1HB   LEU  84          1HB       LEU  84   0.464  -7.444  -5.611
  613   2HB   LEU  84          2HB       LEU  84   1.118  -8.360  -6.964
  614    HG   LEU  84           HG       LEU  84  -0.622  -9.715  -4.929
  615   1HD1  LEU  84          1HD1      LEU  84  -1.676  -8.340  -7.411
  616   2HD1  LEU  84          2HD1      LEU  84  -1.751  -7.612  -5.805
  617   3HD1  LEU  84          3HD1      LEU  84  -2.609  -9.118  -6.133
  618   1HD2  LEU  84          1HD2      LEU  84   0.215 -11.320  -6.381
  619   2HD2  LEU  84          2HD2      LEU  84   0.330 -10.188  -7.728
  620   3HD2  LEU  84          3HD2      LEU  84  -1.237 -10.848  -7.262
  621    H    GLU  85           H        GLU  85   3.850  -7.613  -5.711
  622    HA   GLU  85           HA       GLU  85   4.980  -9.614  -7.581
  623   1HB   GLU  85          1HB       GLU  85   5.140  -6.724  -7.023
  624   2HB   GLU  85          2HB       GLU  85   6.687  -7.449  -7.462
  625   1HG   GLU  85          1HG       GLU  85   5.397  -8.563  -9.404
  626   2HG   GLU  85          2HG       GLU  85   4.130  -7.385  -9.061
  627    H    THR  86           H        THR  86   5.930  -7.864  -4.608
  628    HA   THR  86           HA       THR  86   8.490  -9.113  -4.285
  629    HB   THR  86           HB       THR  86   6.483  -7.706  -2.528
  630    HG1  THR  86           1HG      THR  86   7.933  -6.625  -4.017
  631   1HG2  THR  86          1HG2      THR  86   7.608  -9.485  -1.164
  632   2HG2  THR  86          2HG2      THR  86   7.992  -7.848  -0.634
  633   3HG2  THR  86          3HG2      THR  86   9.162  -8.763  -1.586
  634    H    ALA  87           H        ALA  87   5.338 -10.379  -4.030
  635    HA   ALA  87           HA       ALA  87   5.970 -12.412  -1.994
  636   1HB   ALA  87          1HB       ALA  87   3.715 -12.337  -1.841
  637   2HB   ALA  87          2HB       ALA  87   3.573 -12.911  -3.502
  638   3HB   ALA  87          3HB       ALA  87   3.683 -11.181  -3.172
  639    H    GLY  88           H        GLY  88   5.754 -12.142  -5.501
  640   1HA   GLY  88          1HA       GLY  88   6.261 -13.673  -7.206
  641   2HA   GLY  88          2HA       GLY  88   7.434 -14.329  -6.063
  642    H    ALA  89           H        ALA  89   3.911 -14.394  -6.698
  643    HA   ALA  89           HA       ALA  89   2.351 -16.137  -6.267
  644   1HB   ALA  89          1HB       ALA  89   4.394 -18.105  -7.083
  645   2HB   ALA  89          2HB       ALA  89   4.218 -16.729  -8.169
  646   3HB   ALA  89          3HB       ALA  89   2.827 -17.750  -7.806
  647    H    ASP  90           H        ASP  90   3.286 -15.543  -3.859
  648    HA   ASP  90           HA       ASP  90   4.028 -18.155  -2.616
  649   1HB   ASP  90          1HB       ASP  90   5.884 -16.565  -2.636
  650   2HB   ASP  90          2HB       ASP  90   4.862 -15.324  -1.919
  651    H    ALA  91           H        ALA  91   1.754 -18.495  -2.301
  652    HA   ALA  91           HA       ALA  91  -0.270 -16.966  -1.305
  653   1HB   ALA  91          1HB       ALA  91   0.573 -19.682  -0.242
  654   2HB   ALA  91          2HB       ALA  91  -0.323 -19.412  -1.737
  655   3HB   ALA  91          3HB       ALA  91  -1.059 -19.016  -0.184
  656    H    ALA  92           H        ALA  92   2.607 -17.911   0.490
  657    HA   ALA  92           HA       ALA  92   1.603 -17.031   3.087
  658   1HB   ALA  92          1HB       ALA  92   3.891 -18.348   1.935
  659   2HB   ALA  92          2HB       ALA  92   3.419 -18.272   3.633
  660   3HB   ALA  92          3HB       ALA  92   4.450 -17.016   2.946
  661    H    LYS  93           H        LYS  93   3.793 -15.729   0.616
  662    HA   LYS  93           HA       LYS  93   4.109 -13.159   1.964
  663   1HB   LYS  93          1HB       LYS  93   4.991 -14.585  -0.486
  664   2HB   LYS  93          2HB       LYS  93   4.990 -12.827  -0.587
  665   1HG   LYS  93          1HG       LYS  93   6.219 -12.911   1.694
  666   2HG   LYS  93          2HG       LYS  93   6.510 -14.608   1.307
  667   1HD   LYS  93          1HD       LYS  93   7.319 -13.628  -1.006
  668   2HD   LYS  93          2HD       LYS  93   7.538 -12.148  -0.071
  669   1HE   LYS  93          1HE       LYS  93   9.578 -13.040   0.457
  670   2HE   LYS  93          2HE       LYS  93   8.662 -14.059   1.584
  671   1HZ   LYS  93          1HZ       LYS  93   9.728 -14.710  -1.054
  672   2HZ   LYS  93          2HZ       LYS  93   8.208 -15.361  -0.664
  673   3HZ   LYS  93          3HZ       LYS  93   9.554 -15.696   0.315
  674    H    LYS  94           H        LYS  94   1.994 -14.561  -0.468
  675    HA   LYS  94           HA       LYS  94   0.971 -12.035  -1.492
  676   1HB   LYS  94          1HB       LYS  94   0.585 -14.925  -1.814
  677   2HB   LYS  94          2HB       LYS  94  -0.925 -14.022  -1.944
  678   1HG   LYS  94          1HG       LYS  94   0.544 -12.422  -3.465
  679   2HG   LYS  94          2HG       LYS  94   1.522 -13.876  -3.663
  680   1HD   LYS  94          1HD       LYS  94  -0.752 -15.054  -4.157
  681   2HD   LYS  94          2HD       LYS  94  -1.349 -13.419  -4.444
  682   1HE   LYS  94          1HE       LYS  94  -0.119 -13.168  -6.374
  683   2HE   LYS  94          2HE       LYS  94   1.232 -14.140  -5.757
  684   1HZ   LYS  94          1HZ       LYS  94   0.269 -16.061  -6.396
  685   2HZ   LYS  94          2HZ       LYS  94  -0.556 -15.071  -7.504
  686   3HZ   LYS  94          3HZ       LYS  94  -1.303 -15.527  -6.047
  687    H    LYS  95           H        LYS  95   0.233 -14.155   1.195
  688    HA   LYS  95           HA       LYS  95  -2.357 -12.886   1.784
  689   1HB   LYS  95          1HB       LYS  95  -2.474 -14.563   3.458
  690   2HB   LYS  95          2HB       LYS  95  -1.546 -15.330   2.171
  691   1HG   LYS  95          1HG       LYS  95   0.029 -15.740   3.735
  692   2HG   LYS  95          2HG       LYS  95   0.392 -14.017   3.666
  693   1HD   LYS  95          1HD       LYS  95  -1.259 -13.589   5.446
  694   2HD   LYS  95          2HD       LYS  95  -1.635 -15.311   5.514
  695   1HE   LYS  95          1HE       LYS  95   1.239 -14.530   5.799
  696   2HE   LYS  95          2HE       LYS  95   0.161 -14.235   7.179
  697   1HZ   LYS  95          1HZ       LYS  95   1.238 -16.574   6.850
  698   2HZ   LYS  95          2HZ       LYS  95  -0.027 -16.787   5.735
  699   3HZ   LYS  95          3HZ       LYS  95  -0.373 -16.442   7.362
  700    H    GLU  96           H        GLU  96   0.988 -12.464   2.582
  701    HA   GLU  96           HA       GLU  96   0.405 -10.754   4.941
  702   1HB   GLU  96          1HB       GLU  96   2.794 -10.945   5.270
  703   2HB   GLU  96          2HB       GLU  96   2.208 -12.534   4.811
  704   1HG   GLU  96          1HG       GLU  96   2.925 -12.177   2.530
  705   2HG   GLU  96          2HG       GLU  96   3.411 -10.525   2.911
  706    H    LEU  97           H        LEU  97   1.932 -10.614   1.760
  707    HA   LEU  97           HA       LEU  97   2.449  -7.745   1.855
  708   1HB   LEU  97          1HB       LEU  97   2.441  -9.776  -0.388
  709   2HB   LEU  97          2HB       LEU  97   3.167  -8.170  -0.465
  710    HG   LEU  97           HG       LEU  97   3.996 -10.500   1.268
  711   1HD1  LEU  97          1HD1      LEU  97   5.296  -8.783  -0.842
  712   2HD1  LEU  97          2HD1      LEU  97   5.036 -10.527  -0.868
  713   3HD1  LEU  97          3HD1      LEU  97   6.227  -9.829   0.229
  714   1HD2  LEU  97          1HD2      LEU  97   4.405  -7.556   1.632
  715   2HD2  LEU  97          2HD2      LEU  97   5.752  -8.632   1.997
  716   3HD2  LEU  97          3HD2      LEU  97   4.220  -8.817   2.850
  717    H    THR  98           H        THR  98   0.380  -9.657  -0.357
  718    HA   THR  98           HA       THR  98  -1.221  -7.223  -0.876
  719    HB   THR  98           HB       THR  98  -2.243  -8.762  -2.602
  720    HG1  THR  98           1HG      THR  98  -1.407 -10.613  -1.149
  721   1HG2  THR  98          1HG2      THR  98   0.184  -7.442  -2.566
  722   2HG2  THR  98          2HG2      THR  98  -0.578  -8.130  -3.998
  723   3HG2  THR  98          3HG2      THR  98   0.628  -9.059  -3.108
  724    H    GLY  99           H        GLY  99  -1.432 -10.124   1.003
  725   1HA   GLY  99          1HA       GLY  99  -4.184 -10.604   1.107
  726   2HA   GLY  99          2HA       GLY  99  -3.121 -10.775   2.507
  727    H    CYS 100           H        CYS 100  -5.863  -9.294   1.638
  728    HA   CYS 100           HA       CYS 100  -5.363  -6.604   2.665
  729   1HB   CYS 100          1HB       CYS 100  -8.113  -7.641   2.674
  730   2HB   CYS 100          2HB       CYS 100  -7.478  -6.203   1.920
  731    H    LYS 101           H        LYS 101  -7.529  -9.180   3.819
  732    HA   LYS 101           HA       LYS 101  -7.194  -8.105   6.570
  733   1HB   LYS 101          1HB       LYS 101  -9.178  -9.666   6.957
  734   2HB   LYS 101          2HB       LYS 101  -9.462  -8.359   5.806
  735   1HG   LYS 101          1HG       LYS 101  -9.707  -9.791   4.065
  736   2HG   LYS 101          2HG       LYS 101  -8.342 -10.784   4.578
  737   1HD   LYS 101          1HD       LYS 101  -9.678 -12.258   5.657
  738   2HD   LYS 101          2HD       LYS 101 -10.639 -10.973   6.391
  739   1HE   LYS 101          1HE       LYS 101 -11.748 -10.662   4.108
  740   2HE   LYS 101          2HE       LYS 101 -10.967 -12.183   3.630
  741   1HZ   LYS 101          1HZ       LYS 101 -13.291 -12.243   4.767
  742   2HZ   LYS 101          2HZ       LYS 101 -12.398 -12.032   6.197
  743   3HZ   LYS 101          3HZ       LYS 101 -12.112 -13.381   5.203
  744    H    GLY 102           H        GLY 102  -5.546  -9.074   7.700
  745   1HA   GLY 102          1HA       GLY 102  -4.870 -11.102   8.932
  746   2HA   GLY 102          2HA       GLY 102  -5.298 -12.045   7.503
  747    H    SER 103           H        SER 103  -3.874  -9.347   6.298
  748    HA   SER 103           HA       SER 103  -1.344 -10.760   5.786
  749   1HB   SER 103          1HB       SER 103  -1.015  -8.850   4.253
  750   2HB   SER 103          2HB       SER 103  -2.606  -9.561   4.029
  751    HG   SER 103           HG       SER 103  -3.148  -7.517   4.301
  752    H    LYS 104           H        LYS 104   0.187  -8.302   5.519
  753    HA   LYS 104           HA       LYS 104   0.900  -7.864   8.385
  754   1HB   LYS 104          1HB       LYS 104   2.277  -7.398   5.721
  755   2HB   LYS 104          2HB       LYS 104   3.002  -7.040   7.287
  756   1HG   LYS 104          1HG       LYS 104   1.889  -9.780   6.860
  757   2HG   LYS 104          2HG       LYS 104   3.426  -9.382   6.092
  758   1HD   LYS 104          1HD       LYS 104   3.917  -8.390   8.543
  759   2HD   LYS 104          2HD       LYS 104   2.769  -9.656   8.982
  760   1HE   LYS 104          1HE       LYS 104   4.253 -11.156   7.393
  761   2HE   LYS 104          2HE       LYS 104   5.486  -9.923   7.726
  762   1HZ   LYS 104          1HZ       LYS 104   5.642 -11.508   9.460
  763   2HZ   LYS 104          2HZ       LYS 104   3.960 -11.534   9.696
  764   3HZ   LYS 104          3HZ       LYS 104   4.859 -10.158  10.125
  765    H    CYS 105           H        CYS 105  -0.204  -6.378   5.465
  766    HA   CYS 105           HA       CYS 105   0.272  -3.620   6.255
  767   1HB   CYS 105          1HB       CYS 105  -0.178  -5.089   3.962
  768   2HB   CYS 105          2HB       CYS 105  -1.695  -4.250   4.178
  769    H    HIS 106           H        HIS 106  -2.385  -5.915   6.580
  770    HA   HIS 106           HA       HIS 106  -4.058  -3.720   7.768
  771   1HB   HIS 106          1HB       HIS 106  -4.603  -6.041   5.967
  772   2HB   HIS 106          2HB       HIS 106  -5.878  -5.558   7.086
  773    HD1  HIS 106           HD1      HIS 106  -5.183  -2.473   7.008
  774    HD2  HIS 106           HD2      HIS 106  -5.804  -4.890   3.649
  775    HE1  HIS 106           HE1      HIS 106  -5.736  -0.908   5.101
  776    H    SER 107           H        SER 107  -2.654  -4.459   9.743
  777    HA   SER 107           HA       SER 107  -3.550  -7.027  10.933
  778   1HB   SER 107          1HB       SER 107  -1.403  -4.994  11.350
  779   2HB   SER 107          2HB       SER 107  -1.886  -5.957  12.743
  780    HG   SER 107           HG       SER 107  -0.177  -6.851  11.366
  781    HHA  HEC 201           HHA      HEC 201   6.092   8.665   5.845
  782    HHB  HEC 201           HHB      HEC 201  12.126   9.845   4.718
  783    HHC  HEC 201           HHC      HEC 201  12.570   4.655   1.201
  784    HHD  HEC 201           HHD      HEC 201   6.383   3.722   1.783
  785   1HMA  HEC 201          1HMA      HEC 201  10.001  10.932   7.877
  786   2HMA  HEC 201          2HMA      HEC 201  10.307  11.970   6.483
  787   3HMA  HEC 201          3HMA      HEC 201  11.455  10.699   6.903
  788   1HAA  HEC 201          1HAA      HEC 201   6.756   9.753   7.570
  789   2HAA  HEC 201          2HAA      HEC 201   8.014  10.942   7.898
  790   1HBA  HEC 201          1HBA      HEC 201   6.461  11.200   5.361
  791   2HBA  HEC 201          2HBA      HEC 201   5.676  11.673   6.867
  792   1HMB  HEC 201          1HMB      HEC 201  14.666   9.466   2.830
  793   2HMB  HEC 201          2HMB      HEC 201  15.298   8.296   3.989
  794   3HMB  HEC 201          3HMB      HEC 201  14.115   9.497   4.506
  795    HAB  HEC 201           HAB      HEC 201  14.412   5.408   1.312
  796   1HBB  HEC 201          1HBB      HEC 201  16.636   6.223   2.826
  797   2HBB  HEC 201          2HBB      HEC 201  15.791   4.679   2.943
  798   3HBB  HEC 201          3HBB      HEC 201  15.334   6.016   3.999
  799   1HMC  HEC 201          1HMC      HEC 201  12.025   3.124  -0.178
  800   2HMC  HEC 201          2HMC      HEC 201  10.690   2.101  -0.708
  801   3HMC  HEC 201          3HMC      HEC 201  11.554   1.721   0.781
  802    HAC  HEC 201           HAC      HEC 201   7.012   2.300   0.690
  803   1HBC  HEC 201          1HBC      HEC 201   7.980   0.342   1.384
  804   2HBC  HEC 201          2HBC      HEC 201   9.571   0.790   0.771
  805   3HBC  HEC 201          3HBC      HEC 201   8.335   0.191  -0.337
  806   1HMD  HEC 201          1HMD      HEC 201   4.607   3.279   3.726
  807   2HMD  HEC 201          2HMD      HEC 201   3.404   4.437   4.289
  808   3HMD  HEC 201          3HMD      HEC 201   3.798   4.343   2.572
  809   1HAD  HEC 201          1HAD      HEC 201   4.316   7.604   6.075
  810   2HAD  HEC 201          2HAD      HEC 201   3.171   6.799   5.003
  811   1HBD  HEC 201          1HBD      HEC 201   3.623   4.651   6.078
  812   2HBD  HEC 201          2HBD      HEC 201   4.853   5.396   7.098
  813    HHA  HEC 202           HHA      HEC 202   1.520   7.645  -9.635
  814    HHB  HEC 202           HHB      HEC 202   2.704   4.090  -4.976
  815    HHC  HEC 202           HHC      HEC 202   4.420   8.960  -1.362
  816    HHD  HEC 202           HHD      HEC 202   2.545  12.890  -6.041
  817   1HMA  HEC 202          1HMA      HEC 202   0.325   3.224  -7.604
  818   2HMA  HEC 202          2HMA      HEC 202   0.879   3.246  -5.931
  819   3HMA  HEC 202          3HMA      HEC 202   1.992   2.791  -7.222
  820   1HAA  HEC 202          1HAA      HEC 202   0.970   5.319 -10.148
  821   2HAA  HEC 202          2HAA      HEC 202  -0.105   4.425  -9.108
  822   1HBA  HEC 202          1HBA      HEC 202  -1.379   6.459  -8.636
  823   2HBA  HEC 202          2HBA      HEC 202  -0.282   7.392  -9.652
  824   1HMB  HEC 202          1HMB      HEC 202   4.035   3.791  -1.398
  825   2HMB  HEC 202          2HMB      HEC 202   4.353   3.353  -3.077
  826   3HMB  HEC 202          3HMB      HEC 202   2.692   3.518  -2.509
  827    HAB  HEC 202           HAB      HEC 202   4.182   7.075   0.003
  828   1HBB  HEC 202          1HBB      HEC 202   6.356   6.573   0.386
  829   2HBB  HEC 202          2HBB      HEC 202   6.480   6.185  -1.330
  830   3HBB  HEC 202          3HBB      HEC 202   6.127   4.912  -0.161
  831   1HMC  HEC 202          1HMC      HEC 202   5.413  12.525  -1.525
  832   2HMC  HEC 202          2HMC      HEC 202   3.882  12.223  -0.705
  833   3HMC  HEC 202          3HMC      HEC 202   5.073  10.931  -0.852
  834    HAC  HEC 202           HAC      HEC 202   2.597  13.987  -4.267
  835   1HBC  HEC 202          1HBC      HEC 202   4.245  15.500  -3.604
  836   2HBC  HEC 202          2HBC      HEC 202   5.251  14.070  -3.838
  837   3HBC  HEC 202          3HBC      HEC 202   4.726  14.522  -2.217
  838   1HMD  HEC 202          1HMD      HEC 202   1.970  12.901  -9.950
  839   2HMD  HEC 202          2HMD      HEC 202   2.856  13.466  -8.533
  840   3HMD  HEC 202          3HMD      HEC 202   1.096  13.364  -8.488
  841   1HAD  HEC 202          1HAD      HEC 202   1.957   9.178 -10.898
  842   2HAD  HEC 202          2HAD      HEC 202   1.245  10.777 -11.093
  843   1HBD  HEC 202          1HBD      HEC 202   3.665  11.636 -10.630
  844   2HBD  HEC 202          2HBD      HEC 202   4.142   9.988 -11.040
  845    HHA  HEC 203           HHA      HEC 203   7.012  -6.868   4.634
  846    HHB  HEC 203           HHB      HEC 203   2.709  -2.039   5.008
  847    HHC  HEC 203           HHC      HEC 203   4.641   0.119  -0.355
  848    HHD  HEC 203           HHD      HEC 203   9.023  -4.399  -0.788
  849   1HMA  HEC 203          1HMA      HEC 203   2.992  -5.127   7.533
  850   2HMA  HEC 203          2HMA      HEC 203   2.128  -3.925   6.573
  851   3HMA  HEC 203          3HMA      HEC 203   3.420  -3.420   7.664
  852   1HAA  HEC 203          1HAA      HEC 203   4.743  -6.138   7.740
  853   2HAA  HEC 203          2HAA      HEC 203   4.629  -7.342   6.465
  854   1HBA  HEC 203          1HBA      HEC 203   6.904  -7.627   6.337
  855   2HBA  HEC 203          2HBA      HEC 203   7.244  -5.951   6.772
  856   1HMB  HEC 203          1HMB      HEC 203   2.279   1.297   4.345
  857   2HMB  HEC 203          2HMB      HEC 203   1.965  -0.293   5.040
  858   3HMB  HEC 203          3HMB      HEC 203   1.049   0.250   3.635
  859    HAB  HEC 203           HAB      HEC 203   2.712   0.926   0.227
  860   1HBB  HEC 203          1HBB      HEC 203   4.442   2.454   0.269
  861   2HBB  HEC 203          2HBB      HEC 203   4.448   2.555   2.030
  862   3HBB  HEC 203          3HBB      HEC 203   3.215   3.410   1.101
  863   1HMC  HEC 203          1HMC      HEC 203   7.256   0.269  -2.737
  864   2HMC  HEC 203          2HMC      HEC 203   5.881  -0.650  -3.353
  865   3HMC  HEC 203          3HMC      HEC 203   5.655   0.497  -2.032
  866    HAC  HEC 203           HAC      HEC 203   9.232  -3.219  -2.453
  867   1HBC  HEC 203          1HBC      HEC 203   9.865  -1.439  -3.825
  868   2HBC  HEC 203          2HBC      HEC 203   9.064  -0.570  -2.516
  869   3HBC  HEC 203          3HBC      HEC 203   8.207  -0.874  -4.024
  870   1HMD  HEC 203          1HMD      HEC 203  10.458  -5.810  -0.137
  871   2HMD  HEC 203          2HMD      HEC 203   9.916  -7.484  -0.009
  872   3HMD  HEC 203          3HMD      HEC 203  10.942  -6.791   1.248
  873   1HAD  HEC 203          1HAD      HEC 203  10.050  -7.743   3.354
  874   2HAD  HEC 203          2HAD      HEC 203   8.470  -8.052   4.064
  875   1HBD  HEC 203          1HBD      HEC 203   7.835  -9.508   2.330
  876   2HBD  HEC 203          2HBD      HEC 203   9.063  -8.878   1.230
  877    HHA  HEC 204           HHA      HEC 204  -6.789   2.167   3.875
  878    HHB  HEC 204           HHB      HEC 204 -10.135  -2.332   1.031
  879    HHC  HEC 204           HHC      HEC 204  -4.817  -5.924   0.866
  880    HHD  HEC 204           HHD      HEC 204  -1.490  -0.982   2.575
  881   1HMA  HEC 204          1HMA      HEC 204 -11.684   0.036   3.172
  882   2HMA  HEC 204          2HMA      HEC 204 -11.486  -0.906   1.695
  883   3HMA  HEC 204          3HMA      HEC 204 -11.411   0.855   1.633
  884   1HAA  HEC 204          1HAA      HEC 204  -9.959   1.980   4.584
  885   2HAA  HEC 204          2HAA      HEC 204  -8.521   2.780   3.957
  886   1HBA  HEC 204          1HBA      HEC 204  -9.721   3.113   1.782
  887   2HBA  HEC 204          2HBA      HEC 204 -11.166   2.444   2.533
  888   1HMB  HEC 204          1HMB      HEC 204  -9.821  -4.917  -1.495
  889   2HMB  HEC 204          2HMB      HEC 204 -10.594  -3.901  -0.278
  890   3HMB  HEC 204          3HMB      HEC 204 -10.305  -5.608   0.054
  891    HAB  HEC 204           HAB      HEC 204  -6.479  -7.004   0.164
  892   1HBB  HEC 204          1HBB      HEC 204  -6.905  -7.522  -2.306
  893   2HBB  HEC 204          2HBB      HEC 204  -5.743  -6.241  -1.955
  894   3HBB  HEC 204          3HBB      HEC 204  -7.380  -5.830  -2.466
  895   1HMC  HEC 204          1HMC      HEC 204  -1.557  -6.184   2.135
  896   2HMC  HEC 204          2HMC      HEC 204  -3.003  -6.634   1.231
  897   3HMC  HEC 204          3HMC      HEC 204  -1.587  -6.021   0.379
  898    HAC  HEC 204           HAC      HEC 204  -0.468  -2.506   2.913
  899   1HBC  HEC 204          1HBC      HEC 204   0.129  -2.528   0.423
  900   2HBC  HEC 204          2HBC      HEC 204   0.488  -4.243   0.622
  901   3HBC  HEC 204          3HBC      HEC 204   1.408  -3.039   1.525
  902   1HMD  HEC 204          1HMD      HEC 204  -1.071   0.722   4.156
  903   2HMD  HEC 204          2HMD      HEC 204  -1.631   2.390   4.295
  904   3HMD  HEC 204          3HMD      HEC 204  -1.089   1.768   2.736
  905   1HAD  HEC 204          1HAD      HEC 204  -3.670   3.796   3.598
  906   2HAD  HEC 204          2HAD      HEC 204  -5.321   3.443   4.089
  907   1HBD  HEC 204          1HBD      HEC 204  -4.072   2.212   6.093
  908   2HBD  HEC 204          2HBD      HEC 204  -2.812   3.377   5.693
  Start of MODEL   19
    1   1H    ALA   1          1H        ALA   1  20.186  14.375   0.756
    2   2H    ALA   1          2H        ALA   1  18.584  14.398   1.324
    3   3H    ALA   1          3H        ALA   1  19.142  13.087   0.397
    4    HA   ALA   1           HA       ALA   1  20.191  12.102   2.135
    5   1HB   ALA   1          1HB       ALA   1  21.083  13.762   3.975
    6   2HB   ALA   1          2HB       ALA   1  20.762  14.991   2.751
    7   3HB   ALA   1          3HB       ALA   1  21.897  13.685   2.413
    8    HA   PRO   2           HA       PRO   2  16.127  13.194   4.215
    9   1HB   PRO   2          1HB       PRO   2  14.740  10.978   3.416
   10   2HB   PRO   2          2HB       PRO   2  14.768  12.483   2.487
   11   1HG   PRO   2          1HG       PRO   2  16.279   9.962   2.052
   12   2HG   PRO   2          2HG       PRO   2  15.577  11.076   0.869
   13   1HD   PRO   2          1HD       PRO   2  18.240  10.994   1.489
   14   2HD   PRO   2          2HD       PRO   2  17.411  12.439   0.869
   15    H    LYS   3           H        LYS   3  15.745  12.382   6.279
   16    HA   LYS   3           HA       LYS   3  17.306   9.967   7.069
   17   1HB   LYS   3          1HB       LYS   3  15.862  11.974   8.800
   18   2HB   LYS   3          2HB       LYS   3  17.152  10.871   9.271
   19   1HG   LYS   3          1HG       LYS   3  17.554  12.986   7.151
   20   2HG   LYS   3          2HG       LYS   3  17.838  13.312   8.861
   21   1HD   LYS   3          1HD       LYS   3  19.097  10.825   8.182
   22   2HD   LYS   3          2HD       LYS   3  19.599  12.052   7.018
   23   1HE   LYS   3          1HE       LYS   3  19.962  13.567   9.117
   24   2HE   LYS   3          2HE       LYS   3  19.979  12.031  10.007
   25   1HZ   LYS   3          1HZ       LYS   3  21.535  12.371   7.520
   26   2HZ   LYS   3          2HZ       LYS   3  21.748  11.226   8.756
   27   3HZ   LYS   3          3HZ       LYS   3  22.179  12.850   9.014
   28    H    ALA   4           H        ALA   4  15.783   8.451   6.218
   29    HA   ALA   4           HA       ALA   4  13.061   8.203   6.433
   30   1HB   ALA   4          1HB       ALA   4  13.482   5.979   6.029
   31   2HB   ALA   4          2HB       ALA   4  14.611   5.850   7.379
   32   3HB   ALA   4          3HB       ALA   4  15.140   6.556   5.852
   33    HA   PRO   5           HA       PRO   5  12.292   8.482  10.764
   34   1HB   PRO   5          1HB       PRO   5   9.618   7.897  10.676
   35   2HB   PRO   5          2HB       PRO   5  10.294   9.470  10.222
   36   1HG   PRO   5          1HG       PRO   5   9.262   7.301   8.505
   37   2HG   PRO   5          2HG       PRO   5   9.333   9.040   8.217
   38   1HD   PRO   5          1HD       PRO   5  11.070   7.117   7.150
   39   2HD   PRO   5          2HD       PRO   5  11.313   8.875   7.140
   40    H    ALA   6           H        ALA   6  11.591   7.076  12.535
   41    HA   ALA   6           HA       ALA   6  12.566   4.453  12.449
   42   1HB   ALA   6          1HB       ALA   6  12.153   5.767  14.482
   43   2HB   ALA   6          2HB       ALA   6  11.301   4.226  14.581
   44   3HB   ALA   6          3HB       ALA   6  10.415   5.700  14.189
   45    H    ASP   7           H        ASP   7  11.574   2.450  12.201
   46    HA   ASP   7           HA       ASP   7   9.510   2.127  10.277
   47   1HB   ASP   7          1HB       ASP   7  10.231   0.181  12.482
   48   2HB   ASP   7          2HB       ASP   7   9.719  -0.187  10.834
   49    H    GLY   8           H        GLY   8   7.624   0.426  11.252
   50   1HA   GLY   8          1HA       GLY   8   5.620   0.294  12.458
   51   2HA   GLY   8          2HA       GLY   8   6.411   1.220  13.731
   52    H    LEU   9           H        LEU   9   6.446   2.695  10.622
   53    HA   LEU   9           HA       LEU   9   5.008   5.009  11.488
   54   1HB   LEU   9          1HB       LEU   9   6.507   4.189   9.289
   55   2HB   LEU   9          2HB       LEU   9   4.897   4.451   8.616
   56    HG   LEU   9           HG       LEU   9   5.909   6.505  10.516
   57   1HD1  LEU   9          1HD1      LEU   9   7.906   6.315   9.253
   58   2HD1  LEU   9          2HD1      LEU   9   7.017   7.610   8.450
   59   3HD1  LEU   9          3HD1      LEU   9   7.027   5.986   7.759
   60   1HD2  LEU   9          1HD2      LEU   9   4.134   6.322   8.108
   61   2HD2  LEU   9          2HD2      LEU   9   4.888   7.875   8.477
   62   3HD2  LEU   9          3HD2      LEU   9   3.831   7.100   9.663
   63    H    LYS  10           H        LYS  10   2.836   5.192  11.809
   64    HA   LYS  10           HA       LYS  10   1.074   3.099  10.628
   65   1HB   LYS  10          1HB       LYS  10   1.194   4.697  13.075
   66   2HB   LYS  10          2HB       LYS  10  -0.419   4.644  12.362
   67   1HG   LYS  10          1HG       LYS  10   0.113   2.069  12.107
   68   2HG   LYS  10          2HG       LYS  10   1.257   2.393  13.411
   69   1HD   LYS  10          1HD       LYS  10  -1.085   3.713  14.190
   70   2HD   LYS  10          2HD       LYS  10  -1.641   2.176  13.526
   71   1HE   LYS  10          1HE       LYS  10   0.031   0.994  14.978
   72   2HE   LYS  10          2HE       LYS  10   0.426   2.557  15.721
   73   1HZ   LYS  10          1HZ       LYS  10  -2.371   1.631  15.484
   74   2HZ   LYS  10          2HZ       LYS  10  -1.730   2.814  16.523
   75   3HZ   LYS  10          3HZ       LYS  10  -1.412   1.169  16.805
   76    H    MET  11           H        MET  11   0.212   3.676   8.719
   77    HA   MET  11           HA       MET  11  -0.349   6.508   8.067
   78   1HB   MET  11          1HB       MET  11  -1.140   5.294   5.896
   79   2HB   MET  11          2HB       MET  11   0.581   5.263   6.272
   80   1HG   MET  11          1HG       MET  11  -0.956   3.071   7.491
   81   2HG   MET  11          2HG       MET  11  -0.941   3.049   5.729
   82   1HE   MET  11          1HE       MET  11   0.823   2.470   4.293
   83   2HE   MET  11          2HE       MET  11   2.553   2.532   4.624
   84   3HE   MET  11          3HE       MET  11   1.610   4.019   4.618
   85    H    ASP  12           H        ASP  12  -2.159   7.152   9.239
   86    HA   ASP  12           HA       ASP  12  -4.538   5.340   9.248
   87   1HB   ASP  12          1HB       ASP  12  -5.253   7.101  10.998
   88   2HB   ASP  12          2HB       ASP  12  -3.916   6.037  11.411
   89    H    LYS  13           H        LYS  13  -3.572   7.211   7.017
   90    HA   LYS  13           HA       LYS  13  -5.159   9.481   6.661
   91   1HB   LYS  13          1HB       LYS  13  -4.240   7.272   4.815
   92   2HB   LYS  13          2HB       LYS  13  -5.015   8.732   4.213
   93   1HG   LYS  13          1HG       LYS  13  -2.550   8.714   5.975
   94   2HG   LYS  13          2HG       LYS  13  -2.510   8.869   4.219
   95   1HD   LYS  13          1HD       LYS  13  -3.855  10.918   4.345
   96   2HD   LYS  13          2HD       LYS  13  -3.968  10.751   6.098
   97   1HE   LYS  13          1HE       LYS  13  -1.209  10.699   5.000
   98   2HE   LYS  13          2HE       LYS  13  -2.055  12.256   4.894
   99   1HZ   LYS  13          1HZ       LYS  13  -0.868  11.703   7.079
  100   2HZ   LYS  13          2HZ       LYS  13  -2.153  10.627   7.356
  101   3HZ   LYS  13          3HZ       LYS  13  -2.458  12.289   7.170
  102    H    THR  14           H        THR  14  -6.059   6.096   6.465
  103    HA   THR  14           HA       THR  14  -8.891   6.891   5.850
  104    HB   THR  14           HB       THR  14  -8.987   4.512   4.949
  105    HG1  THR  14           1HG      THR  14  -7.151   3.765   6.071
  106   1HG2  THR  14          1HG2      THR  14  -8.089   5.139   2.854
  107   2HG2  THR  14          2HG2      THR  14  -6.846   6.147   3.595
  108   3HG2  THR  14          3HG2      THR  14  -8.531   6.668   3.613
  109    H    LYS  15           H        LYS  15 -10.454   5.091   6.703
  110    HA   LYS  15           HA       LYS  15 -10.332   4.973   9.547
  111   1HB   LYS  15          1HB       LYS  15 -11.949   3.912   7.316
  112   2HB   LYS  15          2HB       LYS  15 -12.004   2.926   8.778
  113   1HG   LYS  15          1HG       LYS  15 -13.346   4.420   9.791
  114   2HG   LYS  15          2HG       LYS  15 -12.187   5.716   9.485
  115   1HD   LYS  15          1HD       LYS  15 -13.099   6.038   7.234
  116   2HD   LYS  15          2HD       LYS  15 -14.222   4.701   7.480
  117   1HE   LYS  15          1HE       LYS  15 -15.346   5.912   9.282
  118   2HE   LYS  15          2HE       LYS  15 -14.163   7.229   9.166
  119   1HZ   LYS  15          1HZ       LYS  15 -15.970   7.886   7.828
  120   2HZ   LYS  15          2HZ       LYS  15 -16.116   6.350   7.118
  121   3HZ   LYS  15          3HZ       LYS  15 -14.787   7.340   6.742
  122    H    GLN  16           H        GLN  16  -8.938   2.959   7.082
  123    HA   GLN  16           HA       GLN  16  -8.264   0.837   9.076
  124   1HB   GLN  16          1HB       GLN  16  -8.149   0.987   6.045
  125   2HB   GLN  16          2HB       GLN  16  -7.680  -0.429   6.988
  126   1HG   GLN  16          1HG       GLN  16 -10.330   0.643   7.690
  127   2HG   GLN  16          2HG       GLN  16 -10.217   0.044   6.035
  128   1HE2  GLN  16          2HE2      GLN  16  -8.180  -1.306   8.590
  129   2HE2  GLN  16          1HE2      GLN  16  -8.959  -2.812   8.662
  130    HA   PRO  17           HA       PRO  17  -4.467   3.443   8.706
  131   1HB   PRO  17          1HB       PRO  17  -3.704   3.060  11.315
  132   2HB   PRO  17          2HB       PRO  17  -4.819   4.343  10.802
  133   1HG   PRO  17          1HG       PRO  17  -5.428   1.674  11.990
  134   2HG   PRO  17          2HG       PRO  17  -6.150   3.253  12.342
  135   1HD   PRO  17          1HD       PRO  17  -7.380   1.443  10.772
  136   2HD   PRO  17          2HD       PRO  17  -7.521   3.193  10.484
  137    H    VAL  18           H        VAL  18  -2.552   2.553   8.074
  138    HA   VAL  18           HA       VAL  18  -2.014  -0.304   8.784
  139    HB   VAL  18           HB       VAL  18  -1.519   1.441   6.366
  140   1HG1  VAL  18          1HG1      VAL  18   0.556   0.294   6.637
  141   2HG1  VAL  18          2HG1      VAL  18  -0.351  -0.633   5.443
  142   3HG1  VAL  18          3HG1      VAL  18  -0.250  -1.202   7.108
  143   1HG2  VAL  18          1HG2      VAL  18  -2.494  -1.020   5.576
  144   2HG2  VAL  18          2HG2      VAL  18  -3.481   0.416   5.847
  145   3HG2  VAL  18          3HG2      VAL  18  -3.294  -0.781   7.129
  146    H    VAL  19           H        VAL  19   0.253  -0.856   9.145
  147    HA   VAL  19           HA       VAL  19   1.867   1.453  10.152
  148    HB   VAL  19           HB       VAL  19   1.850  -1.518  10.767
  149   1HG1  VAL  19          1HG1      VAL  19   3.286  -0.267  12.757
  150   2HG1  VAL  19          2HG1      VAL  19   3.808   0.608  11.318
  151   3HG1  VAL  19          3HG1      VAL  19   3.997  -1.144  11.402
  152   1HG2  VAL  19          1HG2      VAL  19   0.049   0.284  11.602
  153   2HG2  VAL  19          2HG2      VAL  19   1.316   0.616  12.784
  154   3HG2  VAL  19          3HG2      VAL  19   0.632  -1.004  12.658
  155    H    PHE  20           H        PHE  20   3.531   2.023   8.771
  156    HA   PHE  20           HA       PHE  20   4.614  -0.051   6.918
  157   1HB   PHE  20          1HB       PHE  20   3.775   2.087   5.983
  158   2HB   PHE  20          2HB       PHE  20   4.927   2.970   6.984
  159    HD1  PHE  20           HD1      PHE  20   4.933   0.027   4.659
  160    HD2  PHE  20           HD2      PHE  20   6.931   3.597   5.955
  161    HE1  PHE  20           HE1      PHE  20   6.697  -0.338   2.958
  162    HE2  PHE  20           HE2      PHE  20   8.690   3.230   4.253
  163    HZ   PHE  20           HZ       PHE  20   8.577   1.263   2.755
  164    H    ASN  21           H        ASN  21   6.457  -1.045   7.622
  165    HA   ASN  21           HA       ASN  21   8.221   0.333   9.566
  166   1HB   ASN  21          1HB       ASN  21   7.353  -2.355   8.855
  167   2HB   ASN  21          2HB       ASN  21   9.102  -2.249   8.970
  168   1HD2  ASN  21          2HD2      ASN  21   6.130  -1.427  10.813
  169   2HD2  ASN  21          1HD2      ASN  21   6.845  -1.597  12.343
  170    H    HIS  22           H        HIS  22   9.448   1.770   8.216
  171    HA   HIS  22           HA       HIS  22  10.411   1.360   5.629
  172   1HB   HIS  22          1HB       HIS  22  11.422   2.765   8.084
  173   2HB   HIS  22          2HB       HIS  22  12.422   2.746   6.633
  174    HD1  HIS  22           HD1      HIS  22   9.588   4.465   8.164
  175    HD2  HIS  22           HD2      HIS  22  10.950   3.868   4.265
  176    HE1  HIS  22           HE1      HIS  22   8.521   6.269   6.747
  177    H    SER  23           H        SER  23  11.695   0.070   8.678
  178    HA   SER  23           HA       SER  23  14.196  -0.915   7.896
  179   1HB   SER  23          1HB       SER  23  13.581  -1.205  10.141
  180   2HB   SER  23          2HB       SER  23  11.996  -1.848   9.723
  181    HG   SER  23           HG       SER  23  14.049  -3.240  10.372
  182    H    THR  24           H        THR  24  10.977  -2.272   7.247
  183    HA   THR  24           HA       THR  24  12.040  -4.651   5.906
  184    HB   THR  24           HB       THR  24   9.280  -4.005   5.332
  185    HG1  THR  24           1HG      THR  24   9.985  -3.968   8.071
  186   1HG2  THR  24          1HG2      THR  24   9.430  -5.979   7.319
  187   2HG2  THR  24          2HG2      THR  24  10.920  -6.149   6.391
  188   3HG2  THR  24          3HG2      THR  24   9.358  -6.240   5.576
  189    H    HIS  25           H        HIS  25  11.880  -1.442   5.031
  190    HA   HIS  25           HA       HIS  25  11.580  -2.128   2.137
  191   1HB   HIS  25          1HB       HIS  25  10.812   0.341   3.715
  192   2HB   HIS  25          2HB       HIS  25  10.609   0.145   1.979
  193    HD1  HIS  25           HD1      HIS  25   9.284  -1.072   5.264
  194    HD2  HIS  25           HD2      HIS  25   8.537  -1.662   1.209
  195    HE1  HIS  25           HE1      HIS  25   7.122  -2.381   5.120
  196    H    LYS  26           H        LYS  26  13.657  -0.921   4.566
  197    HA   LYS  26           HA       LYS  26  15.154   1.113   3.365
  198   1HB   LYS  26          1HB       LYS  26  16.086  -1.318   4.931
  199   2HB   LYS  26          2HB       LYS  26  17.025   0.159   4.713
  200   1HG   LYS  26          1HG       LYS  26  14.929   1.362   5.681
  201   2HG   LYS  26          2HG       LYS  26  14.478  -0.239   6.268
  202   1HD   LYS  26          1HD       LYS  26  15.764   0.306   8.065
  203   2HD   LYS  26          2HD       LYS  26  17.108  -0.127   7.008
  204   1HE   LYS  26          1HE       LYS  26  17.859   1.998   7.323
  205   2HE   LYS  26          2HE       LYS  26  16.503   2.519   6.301
  206   1HZ   LYS  26          1HZ       LYS  26  16.599   3.466   8.647
  207   2HZ   LYS  26          2HZ       LYS  26  16.145   1.917   9.175
  208   3HZ   LYS  26          3HZ       LYS  26  15.121   2.801   8.147
  209    H    ALA  27           H        ALA  27  14.912  -2.256   2.478
  210    HA   ALA  27           HA       ALA  27  17.274  -2.189   0.712
  211   1HB   ALA  27          1HB       ALA  27  16.633  -4.201   1.989
  212   2HB   ALA  27          2HB       ALA  27  16.532  -4.521   0.257
  213   3HB   ALA  27          3HB       ALA  27  15.063  -4.219   1.184
  214    H    VAL  28           H        VAL  28  14.060  -1.156   0.536
  215    HA   VAL  28           HA       VAL  28  13.601  -1.789  -2.296
  216    HB   VAL  28           HB       VAL  28  12.209  -0.117  -0.192
  217   1HG1  VAL  28          1HG1      VAL  28  10.316  -0.027  -1.832
  218   2HG1  VAL  28          2HG1      VAL  28  11.407  -0.674  -3.056
  219   3HG1  VAL  28          3HG1      VAL  28  11.727   0.903  -2.334
  220   1HG2  VAL  28          1HG2      VAL  28  10.673  -1.911  -0.045
  221   2HG2  VAL  28          2HG2      VAL  28  12.246  -2.703  -0.145
  222   3HG2  VAL  28          3HG2      VAL  28  11.214  -2.606  -1.572
  223    H    LYS  29           H        LYS  29  12.950   0.257  -3.677
  224    HA   LYS  29           HA       LYS  29  15.292   2.056  -3.607
  225   1HB   LYS  29          1HB       LYS  29  13.453   0.982  -5.541
  226   2HB   LYS  29          2HB       LYS  29  13.475   2.743  -5.649
  227   1HG   LYS  29          1HG       LYS  29  15.327   2.423  -6.920
  228   2HG   LYS  29          2HG       LYS  29  16.131   2.213  -5.363
  229   1HD   LYS  29          1HD       LYS  29  14.923  -0.276  -6.028
  230   2HD   LYS  29          2HD       LYS  29  15.783   0.284  -7.462
  231   1HE   LYS  29          1HE       LYS  29  17.836   0.598  -6.136
  232   2HE   LYS  29          2HE       LYS  29  16.979   0.071  -4.673
  233   1HZ   LYS  29          1HZ       LYS  29  16.318  -1.908  -6.243
  234   2HZ   LYS  29          2HZ       LYS  29  17.786  -1.927  -5.389
  235   3HZ   LYS  29          3HZ       LYS  29  17.760  -1.489  -7.031
  236    H    CYS  30           H        CYS  30  15.015   3.628  -2.115
  237    HA   CYS  30           HA       CYS  30  12.709   4.796  -1.075
  238   1HB   CYS  30          1HB       CYS  30  15.470   5.815  -1.715
  239   2HB   CYS  30          2HB       CYS  30  14.274   6.915  -1.035
  240    H    GLY  31           H        GLY  31  14.057   5.135  -4.267
  241   1HA   GLY  31          1HA       GLY  31  12.393   7.475  -4.929
  242   2HA   GLY  31          2HA       GLY  31  13.508   6.656  -6.023
  243    H    ASP  32           H        ASP  32  12.071   4.062  -4.915
  244    HA   ASP  32           HA       ASP  32  10.182   3.905  -7.151
  245   1HB   ASP  32          1HB       ASP  32  11.749   2.165  -5.653
  246   2HB   ASP  32          2HB       ASP  32  10.112   1.789  -5.119
  247    H    CYS  33           H        CYS  33  10.054   4.242  -3.636
  248    HA   CYS  33           HA       CYS  33   7.087   4.175  -3.617
  249   1HB   CYS  33          1HB       CYS  33   9.355   4.228  -1.647
  250   2HB   CYS  33          2HB       CYS  33   7.779   4.795  -1.107
  251    H    HIS  34           H        HIS  34   9.697   6.417  -2.614
  252    HA   HIS  34           HA       HIS  34   7.844   8.727  -2.714
  253   1HB   HIS  34          1HB       HIS  34  10.741   8.272  -1.942
  254   2HB   HIS  34          2HB       HIS  34  10.002   9.869  -1.940
  255    HD1  HIS  34           HD1      HIS  34   7.511   9.775  -0.526
  256    HD2  HIS  34           HD2      HIS  34  10.546   7.123   0.534
  257    HE1  HIS  34           HE1      HIS  34   7.012   9.019   1.840
  258    H    HIS  35           H        HIS  35   8.471   7.324  -5.213
  259    HA   HIS  35           HA       HIS  35  10.415   8.083  -6.914
  260   1HB   HIS  35          1HB       HIS  35   8.571   8.355  -8.636
  261   2HB   HIS  35          2HB       HIS  35   8.452   6.907  -7.653
  262    HD1  HIS  35           HD1      HIS  35   6.987  10.305  -8.042
  263    HD2  HIS  35           HD2      HIS  35   6.170   6.791  -5.982
  264    HE1  HIS  35           HE1      HIS  35   4.682  10.596  -7.045
  265    HA   PRO  36           HA       PRO  36  10.882  12.412  -7.222
  266   1HB   PRO  36          1HB       PRO  36  11.247  12.763  -9.919
  267   2HB   PRO  36          2HB       PRO  36  12.481  12.059  -8.853
  268   1HG   PRO  36          1HG       PRO  36  10.535  10.689 -10.653
  269   2HG   PRO  36          2HG       PRO  36  12.251  10.342 -10.377
  270   1HD   PRO  36          1HD       PRO  36  10.294   8.891  -9.225
  271   2HD   PRO  36          2HD       PRO  36  11.843   9.204  -8.409
  272    H    VAL  37           H        VAL  37   9.199  13.820  -6.959
  273    HA   VAL  37           HA       VAL  37   6.813  13.573  -8.723
  274    HB   VAL  37           HB       VAL  37   7.419  14.279  -5.942
  275   1HG1  VAL  37          1HG1      VAL  37   5.383  15.961  -7.437
  276   2HG1  VAL  37          2HG1      VAL  37   6.909  16.555  -6.782
  277   3HG1  VAL  37          3HG1      VAL  37   5.650  15.969  -5.694
  278   1HG2  VAL  37          1HG2      VAL  37   4.642  13.908  -6.428
  279   2HG2  VAL  37          2HG2      VAL  37   5.786  12.745  -5.758
  280   3HG2  VAL  37          3HG2      VAL  37   5.507  12.805  -7.499
  281    H    ASN  38           H        ASN  38   9.548  14.985  -9.156
  282    HA   ASN  38           HA       ASN  38   8.645  17.108 -10.845
  283   1HB   ASN  38          1HB       ASN  38   8.115  17.869  -8.412
  284   2HB   ASN  38          2HB       ASN  38   9.840  18.090  -8.250
  285   1HD2  ASN  38          2HD2      ASN  38   9.712  18.737 -11.356
  286   2HD2  ASN  38          1HD2      ASN  38   9.296  20.382 -11.357
  287    H    GLY  39           H        GLY  39  11.250  17.523  -8.543
  288   1HA   GLY  39          1HA       GLY  39  13.233  16.689 -10.606
  289   2HA   GLY  39          2HA       GLY  39  13.455  18.173  -9.668
  290    H    LYS  40           H        LYS  40  11.868  16.042  -7.699
  291    HA   LYS  40           HA       LYS  40  14.202  14.473  -6.808
  292   1HB   LYS  40          1HB       LYS  40  14.164  15.636  -4.558
  293   2HB   LYS  40          2HB       LYS  40  14.738  16.645  -5.886
  294   1HG   LYS  40          1HG       LYS  40  12.151  17.255  -6.067
  295   2HG   LYS  40          2HG       LYS  40  12.171  16.795  -4.364
  296   1HD   LYS  40          1HD       LYS  40  13.658  18.500  -3.783
  297   2HD   LYS  40          2HD       LYS  40  14.282  18.650  -5.425
  298   1HE   LYS  40          1HE       LYS  40  12.136  19.632  -6.164
  299   2HE   LYS  40          2HE       LYS  40  11.505  19.485  -4.511
  300   1HZ   LYS  40          1HZ       LYS  40  12.994  21.017  -3.700
  301   2HZ   LYS  40          2HZ       LYS  40  12.679  21.670  -5.236
  302   3HZ   LYS  40          3HZ       LYS  40  14.104  20.785  -4.961
  303    H    GLU  41           H        GLU  41  13.524  12.715  -5.586
  304    HA   GLU  41           HA       GLU  41  10.781  11.932  -5.550
  305   1HB   GLU  41          1HB       GLU  41  13.358  11.085  -4.308
  306   2HB   GLU  41          2HB       GLU  41  11.871  10.358  -3.700
  307   1HG   GLU  41          1HG       GLU  41  11.511   9.185  -5.629
  308   2HG   GLU  41          2HG       GLU  41  12.105  10.495  -6.650
  309    H    ASP  42           H        ASP  42   9.193  12.859  -4.307
  310    HA   ASP  42           HA       ASP  42   9.698  14.526  -2.028
  311   1HB   ASP  42          1HB       ASP  42   7.290  13.033  -3.085
  312   2HB   ASP  42          2HB       ASP  42   7.199  14.113  -1.694
  313    H    TYR  43           H        TYR  43  10.739  13.618  -0.274
  314    HA   TYR  43           HA       TYR  43  10.166  10.839   0.534
  315   1HB   TYR  43          1HB       TYR  43  11.982  13.005   1.644
  316   2HB   TYR  43          2HB       TYR  43  11.995  11.315   2.149
  317    HD1  TYR  43           HD1      TYR  43  12.441   9.520   0.362
  318    HD2  TYR  43           HD2      TYR  43  13.195  13.705  -0.257
  319    HE1  TYR  43           HE1      TYR  43  13.951   8.971  -1.525
  320    HE2  TYR  43           HE2      TYR  43  14.704  13.154  -2.144
  321    HH   TYR  43           HH       TYR  43  16.033  10.267  -2.649
  322    H    GLN  44           H        GLN  44   7.785  11.938   0.908
  323    HA   GLN  44           HA       GLN  44   7.644  12.488   3.850
  324   1HB   GLN  44          1HB       GLN  44   5.820  14.159   3.205
  325   2HB   GLN  44          2HB       GLN  44   7.464  14.625   2.768
  326   1HG   GLN  44          1HG       GLN  44   7.100  13.765   0.481
  327   2HG   GLN  44          2HG       GLN  44   5.451  13.314   0.916
  328   1HE2  GLN  44          2HE2      GLN  44   7.186  16.294   1.898
  329   2HE2  GLN  44          1HE2      GLN  44   6.119  17.359   1.120
  330    H    LYS  45           H        LYS  45   5.220  12.305   4.546
  331    HA   LYS  45           HA       LYS  45   4.269   9.736   4.323
  332   1HB   LYS  45          1HB       LYS  45   1.984  10.837   4.720
  333   2HB   LYS  45          2HB       LYS  45   3.261  11.237   5.861
  334   1HG   LYS  45          1HG       LYS  45   3.741  13.303   4.540
  335   2HG   LYS  45          2HG       LYS  45   2.371  12.914   3.498
  336   1HD   LYS  45          1HD       LYS  45   0.812  13.406   5.128
  337   2HD   LYS  45          2HD       LYS  45   1.895  12.961   6.446
  338   1HE   LYS  45          1HE       LYS  45   2.749  15.073   6.611
  339   2HE   LYS  45          2HE       LYS  45   2.799  15.286   4.850
  340   1HZ   LYS  45          1HZ       LYS  45   0.537  15.774   4.763
  341   2HZ   LYS  45          2HZ       LYS  45   1.059  16.616   6.143
  342   3HZ   LYS  45          3HZ       LYS  45   0.232  15.142   6.308
  343    H    CYS  46           H        CYS  46   3.346   8.513   2.767
  344    HA   CYS  46           HA       CYS  46   3.269   9.133   0.042
  345   1HB   CYS  46          1HB       CYS  46   1.573   7.289   1.741
  346   2HB   CYS  46          2HB       CYS  46   1.668   7.191  -0.015
  347    H    ALA  47           H        ALA  47   0.739   9.567   2.481
  348    HA   ALA  47           HA       ALA  47  -1.026  10.848   0.433
  349   1HB   ALA  47          1HB       ALA  47  -1.760   8.908   1.881
  350   2HB   ALA  47          2HB       ALA  47  -2.785  10.341   2.001
  351   3HB   ALA  47          3HB       ALA  47  -1.613   9.987   3.269
  352    H    THR  48           H        THR  48   1.084  12.477   1.184
  353    HA   THR  48           HA       THR  48   0.932  14.092   3.430
  354    HB   THR  48           HB       THR  48   1.324  15.394   0.775
  355    HG1  THR  48           1HG      THR  48   3.334  13.697   1.657
  356   1HG2  THR  48          1HG2      THR  48   2.830  16.645   1.930
  357   2HG2  THR  48          2HG2      THR  48   3.473  15.248   2.793
  358   3HG2  THR  48          3HG2      THR  48   1.989  16.023   3.349
  359    H    ALA  49           H        ALA  49   0.259  16.620   2.998
  360    HA   ALA  49           HA       ALA  49  -2.616  16.685   3.160
  361   1HB   ALA  49          1HB       ALA  49  -1.149  18.251   4.323
  362   2HB   ALA  49          2HB       ALA  49  -2.186  19.155   3.219
  363   3HB   ALA  49          3HB       ALA  49  -0.507  18.833   2.788
  364    H    GLY  50           H        GLY  50  -0.569  16.527   0.464
  365   1HA   GLY  50          1HA       GLY  50  -2.823  17.244  -1.324
  366   2HA   GLY  50          2HA       GLY  50  -1.303  18.113  -1.561
  367    H    CYS  51           H        CYS  51  -1.027  14.947  -0.356
  368    HA   CYS  51           HA       CYS  51   0.093  14.010  -2.938
  369   1HB   CYS  51          1HB       CYS  51   0.602  13.891  -0.068
  370   2HB   CYS  51          2HB       CYS  51   0.751  12.329  -0.808
  371    H    HIS  52           H        HIS  52  -0.303  11.231  -1.372
  372    HA   HIS  52           HA       HIS  52  -2.753  10.512  -2.797
  373   1HB   HIS  52          1HB       HIS  52  -0.875   9.086  -0.900
  374   2HB   HIS  52          2HB       HIS  52  -2.229   8.293  -1.679
  375    HD1  HIS  52           HD1      HIS  52  -2.199   8.683  -4.402
  376    HD2  HIS  52           HD2      HIS  52   1.434   8.905  -2.405
  377    HE1  HIS  52           HE1      HIS  52  -0.401   8.346  -6.163
  378    H    ASP  53           H        ASP  53  -3.723  12.417  -1.243
  379    HA   ASP  53           HA       ASP  53  -4.640  11.198   1.325
  380   1HB   ASP  53          1HB       ASP  53  -5.183  13.572   1.864
  381   2HB   ASP  53          2HB       ASP  53  -3.488  13.357   1.420
  382    H    ASN  54           H        ASN  54  -5.812  10.831  -1.586
  383    HA   ASN  54           HA       ASN  54  -8.465  12.063  -1.351
  384   1HB   ASN  54          1HB       ASN  54  -6.844  10.777  -3.316
  385   2HB   ASN  54          2HB       ASN  54  -8.357   9.884  -3.215
  386   1HD2  ASN  54          2HD2      ASN  54  -9.802  10.688  -4.736
  387   2HD2  ASN  54          1HD2      ASN  54 -10.003  12.328  -5.121
  388    H    MET  55           H        MET  55  -9.654  11.267   0.375
  389    HA   MET  55           HA       MET  55  -9.508   8.472   1.206
  390   1HB   MET  55          1HB       MET  55 -11.412  10.720   1.943
  391   2HB   MET  55          2HB       MET  55 -11.131   9.250   2.872
  392   1HG   MET  55          1HG       MET  55  -8.589  10.109   2.665
  393   2HG   MET  55          2HG       MET  55  -9.417  11.664   2.586
  394   1HE   MET  55          1HE       MET  55  -9.051   8.339   4.277
  395   2HE   MET  55          2HE       MET  55 -10.795   8.437   4.520
  396   3HE   MET  55          3HE       MET  55  -9.712   8.521   5.909
  397    H    ASP  56           H        ASP  56 -10.581   9.249  -1.588
  398    HA   ASP  56           HA       ASP  56 -13.417   8.532  -1.512
  399   1HB   ASP  56          1HB       ASP  56 -11.959   9.980  -3.184
  400   2HB   ASP  56          2HB       ASP  56 -11.664   8.419  -3.951
  401    H    LYS  57           H        LYS  57 -10.396   6.855  -1.607
  402    HA   LYS  57           HA       LYS  57  -9.899   4.549  -1.740
  403   1HB   LYS  57          1HB       LYS  57 -12.887   4.361  -1.272
  404   2HB   LYS  57          2HB       LYS  57 -11.692   3.118  -0.906
  405   1HG   LYS  57          1HG       LYS  57 -10.783   4.338   0.876
  406   2HG   LYS  57          2HG       LYS  57 -11.423   5.869   0.280
  407   1HD   LYS  57          1HD       LYS  57 -12.678   5.035   2.262
  408   2HD   LYS  57          2HD       LYS  57 -13.701   5.169   0.830
  409   1HE   LYS  57          1HE       LYS  57 -12.410   2.552   0.978
  410   2HE   LYS  57          2HE       LYS  57 -13.414   2.883   2.404
  411   1HZ   LYS  57          1HZ       LYS  57 -15.083   3.792   0.720
  412   2HZ   LYS  57          2HZ       LYS  57 -14.930   2.104   0.835
  413   3HZ   LYS  57          3HZ       LYS  57 -14.193   2.941  -0.446
  414    H    LYS  58           H        LYS  58 -11.228   6.188  -4.106
  415    HA   LYS  58           HA       LYS  58 -11.309   3.868  -5.948
  416   1HB   LYS  58          1HB       LYS  58 -13.587   5.855  -5.677
  417   2HB   LYS  58          2HB       LYS  58 -13.541   4.447  -6.740
  418   1HG   LYS  58          1HG       LYS  58 -13.282   3.005  -4.689
  419   2HG   LYS  58          2HG       LYS  58 -13.569   4.445  -3.711
  420   1HD   LYS  58          1HD       LYS  58 -15.794   4.359  -4.078
  421   2HD   LYS  58          2HD       LYS  58 -15.567   4.150  -5.814
  422   1HE   LYS  58          1HE       LYS  58 -14.734   1.713  -4.648
  423   2HE   LYS  58          2HE       LYS  58 -16.255   2.149  -3.843
  424   1HZ   LYS  58          1HZ       LYS  58 -17.340   2.410  -5.895
  425   2HZ   LYS  58          2HZ       LYS  58 -16.471   0.959  -6.050
  426   3HZ   LYS  58          3HZ       LYS  58 -15.890   2.382  -6.773
  427    H    ASP  59           H        ASP  59  -9.946   6.685  -5.338
  428    HA   ASP  59           HA       ASP  59 -10.411   8.386  -7.579
  429   1HB   ASP  59          1HB       ASP  59  -9.214   9.265  -5.750
  430   2HB   ASP  59          2HB       ASP  59  -8.149   7.865  -5.660
  431    H    LYS  60           H        LYS  60  -8.481   5.462  -7.225
  432    HA   LYS  60           HA       LYS  60  -7.090   4.325  -8.780
  433   1HB   LYS  60          1HB       LYS  60  -9.685   5.073  -9.865
  434   2HB   LYS  60          2HB       LYS  60  -8.488   4.889 -11.148
  435   1HG   LYS  60          1HG       LYS  60  -8.982   2.839  -8.970
  436   2HG   LYS  60          2HG       LYS  60  -9.663   2.748 -10.594
  437   1HD   LYS  60          1HD       LYS  60  -6.770   3.224 -10.591
  438   2HD   LYS  60          2HD       LYS  60  -7.222   1.699  -9.828
  439   1HE   LYS  60          1HE       LYS  60  -8.329   0.919 -11.793
  440   2HE   LYS  60          2HE       LYS  60  -8.323   2.536 -12.525
  441   1HZ   LYS  60          1HZ       LYS  60  -6.508   1.106 -13.360
  442   2HZ   LYS  60          2HZ       LYS  60  -5.880   1.015 -11.785
  443   3HZ   LYS  60          3HZ       LYS  60  -5.938   2.508 -12.594
  444    H    SER  61           H        SER  61  -6.599   7.326  -8.360
  445    HA   SER  61           HA       SER  61  -5.240   7.874 -10.980
  446   1HB   SER  61          1HB       SER  61  -7.123   9.338  -9.482
  447   2HB   SER  61          2HB       SER  61  -5.586  10.157  -9.221
  448    HG   SER  61           HG       SER  61  -5.421   9.822 -11.654
  449    H    ALA  62           H        ALA  62  -3.445   9.754 -10.303
  450    HA   ALA  62           HA       ALA  62  -1.509   8.290  -8.648
  451   1HB   ALA  62          1HB       ALA  62  -1.580  10.336 -10.703
  452   2HB   ALA  62          2HB       ALA  62  -0.236   9.302 -10.217
  453   3HB   ALA  62          3HB       ALA  62  -0.524  10.826  -9.378
  454    H    LYS  63           H        LYS  63  -4.042  10.135  -7.775
  455    HA   LYS  63           HA       LYS  63  -2.557  11.456  -5.523
  456   1HB   LYS  63          1HB       LYS  63  -4.028  12.615  -7.536
  457   2HB   LYS  63          2HB       LYS  63  -5.241  12.439  -6.266
  458   1HG   LYS  63          1HG       LYS  63  -4.365  14.194  -5.170
  459   2HG   LYS  63          2HG       LYS  63  -2.811  13.367  -5.068
  460   1HD   LYS  63          1HD       LYS  63  -1.971  14.412  -6.956
  461   2HD   LYS  63          2HD       LYS  63  -3.569  14.643  -7.666
  462   1HE   LYS  63          1HE       LYS  63  -4.028  16.304  -5.769
  463   2HE   LYS  63          2HE       LYS  63  -2.288  16.232  -5.428
  464   1HZ   LYS  63          1HZ       LYS  63  -2.710  17.977  -7.016
  465   2HZ   LYS  63          2HZ       LYS  63  -3.548  16.907  -8.034
  466   3HZ   LYS  63          3HZ       LYS  63  -1.878  16.717  -7.788
  467    H    GLY  64           H        GLY  64  -4.612   8.943  -6.290
  468   1HA   GLY  64          1HA       GLY  64  -6.266   9.198  -3.846
  469   2HA   GLY  64          2HA       GLY  64  -6.486   7.997  -5.108
  470    H    TYR  65           H        TYR  65  -5.752   8.156  -2.009
  471    HA   TYR  65           HA       TYR  65  -3.318   6.768  -1.598
  472   1HB   TYR  65          1HB       TYR  65  -5.232   7.861  -0.072
  473   2HB   TYR  65          2HB       TYR  65  -5.753   6.182   0.048
  474    HD1  TYR  65           HD1      TYR  65  -2.196   6.942  -0.465
  475    HD2  TYR  65           HD2      TYR  65  -5.238   6.157   2.467
  476    HE1  TYR  65           HE1      TYR  65  -0.448   6.527   1.236
  477    HE2  TYR  65           HE2      TYR  65  -3.482   5.739   4.168
  478    HH   TYR  65           HH       TYR  65  -0.069   6.304   3.464
  479    H    TYR  66           H        TYR  66  -6.604   5.355  -1.599
  480    HA   TYR  66           HA       TYR  66  -6.110   2.658  -1.559
  481   1HB   TYR  66          1HB       TYR  66  -8.199   4.308  -2.089
  482   2HB   TYR  66          2HB       TYR  66  -7.963   3.585  -3.679
  483    HD1  TYR  66           HD1      TYR  66  -7.805   1.016  -3.815
  484    HD2  TYR  66           HD2      TYR  66  -9.299   3.129  -0.391
  485    HE1  TYR  66           HE1      TYR  66  -8.950  -1.046  -3.047
  486    HE2  TYR  66           HE2      TYR  66 -10.447   1.069   0.378
  487    HH   TYR  66           HH       TYR  66 -10.334  -1.928  -1.549
  488    H    HIS  67           H        HIS  67  -6.507   4.329  -4.695
  489    HA   HIS  67           HA       HIS  67  -5.716   2.414  -6.467
  490   1HB   HIS  67          1HB       HIS  67  -6.349   4.652  -7.130
  491   2HB   HIS  67          2HB       HIS  67  -4.910   5.330  -6.364
  492    HD1  HIS  67           HD1      HIS  67  -5.662   2.663  -8.982
  493    HD2  HIS  67           HD2      HIS  67  -2.844   5.626  -8.179
  494    HE1  HIS  67           HE1      HIS  67  -3.963   2.555 -10.848
  495    H    ALA  68           H        ALA  68  -3.204   4.789  -5.771
  496    HA   ALA  68           HA       ALA  68  -0.980   3.302  -6.480
  497   1HB   ALA  68          1HB       ALA  68  -1.591   5.524  -4.596
  498   2HB   ALA  68          2HB       ALA  68  -0.483   5.486  -5.967
  499   3HB   ALA  68          3HB       ALA  68  -0.005   4.772  -4.426
  500    H    MET  69           H        MET  69  -2.907   2.897  -3.563
  501    HA   MET  69           HA       MET  69  -0.828   1.304  -2.219
  502   1HB   MET  69          1HB       MET  69  -3.695   2.016  -1.580
  503   2HB   MET  69          2HB       MET  69  -2.600   1.191  -0.475
  504   1HG   MET  69          1HG       MET  69  -1.438   3.611  -1.649
  505   2HG   MET  69          2HG       MET  69  -2.878   3.931  -0.686
  506   1HE   MET  69          1HE       MET  69   0.116   5.012   0.110
  507   2HE   MET  69          2HE       MET  69   0.631   3.648  -0.880
  508   3HE   MET  69          3HE       MET  69   1.168   3.764   0.794
  509    H    HIS  70           H        HIS  70  -3.858   0.676  -3.981
  510    HA   HIS  70           HA       HIS  70  -3.439  -2.236  -3.431
  511   1HB   HIS  70          1HB       HIS  70  -5.906  -0.727  -4.350
  512   2HB   HIS  70          2HB       HIS  70  -5.842  -2.417  -3.850
  513    HD1  HIS  70           HD1      HIS  70  -5.939   1.051  -2.513
  514    HD2  HIS  70           HD2      HIS  70  -5.384  -2.799  -1.022
  515    HE1  HIS  70           HE1      HIS  70  -6.143   1.226   0.004
  516    H    ASP  71           H        ASP  71  -3.172   0.122  -5.890
  517    HA   ASP  71           HA       ASP  71  -3.815  -1.700  -8.116
  518   1HB   ASP  71          1HB       ASP  71  -2.821   1.129  -7.785
  519   2HB   ASP  71          2HB       ASP  71  -2.904   0.372  -9.374
  520    H    LYS  72           H        LYS  72  -2.178  -2.232  -9.770
  521    HA   LYS  72           HA       LYS  72   0.568  -2.508  -8.597
  522   1HB   LYS  72          1HB       LYS  72   0.684  -4.593  -9.854
  523   2HB   LYS  72          2HB       LYS  72  -0.815  -4.582  -8.925
  524   1HG   LYS  72          1HG       LYS  72  -1.972  -3.668 -10.984
  525   2HG   LYS  72          2HG       LYS  72  -0.480  -3.980 -11.873
  526   1HD   LYS  72          1HD       LYS  72  -0.707  -6.279 -11.727
  527   2HD   LYS  72          2HD       LYS  72  -1.632  -6.197 -10.228
  528   1HE   LYS  72          1HE       LYS  72  -3.602  -5.386 -11.437
  529   2HE   LYS  72          2HE       LYS  72  -2.679  -5.350 -12.953
  530   1HZ   LYS  72          1HZ       LYS  72  -2.120  -7.786 -12.258
  531   2HZ   LYS  72          2HZ       LYS  72  -3.580  -7.442 -13.056
  532   3HZ   LYS  72          3HZ       LYS  72  -3.561  -7.664 -11.372
  533    H    GLY  73           H        GLY  73  -1.221  -2.088 -11.656
  534   1HA   GLY  73          1HA       GLY  73   1.184  -1.373 -13.143
  535   2HA   GLY  73          2HA       GLY  73  -0.475  -1.235 -13.733
  536    H    THR  74           H        THR  74   1.471   0.220 -11.115
  537    HA   THR  74           HA       THR  74   0.175   2.848 -11.710
  538    HB   THR  74           HB       THR  74   1.300   3.247  -9.366
  539    HG1  THR  74           1HG      THR  74   2.486   1.222  -9.626
  540   1HG2  THR  74          1HG2      THR  74  -1.042   1.406  -9.885
  541   2HG2  THR  74          2HG2      THR  74  -1.088   3.139  -9.562
  542   3HG2  THR  74          3HG2      THR  74  -0.640   2.014  -8.279
  543    H    LYS  75           H        LYS  75   1.587   4.776 -11.619
  544    HA   LYS  75           HA       LYS  75   3.761   4.921 -13.281
  545   1HB   LYS  75          1HB       LYS  75   2.474   6.626 -11.652
  546   2HB   LYS  75          2HB       LYS  75   3.925   6.401 -10.681
  547   1HG   LYS  75          1HG       LYS  75   4.079   8.328 -12.284
  548   2HG   LYS  75          2HG       LYS  75   5.335   7.115 -12.520
  549   1HD   LYS  75          1HD       LYS  75   2.981   6.439 -14.062
  550   2HD   LYS  75          2HD       LYS  75   3.527   8.070 -14.454
  551   1HE   LYS  75          1HE       LYS  75   5.766   6.200 -14.214
  552   2HE   LYS  75          2HE       LYS  75   4.618   5.727 -15.484
  553   1HZ   LYS  75          1HZ       LYS  75   5.589   8.507 -15.128
  554   2HZ   LYS  75          2HZ       LYS  75   4.718   7.873 -16.440
  555   3HZ   LYS  75          3HZ       LYS  75   6.331   7.404 -16.181
  556    H    PHE  76           H        PHE  76   3.760   3.790  -9.937
  557    HA   PHE  76           HA       PHE  76   6.543   2.747 -10.322
  558   1HB   PHE  76          1HB       PHE  76   5.446   4.175  -7.882
  559   2HB   PHE  76          2HB       PHE  76   7.081   3.555  -8.075
  560    HD1  PHE  76           HD1      PHE  76   8.525   4.528  -9.962
  561    HD2  PHE  76           HD2      PHE  76   4.820   6.282  -8.683
  562    HE1  PHE  76           HE1      PHE  76   9.151   6.662 -11.061
  563    HE2  PHE  76           HE2      PHE  76   5.446   8.412  -9.778
  564    HZ   PHE  76           HZ       PHE  76   7.605   8.597 -10.965
  565    H    LYS  77           H        LYS  77   7.026   1.146  -8.399
  566    HA   LYS  77           HA       LYS  77   4.884  -0.801  -8.310
  567   1HB   LYS  77          1HB       LYS  77   6.431  -1.967  -6.794
  568   2HB   LYS  77          2HB       LYS  77   7.280  -1.380  -8.223
  569   1HG   LYS  77          1HG       LYS  77   7.714   0.743  -6.741
  570   2HG   LYS  77          2HG       LYS  77   7.382  -0.360  -5.406
  571   1HD   LYS  77          1HD       LYS  77   9.539  -0.601  -7.516
  572   2HD   LYS  77          2HD       LYS  77   9.752  -0.459  -5.771
  573   1HE   LYS  77          1HE       LYS  77   9.523  -2.700  -5.484
  574   2HE   LYS  77          2HE       LYS  77   8.071  -2.750  -6.503
  575   1HZ   LYS  77          1HZ       LYS  77   9.295  -2.974  -8.410
  576   2HZ   LYS  77          2HZ       LYS  77  10.283  -3.834  -7.328
  577   3HZ   LYS  77          3HZ       LYS  77  10.675  -2.237  -7.757
  578    H    SER  78           H        SER  78   3.150  -0.469  -7.153
  579    HA   SER  78           HA       SER  78   2.943   1.456  -4.991
  580   1HB   SER  78          1HB       SER  78   0.619  -0.027  -5.070
  581   2HB   SER  78          2HB       SER  78   0.956   1.382  -6.070
  582    HG   SER  78           HG       SER  78   0.350  -0.678  -7.149
  583    H    CYS  79           H        CYS  79   1.534   0.606  -3.019
  584    HA   CYS  79           HA       CYS  79   3.171  -1.043  -1.373
  585   1HB   CYS  79          1HB       CYS  79   0.250  -0.237  -1.258
  586   2HB   CYS  79          2HB       CYS  79   1.121  -0.957   0.093
  587    H    VAL  80           H        VAL  80  -0.157  -1.824  -2.413
  588    HA   VAL  80           HA       VAL  80   0.168  -4.666  -1.989
  589    HB   VAL  80           HB       VAL  80  -1.816  -2.900  -3.427
  590   1HG1  VAL  80          1HG1      VAL  80  -1.471  -5.803  -3.574
  591   2HG1  VAL  80          2HG1      VAL  80  -2.477  -4.742  -4.561
  592   3HG1  VAL  80          3HG1      VAL  80  -3.074  -5.332  -3.010
  593   1HG2  VAL  80          1HG2      VAL  80  -2.607  -4.605  -1.141
  594   2HG2  VAL  80          2HG2      VAL  80  -2.972  -2.909  -1.455
  595   3HG2  VAL  80          3HG2      VAL  80  -1.419  -3.360  -0.753
  596    H    GLY  81           H        GLY  81   0.700  -2.501  -4.705
  597   1HA   GLY  81          1HA       GLY  81   0.770  -4.499  -6.779
  598   2HA   GLY  81          2HA       GLY  81   1.501  -2.896  -6.880
  599    H    CYS  82           H        CYS  82   3.281  -3.039  -4.715
  600    HA   CYS  82           HA       CYS  82   5.449  -4.623  -5.870
  601   1HB   CYS  82          1HB       CYS  82   5.474  -2.343  -4.599
  602   2HB   CYS  82          2HB       CYS  82   5.379  -3.323  -3.140
  603    H    HIS  83           H        HIS  83   3.032  -4.980  -3.437
  604    HA   HIS  83           HA       HIS  83   4.286  -7.089  -1.902
  605   1HB   HIS  83          1HB       HIS  83   1.643  -5.724  -2.179
  606   2HB   HIS  83          2HB       HIS  83   1.684  -7.245  -1.311
  607    HD1  HIS  83           HD1      HIS  83   1.219  -5.891   0.934
  608    HD2  HIS  83           HD2      HIS  83   4.830  -4.985  -0.946
  609    HE1  HIS  83           HE1      HIS  83   2.622  -4.655   2.638
  610    H    LEU  84           H        LEU  84   1.449  -7.186  -4.140
  611    HA   LEU  84           HA       LEU  84   1.170  -9.950  -4.383
  612   1HB   LEU  84          1HB       LEU  84   0.273  -7.581  -5.583
  613   2HB   LEU  84          2HB       LEU  84   0.934  -8.528  -6.911
  614    HG   LEU  84           HG       LEU  84  -0.832  -9.864  -4.898
  615   1HD1  LEU  84          1HD1      LEU  84  -1.883  -7.674  -5.789
  616   2HD1  LEU  84          2HD1      LEU  84  -2.824  -9.156  -5.962
  617   3HD1  LEU  84          3HD1      LEU  84  -1.952  -8.500  -7.346
  618   1HD2  LEU  84          1HD2      LEU  84  -0.093 -10.232  -7.803
  619   2HD2  LEU  84          2HD2      LEU  84  -1.487 -11.055  -7.102
  620   3HD2  LEU  84          3HD2      LEU  84   0.129 -11.360  -6.465
  621    H    GLU  85           H        GLU  85   3.646  -7.846  -5.720
  622    HA   GLU  85           HA       GLU  85   4.729  -9.980  -7.467
  623   1HB   GLU  85          1HB       GLU  85   5.275  -7.064  -6.918
  624   2HB   GLU  85          2HB       GLU  85   6.426  -8.029  -7.842
  625   1HG   GLU  85          1HG       GLU  85   4.125  -8.743  -9.081
  626   2HG   GLU  85          2HG       GLU  85   3.709  -7.101  -8.590
  627    H    THR  86           H        THR  86   5.839  -7.976  -4.703
  628    HA   THR  86           HA       THR  86   8.349  -9.219  -4.289
  629    HB   THR  86           HB       THR  86   6.316  -7.813  -2.560
  630    HG1  THR  86           1HG      THR  86   7.432  -6.317  -3.528
  631   1HG2  THR  86          1HG2      THR  86   7.490  -9.537  -1.164
  632   2HG2  THR  86          2HG2      THR  86   7.832  -7.878  -0.671
  633   3HG2  THR  86          3HG2      THR  86   9.023  -8.783  -1.606
  634    H    ALA  87           H        ALA  87   5.150 -10.425  -3.774
  635    HA   ALA  87           HA       ALA  87   6.016 -12.528  -1.881
  636   1HB   ALA  87          1HB       ALA  87   3.444 -13.088  -2.486
  637   2HB   ALA  87          2HB       ALA  87   3.489 -11.400  -2.996
  638   3HB   ALA  87          3HB       ALA  87   3.884 -11.829  -1.331
  639    H    GLY  88           H        GLY  88   5.065 -12.147  -5.260
  640   1HA   GLY  88          1HA       GLY  88   5.224 -13.615  -7.080
  641   2HA   GLY  88          2HA       GLY  88   6.506 -14.416  -6.170
  642    H    ALA  89           H        ALA  89   5.968 -16.560  -6.348
  643    HA   ALA  89           HA       ALA  89   3.160 -17.433  -6.036
  644   1HB   ALA  89          1HB       ALA  89   5.563 -19.215  -6.270
  645   2HB   ALA  89          2HB       ALA  89   5.065 -18.247  -7.657
  646   3HB   ALA  89          3HB       ALA  89   3.956 -19.427  -6.961
  647    H    ASP  90           H        ASP  90   4.053 -16.271  -3.664
  648    HA   ASP  90           HA       ASP  90   4.556 -18.632  -1.898
  649   1HB   ASP  90          1HB       ASP  90   6.396 -17.025  -1.977
  650   2HB   ASP  90          2HB       ASP  90   5.290 -15.703  -1.612
  651    H    ALA  91           H        ALA  91   2.205 -18.898  -1.938
  652    HA   ALA  91           HA       ALA  91   0.133 -17.214  -1.352
  653   1HB   ALA  91          1HB       ALA  91   0.713 -19.856   0.029
  654   2HB   ALA  91          2HB       ALA  91   0.033 -19.687  -1.589
  655   3HB   ALA  91          3HB       ALA  91  -0.882 -19.134  -0.186
  656    H    ALA  92           H        ALA  92   2.737 -18.067   0.846
  657    HA   ALA  92           HA       ALA  92   1.470 -16.988   3.242
  658   1HB   ALA  92          1HB       ALA  92   3.534 -17.563   4.248
  659   2HB   ALA  92          2HB       ALA  92   4.433 -17.300   2.754
  660   3HB   ALA  92          3HB       ALA  92   3.404 -18.721   2.926
  661    H    LYS  93           H        LYS  93   3.819 -15.869   0.843
  662    HA   LYS  93           HA       LYS  93   4.167 -13.241   2.047
  663   1HB   LYS  93          1HB       LYS  93   5.013 -14.809  -0.319
  664   2HB   LYS  93          2HB       LYS  93   5.034 -13.063  -0.529
  665   1HG   LYS  93          1HG       LYS  93   6.329 -12.931   1.650
  666   2HG   LYS  93          2HG       LYS  93   6.470 -14.688   1.577
  667   1HD   LYS  93          1HD       LYS  93   7.429 -14.352  -0.782
  668   2HD   LYS  93          2HD       LYS  93   7.587 -12.649  -0.352
  669   1HE   LYS  93          1HE       LYS  93   8.889 -13.398   1.706
  670   2HE   LYS  93          2HE       LYS  93   8.926 -15.019   0.985
  671   1HZ   LYS  93          1HZ       LYS  93   9.862 -14.070  -1.029
  672   2HZ   LYS  93          2HZ       LYS  93  10.857 -13.718   0.303
  673   3HZ   LYS  93          3HZ       LYS  93   9.838 -12.520  -0.342
  674    H    LYS  94           H        LYS  94   1.969 -14.737  -0.229
  675    HA   LYS  94           HA       LYS  94   0.996 -12.228  -1.384
  676   1HB   LYS  94          1HB       LYS  94   0.782 -15.044  -1.797
  677   2HB   LYS  94          2HB       LYS  94  -0.854 -14.419  -1.590
  678   1HG   LYS  94          1HG       LYS  94   0.422 -12.526  -3.214
  679   2HG   LYS  94          2HG       LYS  94   0.963 -14.087  -3.835
  680   1HD   LYS  94          1HD       LYS  94  -1.836 -14.264  -3.237
  681   2HD   LYS  94          2HD       LYS  94  -1.561 -12.834  -4.233
  682   1HE   LYS  94          1HE       LYS  94   0.053 -14.725  -5.453
  683   2HE   LYS  94          2HE       LYS  94  -1.371 -15.669  -4.973
  684   1HZ   LYS  94          1HZ       LYS  94  -1.465 -13.041  -6.360
  685   2HZ   LYS  94          2HZ       LYS  94  -2.797 -14.015  -5.954
  686   3HZ   LYS  94          3HZ       LYS  94  -1.682 -14.539  -7.124
  687    H    LYS  95           H        LYS  95   0.285 -14.194   1.411
  688    HA   LYS  95           HA       LYS  95  -2.308 -12.876   1.932
  689   1HB   LYS  95          1HB       LYS  95  -2.497 -14.523   3.615
  690   2HB   LYS  95          2HB       LYS  95  -1.542 -15.334   2.375
  691   1HG   LYS  95          1HG       LYS  95  -0.034 -15.738   4.008
  692   2HG   LYS  95          2HG       LYS  95   0.378 -14.028   3.890
  693   1HD   LYS  95          1HD       LYS  95  -1.599 -13.650   5.523
  694   2HD   LYS  95          2HD       LYS  95  -1.477 -15.380   5.844
  695   1HE   LYS  95          1HE       LYS  95   0.937 -13.557   6.010
  696   2HE   LYS  95          2HE       LYS  95  -0.113 -13.870   7.406
  697   1HZ   LYS  95          1HZ       LYS  95   0.947 -16.067   5.733
  698   2HZ   LYS  95          2HZ       LYS  95   0.297 -16.153   7.300
  699   3HZ   LYS  95          3HZ       LYS  95   1.827 -15.459   7.049
  700    H    GLU  96           H        GLU  96   1.036 -12.471   2.682
  701    HA   GLU  96           HA       GLU  96   0.516 -10.761   5.053
  702   1HB   GLU  96          1HB       GLU  96   2.927 -10.908   5.282
  703   2HB   GLU  96          2HB       GLU  96   2.335 -12.509   4.878
  704   1HG   GLU  96          1HG       GLU  96   2.952 -12.195   2.562
  705   2HG   GLU  96          2HG       GLU  96   3.434 -10.528   2.886
  706    H    LEU  97           H        LEU  97   1.941 -10.588   1.823
  707    HA   LEU  97           HA       LEU  97   2.399  -7.706   1.911
  708   1HB   LEU  97          1HB       LEU  97   2.367  -9.713  -0.353
  709   2HB   LEU  97          2HB       LEU  97   3.101  -8.109  -0.403
  710    HG   LEU  97           HG       LEU  97   3.950 -10.499   1.228
  711   1HD1  LEU  97          1HD1      LEU  97   6.175  -9.353   0.213
  712   2HD1  LEU  97          2HD1      LEU  97   4.996  -8.857  -1.001
  713   3HD1  LEU  97          3HD1      LEU  97   5.233 -10.569  -0.650
  714   1HD2  LEU  97          1HD2      LEU  97   4.801  -7.607   1.594
  715   2HD2  LEU  97          2HD2      LEU  97   5.511  -8.995   2.416
  716   3HD2  LEU  97          3HD2      LEU  97   3.839  -8.540   2.741
  717    H    THR  98           H        THR  98   0.328  -9.661  -0.260
  718    HA   THR  98           HA       THR  98  -1.330  -7.273  -0.779
  719    HB   THR  98           HB       THR  98  -2.386  -8.868  -2.418
  720    HG1  THR  98           1HG      THR  98  -1.965 -10.779  -1.292
  721   1HG2  THR  98          1HG2      THR  98  -0.738  -8.349  -3.890
  722   2HG2  THR  98          2HG2      THR  98   0.492  -9.186  -2.942
  723   3HG2  THR  98          3HG2      THR  98   0.015  -7.543  -2.517
  724    H    GLY  99           H        GLY  99  -1.355  -9.766   1.493
  725   1HA   GLY  99          1HA       GLY  99  -4.095 -10.489   1.617
  726   2HA   GLY  99          2HA       GLY  99  -3.010 -10.465   3.007
  727    H    CYS 100           H        CYS 100  -5.832  -9.202   1.955
  728    HA   CYS 100           HA       CYS 100  -5.504  -6.433   2.845
  729   1HB   CYS 100          1HB       CYS 100  -8.188  -7.619   2.685
  730   2HB   CYS 100          2HB       CYS 100  -7.578  -6.164   1.948
  731    H    LYS 101           H        LYS 101  -7.616  -9.063   4.009
  732    HA   LYS 101           HA       LYS 101  -7.646  -7.729   6.665
  733   1HB   LYS 101          1HB       LYS 101  -9.328  -9.766   5.219
  734   2HB   LYS 101          2HB       LYS 101  -9.532  -9.490   6.948
  735   1HG   LYS 101          1HG       LYS 101 -10.029  -7.148   6.579
  736   2HG   LYS 101          2HG       LYS 101  -9.641  -7.293   4.864
  737   1HD   LYS 101          1HD       LYS 101 -11.709  -8.047   4.385
  738   2HD   LYS 101          2HD       LYS 101 -11.615  -9.271   5.652
  739   1HE   LYS 101          1HE       LYS 101 -11.888  -6.710   6.915
  740   2HE   LYS 101          2HE       LYS 101 -13.153  -6.869   5.680
  741   1HZ   LYS 101          1HZ       LYS 101 -13.597  -9.117   6.532
  742   2HZ   LYS 101          2HZ       LYS 101 -13.885  -7.922   7.705
  743   3HZ   LYS 101          3HZ       LYS 101 -12.473  -8.864   7.778
  744    H    GLY 102           H        GLY 102  -5.469  -9.689   5.501
  745   1HA   GLY 102          1HA       GLY 102  -5.086 -11.095   8.049
  746   2HA   GLY 102          2HA       GLY 102  -5.382 -12.161   6.676
  747    H    SER 103           H        SER 103  -3.582  -9.102   6.566
  748    HA   SER 103           HA       SER 103  -1.142 -10.691   5.881
  749   1HB   SER 103          1HB       SER 103  -0.919  -9.363   4.040
  750   2HB   SER 103          2HB       SER 103  -2.646  -9.183   4.244
  751    HG   SER 103           HG       SER 103  -1.087  -7.238   4.122
  752    H    LYS 104           H        LYS 104   0.359  -8.200   5.617
  753    HA   LYS 104           HA       LYS 104   0.912  -7.675   8.503
  754   1HB   LYS 104          1HB       LYS 104   2.409  -7.186   5.908
  755   2HB   LYS 104          2HB       LYS 104   3.056  -6.859   7.515
  756   1HG   LYS 104          1HG       LYS 104   1.989  -9.597   6.919
  757   2HG   LYS 104          2HG       LYS 104   3.590  -9.157   6.324
  758   1HD   LYS 104          1HD       LYS 104   4.078  -8.367   8.725
  759   2HD   LYS 104          2HD       LYS 104   2.625  -9.256   9.184
  760   1HE   LYS 104          1HE       LYS 104   3.960 -11.092   7.600
  761   2HE   LYS 104          2HE       LYS 104   5.281 -10.290   8.472
  762   1HZ   LYS 104          1HZ       LYS 104   2.837 -10.952   9.948
  763   2HZ   LYS 104          2HZ       LYS 104   4.444 -10.880  10.496
  764   3HZ   LYS 104          3HZ       LYS 104   3.912 -12.215   9.591
  765    H    CYS 105           H        CYS 105  -0.137  -6.291   5.524
  766    HA   CYS 105           HA       CYS 105   0.269  -3.503   6.231
  767   1HB   CYS 105          1HB       CYS 105  -0.127  -5.061   3.985
  768   2HB   CYS 105          2HB       CYS 105  -1.660  -4.248   4.157
  769    H    HIS 106           H        HIS 106  -2.294  -5.858   6.662
  770    HA   HIS 106           HA       HIS 106  -4.045  -3.684   7.770
  771   1HB   HIS 106          1HB       HIS 106  -4.519  -5.996   5.944
  772   2HB   HIS 106          2HB       HIS 106  -5.814  -5.569   7.061
  773    HD1  HIS 106           HD1      HIS 106  -5.134  -2.452   7.013
  774    HD2  HIS 106           HD2      HIS 106  -5.833  -4.858   3.661
  775    HE1  HIS 106           HE1      HIS 106  -5.746  -0.884   5.128
  776    H    SER 107           H        SER 107  -2.602  -4.464   9.739
  777    HA   SER 107           HA       SER 107  -3.172  -7.050  10.912
  778   1HB   SER 107          1HB       SER 107  -1.147  -5.775  11.395
  779   2HB   SER 107          2HB       SER 107  -2.104  -4.431  12.012
  780    HG   SER 107           HG       SER 107  -1.202  -5.993  13.588
  781    HHA  HEC 201           HHA      HEC 201   5.918   8.660   5.646
  782    HHB  HEC 201           HHB      HEC 201  12.056   9.746   4.861
  783    HHC  HEC 201           HHC      HEC 201  12.486   4.745   1.025
  784    HHD  HEC 201           HHD      HEC 201   6.390   3.664   1.716
  785   1HMA  HEC 201          1HMA      HEC 201  11.277  10.697   6.914
  786   2HMA  HEC 201          2HMA      HEC 201   9.813  10.807   7.895
  787   3HMA  HEC 201          3HMA      HEC 201  10.074  11.939   6.567
  788   1HAA  HEC 201          1HAA      HEC 201   6.455   9.745   7.276
  789   2HAA  HEC 201          2HAA      HEC 201   7.758  10.764   7.879
  790   1HBA  HEC 201          1HBA      HEC 201   6.698  11.537   5.235
  791   2HBA  HEC 201          2HBA      HEC 201   5.563  11.715   6.573
  792   1HMB  HEC 201          1HMB      HEC 201  15.060   8.167   4.517
  793   2HMB  HEC 201          2HMB      HEC 201  13.989   9.567   4.476
  794   3HMB  HEC 201          3HMB      HEC 201  14.928   9.135   3.049
  795    HAB  HEC 201           HAB      HEC 201  14.402   5.440   1.318
  796   1HBB  HEC 201          1HBB      HEC 201  15.628   4.757   3.122
  797   2HBB  HEC 201          2HBB      HEC 201  15.440   6.297   3.958
  798   3HBB  HEC 201          3HBB      HEC 201  16.653   6.125   2.691
  799   1HMC  HEC 201          1HMC      HEC 201  12.177   2.919   0.196
  800   2HMC  HEC 201          2HMC      HEC 201  11.011   1.598   0.121
  801   3HMC  HEC 201          3HMC      HEC 201  10.997   2.858  -1.114
  802    HAC  HEC 201           HAC      HEC 201   6.993   2.362   0.526
  803   1HBC  HEC 201          1HBC      HEC 201   9.226   0.768   1.086
  804   2HBC  HEC 201          2HBC      HEC 201   8.851   0.456  -0.607
  805   3HBC  HEC 201          3HBC      HEC 201   7.618   0.209   0.629
  806   1HMD  HEC 201          1HMD      HEC 201   3.368   4.620   2.754
  807   2HMD  HEC 201          2HMD      HEC 201   3.672   4.106   4.415
  808   3HMD  HEC 201          3HMD      HEC 201   4.566   3.370   3.087
  809   1HAD  HEC 201          1HAD      HEC 201   4.185   7.951   5.544
  810   2HAD  HEC 201          2HAD      HEC 201   3.175   7.403   4.210
  811   1HBD  HEC 201          1HBD      HEC 201   2.644   5.369   5.310
  812   2HBD  HEC 201          2HBD      HEC 201   3.949   5.573   6.479
  813    HHA  HEC 202           HHA      HEC 202   1.623   7.721  -9.493
  814    HHB  HEC 202           HHB      HEC 202   2.924   4.157  -4.835
  815    HHC  HEC 202           HHC      HEC 202   4.542   9.024  -1.229
  816    HHD  HEC 202           HHD      HEC 202   2.570  12.958  -5.843
  817   1HMA  HEC 202          1HMA      HEC 202   0.497   3.280  -7.576
  818   2HMA  HEC 202          2HMA      HEC 202   1.023   3.254  -5.893
  819   3HMA  HEC 202          3HMA      HEC 202   2.162   2.857  -7.180
  820   1HAA  HEC 202          1HAA      HEC 202   1.162   5.264 -10.017
  821   2HAA  HEC 202          2HAA      HEC 202   0.048   4.447  -8.962
  822   1HBA  HEC 202          1HBA      HEC 202  -1.236   6.497  -8.669
  823   2HBA  HEC 202          2HBA      HEC 202  -0.105   7.372  -9.695
  824   1HMB  HEC 202          1HMB      HEC 202   3.023   3.534  -2.344
  825   2HMB  HEC 202          2HMB      HEC 202   4.506   3.826  -1.435
  826   3HMB  HEC 202          3HMB      HEC 202   4.588   3.427  -3.150
  827    HAB  HEC 202           HAB      HEC 202   4.240   7.079   0.086
  828   1HBB  HEC 202          1HBB      HEC 202   6.459   5.265   0.028
  829   2HBB  HEC 202          2HBB      HEC 202   6.475   6.996   0.362
  830   3HBB  HEC 202          3HBB      HEC 202   6.639   6.414  -1.295
  831   1HMC  HEC 202          1HMC      HEC 202   5.368  11.000  -0.805
  832   2HMC  HEC 202          2HMC      HEC 202   5.393  12.682  -1.334
  833   3HMC  HEC 202          3HMC      HEC 202   3.993  12.051  -0.467
  834    HAC  HEC 202           HAC      HEC 202   2.699  14.055  -4.056
  835   1HBC  HEC 202          1HBC      HEC 202   4.403  15.211  -2.200
  836   2HBC  HEC 202          2HBC      HEC 202   4.741  15.097  -3.927
  837   3HBC  HEC 202          3HBC      HEC 202   5.386  13.885  -2.821
  838   1HMD  HEC 202          1HMD      HEC 202   0.948  13.425  -8.136
  839   2HMD  HEC 202          2HMD      HEC 202   1.679  13.016  -9.688
  840   3HMD  HEC 202          3HMD      HEC 202   2.690  13.588  -8.360
  841   1HAD  HEC 202          1HAD      HEC 202   1.812   9.321 -10.722
  842   2HAD  HEC 202          2HAD      HEC 202   0.968  10.861 -10.812
  843   1HBD  HEC 202          1HBD      HEC 202   3.435  11.814 -10.469
  844   2HBD  HEC 202          2HBD      HEC 202   3.866  10.255 -11.174
  845    HHA  HEC 203           HHA      HEC 203   7.117  -6.820   4.617
  846    HHB  HEC 203           HHB      HEC 203   2.732  -2.052   4.859
  847    HHC  HEC 203           HHC      HEC 203   4.691   0.047  -0.516
  848    HHD  HEC 203           HHD      HEC 203   8.979  -4.527  -0.951
  849   1HMA  HEC 203          1HMA      HEC 203   3.022  -5.015   7.472
  850   2HMA  HEC 203          2HMA      HEC 203   2.218  -3.776   6.509
  851   3HMA  HEC 203          3HMA      HEC 203   3.543  -3.334   7.585
  852   1HAA  HEC 203          1HAA      HEC 203   4.902  -6.009   7.733
  853   2HAA  HEC 203          2HAA      HEC 203   4.673  -7.259   6.519
  854   1HBA  HEC 203          1HBA      HEC 203   6.923  -7.638   6.285
  855   2HBA  HEC 203          2HBA      HEC 203   7.345  -5.952   6.596
  856   1HMB  HEC 203          1HMB      HEC 203   1.491   0.991   3.412
  857   2HMB  HEC 203          2HMB      HEC 203   1.359  -0.532   4.291
  858   3HMB  HEC 203          3HMB      HEC 203   2.529   0.684   4.804
  859    HAB  HEC 203           HAB      HEC 203   2.765   0.935   0.085
  860   1HBB  HEC 203          1HBB      HEC 203   4.217   2.671   0.052
  861   2HBB  HEC 203          2HBB      HEC 203   4.747   2.310   1.695
  862   3HBB  HEC 203          3HBB      HEC 203   3.349   3.353   1.428
  863   1HMC  HEC 203          1HMC      HEC 203   5.542   0.249  -2.301
  864   2HMC  HEC 203          2HMC      HEC 203   7.251   0.264  -2.738
  865   3HMC  HEC 203          3HMC      HEC 203   6.131  -0.794  -3.596
  866    HAC  HEC 203           HAC      HEC 203   9.134  -3.545  -2.596
  867   1HBC  HEC 203          1HBC      HEC 203   8.538  -1.326  -4.419
  868   2HBC  HEC 203          2HBC      HEC 203  10.078  -1.803  -3.710
  869   3HBC  HEC 203          3HBC      HEC 203   8.967  -0.777  -2.802
  870   1HMD  HEC 203          1HMD      HEC 203  10.057  -7.776   0.303
  871   2HMD  HEC 203          2HMD      HEC 203  11.022  -6.468   0.989
  872   3HMD  HEC 203          3HMD      HEC 203  10.153  -6.223  -0.527
  873   1HAD  HEC 203          1HAD      HEC 203  10.141  -7.824   3.130
  874   2HAD  HEC 203          2HAD      HEC 203   8.706  -7.888   4.148
  875   1HBD  HEC 203          1HBD      HEC 203   7.603  -9.170   2.203
  876   2HBD  HEC 203          2HBD      HEC 203   9.239  -9.366   1.574
  877    HHA  HEC 204           HHA      HEC 204  -6.863   2.162   3.903
  878    HHB  HEC 204           HHB      HEC 204 -10.163  -2.375   1.064
  879    HHC  HEC 204           HHC      HEC 204  -4.806  -5.897   0.925
  880    HHD  HEC 204           HHD      HEC 204  -1.518  -0.975   2.607
  881   1HMA  HEC 204          1HMA      HEC 204 -11.721  -0.205   3.196
  882   2HMA  HEC 204          2HMA      HEC 204 -11.493  -0.906   1.594
  883   3HMA  HEC 204          3HMA      HEC 204 -11.521   0.845   1.793
  884   1HAA  HEC 204          1HAA      HEC 204 -10.052   1.964   4.563
  885   2HAA  HEC 204          2HAA      HEC 204  -8.600   2.768   3.979
  886   1HBA  HEC 204          1HBA      HEC 204  -9.764   3.070   1.759
  887   2HBA  HEC 204          2HBA      HEC 204 -11.229   2.461   2.523
  888   1HMB  HEC 204          1HMB      HEC 204 -10.664  -4.039  -0.062
  889   2HMB  HEC 204          2HMB      HEC 204 -10.192  -5.736  -0.146
  890   3HMB  HEC 204          3HMB      HEC 204  -9.879  -4.664  -1.511
  891    HAB  HEC 204           HAB      HEC 204  -6.481  -6.994   0.235
  892   1HBB  HEC 204          1HBB      HEC 204  -6.906  -7.561  -2.236
  893   2HBB  HEC 204          2HBB      HEC 204  -5.721  -6.301  -1.892
  894   3HBB  HEC 204          3HBB      HEC 204  -7.345  -5.864  -2.425
  895   1HMC  HEC 204          1HMC      HEC 204  -3.004  -6.513   0.743
  896   2HMC  HEC 204          2HMC      HEC 204  -1.438  -5.829   0.310
  897   3HMC  HEC 204          3HMC      HEC 204  -1.765  -6.298   1.979
  898    HAC  HEC 204           HAC      HEC 204  -0.462  -2.483   2.860
  899   1HBC  HEC 204          1HBC      HEC 204   0.411  -4.247   0.549
  900   2HBC  HEC 204          2HBC      HEC 204   1.406  -3.120   1.471
  901   3HBC  HEC 204          3HBC      HEC 204   0.152  -2.510   0.392
  902   1HMD  HEC 204          1HMD      HEC 204  -1.190   0.980   4.349
  903   2HMD  HEC 204          2HMD      HEC 204  -1.692   2.631   3.980
  904   3HMD  HEC 204          3HMD      HEC 204  -1.077   1.587   2.697
  905   1HAD  HEC 204          1HAD      HEC 204  -3.775   3.848   3.640
  906   2HAD  HEC 204          2HAD      HEC 204  -5.416   3.443   4.128
  907   1HBD  HEC 204          1HBD      HEC 204  -4.178   2.213   6.115
  908   2HBD  HEC 204          2HBD      HEC 204  -2.892   3.354   5.725
  Start of MODEL   20
    1   1H    ALA   1          1H        ALA   1  20.561  14.691   2.676
    2   2H    ALA   1          2H        ALA   1  21.695  13.897   1.691
    3   3H    ALA   1          3H        ALA   1  21.522  13.450   3.320
    4    HA   ALA   1           HA       ALA   1  19.603  12.990   1.100
    5   1HB   ALA   1          1HB       ALA   1  20.024  10.653   2.379
    6   2HB   ALA   1          2HB       ALA   1  21.531  11.471   2.790
    7   3HB   ALA   1          3HB       ALA   1  21.092  11.230   1.099
    8    HA   PRO   2           HA       PRO   2  16.307  13.014   3.998
    9   1HB   PRO   2          1HB       PRO   2  14.868  10.795   3.301
   10   2HB   PRO   2          2HB       PRO   2  14.911  12.265   2.315
   11   1HG   PRO   2          1HG       PRO   2  16.372   9.703   1.954
   12   2HG   PRO   2          2HG       PRO   2  15.668  10.782   0.740
   13   1HD   PRO   2          1HD       PRO   2  18.339  10.680   1.320
   14   2HD   PRO   2          2HD       PRO   2  17.522  12.115   0.663
   15    H    LYS   3           H        LYS   3  15.875  12.246   6.081
   16    HA   LYS   3           HA       LYS   3  17.445   9.864   6.957
   17   1HB   LYS   3          1HB       LYS   3  15.987  11.870   8.665
   18   2HB   LYS   3          2HB       LYS   3  17.354  10.851   9.103
   19   1HG   LYS   3          1HG       LYS   3  18.712  12.096   7.359
   20   2HG   LYS   3          2HG       LYS   3  17.364  13.225   7.226
   21   1HD   LYS   3          1HD       LYS   3  17.592  13.927   9.491
   22   2HD   LYS   3          2HD       LYS   3  18.661  12.578   9.878
   23   1HE   LYS   3          1HE       LYS   3  20.346  13.523   8.261
   24   2HE   LYS   3          2HE       LYS   3  19.299  14.946   8.085
   25   1HZ   LYS   3          1HZ       LYS   3  20.292  13.895  10.681
   26   2HZ   LYS   3          2HZ       LYS   3  19.383  15.311  10.443
   27   3HZ   LYS   3          3HZ       LYS   3  20.976  15.212   9.860
   28    H    ALA   4           H        ALA   4  15.910   8.337   6.134
   29    HA   ALA   4           HA       ALA   4  13.187   8.106   6.372
   30   1HB   ALA   4          1HB       ALA   4  15.234   6.445   5.776
   31   2HB   ALA   4          2HB       ALA   4  13.588   5.864   6.026
   32   3HB   ALA   4          3HB       ALA   4  14.766   5.771   7.337
   33    HA   PRO   5           HA       PRO   5  12.433   8.428  10.702
   34   1HB   PRO   5          1HB       PRO   5   9.768   7.790  10.635
   35   2HB   PRO   5          2HB       PRO   5  10.414   9.371  10.169
   36   1HG   PRO   5          1HG       PRO   5   9.402   7.181   8.469
   37   2HG   PRO   5          2HG       PRO   5   9.459   8.918   8.168
   38   1HD   PRO   5          1HD       PRO   5  11.213   7.004   7.111
   39   2HD   PRO   5          2HD       PRO   5  11.434   8.764   7.086
   40    H    ALA   6           H        ALA   6  11.776   7.032  12.498
   41    HA   ALA   6           HA       ALA   6  12.801   4.412  12.392
   42   1HB   ALA   6          1HB       ALA   6  12.164   4.368  14.633
   43   2HB   ALA   6          2HB       ALA   6  10.640   5.198  14.318
   44   3HB   ALA   6          3HB       ALA   6  12.153   6.104  14.321
   45    H    ASP   7           H        ASP   7  11.758   2.389  12.367
   46    HA   ASP   7           HA       ASP   7   9.579   2.028  10.559
   47   1HB   ASP   7          1HB       ASP   7  10.476   0.116  12.724
   48   2HB   ASP   7          2HB       ASP   7   9.865  -0.272  11.118
   49    H    GLY   8           H        GLY   8   7.469   1.110  11.151
   50   1HA   GLY   8          1HA       GLY   8   5.714   0.666  12.773
   51   2HA   GLY   8          2HA       GLY   8   6.558   1.712  13.915
   52    H    LEU   9           H        LEU   9   6.431   2.965  10.739
   53    HA   LEU   9           HA       LEU   9   4.950   5.287  11.492
   54   1HB   LEU   9          1HB       LEU   9   6.366   4.282   9.267
   55   2HB   LEU   9          2HB       LEU   9   4.744   4.650   8.676
   56    HG   LEU   9           HG       LEU   9   5.969   6.652  10.491
   57   1HD1  LEU   9          1HD1      LEU   9   7.920   6.379   9.214
   58   2HD1  LEU   9          2HD1      LEU   9   7.058   7.620   8.304
   59   3HD1  LEU   9          3HD1      LEU   9   7.021   5.941   7.761
   60   1HD2  LEU   9          1HD2      LEU   9   3.871   6.457   8.513
   61   2HD2  LEU   9          2HD2      LEU   9   4.980   7.767   8.086
   62   3HD2  LEU   9          3HD2      LEU   9   4.189   7.755   9.664
   63    H    LYS  10           H        LYS  10   2.785   5.492  11.775
   64    HA   LYS  10           HA       LYS  10   1.051   3.231  10.915
   65   1HB   LYS  10          1HB       LYS  10   1.112   5.250  13.049
   66   2HB   LYS  10          2HB       LYS  10  -0.492   4.964  12.374
   67   1HG   LYS  10          1HG       LYS  10   0.105   2.442  12.606
   68   2HG   LYS  10          2HG       LYS  10   1.353   3.004  13.721
   69   1HD   LYS  10          1HD       LYS  10  -0.156   3.505  15.338
   70   2HD   LYS  10          2HD       LYS  10  -1.279   4.230  14.186
   71   1HE   LYS  10          1HE       LYS  10  -2.063   1.999  13.506
   72   2HE   LYS  10          2HE       LYS  10  -0.905   1.243  14.618
   73   1HZ   LYS  10          1HZ       LYS  10  -2.748   3.325  15.593
   74   2HZ   LYS  10          2HZ       LYS  10  -1.978   2.084  16.462
   75   3HZ   LYS  10          3HZ       LYS  10  -3.292   1.725  15.447
   76    H    MET  11           H        MET  11   0.191   3.473   8.934
   77    HA   MET  11           HA       MET  11  -0.384   6.127   7.781
   78   1HB   MET  11          1HB       MET  11  -0.403   3.240   6.939
   79   2HB   MET  11          2HB       MET  11  -1.303   4.408   5.971
   80   1HG   MET  11          1HG       MET  11   0.616   5.572   5.351
   81   2HG   MET  11          2HG       MET  11   1.521   5.029   6.763
   82   1HE   MET  11          1HE       MET  11   1.138   4.555   2.985
   83   2HE   MET  11          2HE       MET  11  -0.376   3.996   3.691
   84   3HE   MET  11          3HE       MET  11   0.669   2.856   2.848
   85    H    ASP  12           H        ASP  12  -2.090   6.872   9.195
   86    HA   ASP  12           HA       ASP  12  -4.554   5.177   9.282
   87   1HB   ASP  12          1HB       ASP  12  -5.108   6.922  11.094
   88   2HB   ASP  12          2HB       ASP  12  -3.792   5.803  11.428
   89    H    LYS  13           H        LYS  13  -3.536   7.139   7.088
   90    HA   LYS  13           HA       LYS  13  -5.099   9.447   6.876
   91   1HB   LYS  13          1HB       LYS  13  -4.150   7.350   4.925
   92   2HB   LYS  13          2HB       LYS  13  -4.990   8.797   4.374
   93   1HG   LYS  13          1HG       LYS  13  -2.508   8.805   6.116
   94   2HG   LYS  13          2HG       LYS  13  -2.506   9.068   4.372
   95   1HD   LYS  13          1HD       LYS  13  -4.080  10.995   4.722
   96   2HD   LYS  13          2HD       LYS  13  -3.875  10.782   6.461
   97   1HE   LYS  13          1HE       LYS  13  -1.619  11.450   6.407
   98   2HE   LYS  13          2HE       LYS  13  -1.464  11.106   4.673
   99   1HZ   LYS  13          1HZ       LYS  13  -2.525  13.007   4.097
  100   2HZ   LYS  13          2HZ       LYS  13  -1.919  13.544   5.592
  101   3HZ   LYS  13          3HZ       LYS  13  -3.526  13.008   5.466
  102    H    THR  14           H        THR  14  -6.059   6.091   6.510
  103    HA   THR  14           HA       THR  14  -8.864   6.964   5.880
  104    HB   THR  14           HB       THR  14  -9.054   4.702   4.870
  105    HG1  THR  14           1HG      THR  14  -7.667   3.345   5.655
  106   1HG2  THR  14          1HG2      THR  14  -8.110   5.385   2.915
  107   2HG2  THR  14          2HG2      THR  14  -6.540   5.681   3.662
  108   3HG2  THR  14          3HG2      THR  14  -7.825   6.878   3.810
  109    H    LYS  15           H        LYS  15 -10.291   4.781   6.534
  110    HA   LYS  15           HA       LYS  15 -10.345   4.791   9.436
  111   1HB   LYS  15          1HB       LYS  15 -11.859   3.693   7.137
  112   2HB   LYS  15          2HB       LYS  15 -11.987   2.760   8.629
  113   1HG   LYS  15          1HG       LYS  15 -13.447   4.267   9.434
  114   2HG   LYS  15          2HG       LYS  15 -12.202   5.513   9.327
  115   1HD   LYS  15          1HD       LYS  15 -12.847   6.106   7.106
  116   2HD   LYS  15          2HD       LYS  15 -13.855   4.667   6.940
  117   1HE   LYS  15          1HE       LYS  15 -15.598   5.956   7.622
  118   2HE   LYS  15          2HE       LYS  15 -14.842   5.974   9.228
  119   1HZ   LYS  15          1HZ       LYS  15 -14.954   8.217   8.619
  120   2HZ   LYS  15          2HZ       LYS  15 -14.493   7.906   7.014
  121   3HZ   LYS  15          3HZ       LYS  15 -13.353   7.779   8.268
  122    H    GLN  16           H        GLN  16  -8.891   2.790   6.986
  123    HA   GLN  16           HA       GLN  16  -8.245   0.664   8.982
  124   1HB   GLN  16          1HB       GLN  16  -8.634   0.886   6.053
  125   2HB   GLN  16          2HB       GLN  16  -7.328  -0.191   6.550
  126   1HG   GLN  16          1HG       GLN  16  -9.165  -1.037   8.283
  127   2HG   GLN  16          2HG       GLN  16 -10.267  -0.415   7.055
  128   1HE2  GLN  16          2HE2      GLN  16  -8.845  -1.028   4.691
  129   2HE2  GLN  16          1HE2      GLN  16  -8.689  -2.713   4.553
  130    HA   PRO  17           HA       PRO  17  -4.451   3.270   8.738
  131   1HB   PRO  17          1HB       PRO  17  -3.728   2.844  11.349
  132   2HB   PRO  17          2HB       PRO  17  -4.846   4.128  10.844
  133   1HG   PRO  17          1HG       PRO  17  -5.449   1.434  11.977
  134   2HG   PRO  17          2HG       PRO  17  -6.196   3.000  12.337
  135   1HD   PRO  17          1HD       PRO  17  -7.367   1.190  10.714
  136   2HD   PRO  17          2HD       PRO  17  -7.540   2.944  10.466
  137    H    VAL  18           H        VAL  18  -2.474   2.421   8.179
  138    HA   VAL  18           HA       VAL  18  -1.893  -0.414   8.954
  139    HB   VAL  18           HB       VAL  18  -1.602   1.145   6.380
  140   1HG1  VAL  18          1HG1      VAL  18  -0.396  -1.565   6.998
  141   2HG1  VAL  18          2HG1      VAL  18   0.523  -0.062   6.925
  142   3HG1  VAL  18          3HG1      VAL  18  -0.277  -0.676   5.478
  143   1HG2  VAL  18          1HG2      VAL  18  -2.564  -1.390   5.849
  144   2HG2  VAL  18          2HG2      VAL  18  -3.566   0.046   6.066
  145   3HG2  VAL  18          3HG2      VAL  18  -3.273  -1.040   7.425
  146    H    VAL  19           H        VAL  19   0.114  -0.699   9.898
  147    HA   VAL  19           HA       VAL  19   1.824   1.653  10.327
  148    HB   VAL  19           HB       VAL  19   1.712  -1.216  11.247
  149   1HG1  VAL  19          1HG1      VAL  19   4.082  -0.790  10.941
  150   2HG1  VAL  19          2HG1      VAL  19   3.720  -0.689  12.664
  151   3HG1  VAL  19          3HG1      VAL  19   3.940   0.785  11.722
  152   1HG2  VAL  19          1HG2      VAL  19   1.356  -0.197  13.413
  153   2HG2  VAL  19          2HG2      VAL  19   0.277   0.598  12.265
  154   3HG2  VAL  19          3HG2      VAL  19   1.761   1.399  12.781
  155    H    PHE  20           H        PHE  20   3.507   2.149   8.938
  156    HA   PHE  20           HA       PHE  20   4.470   0.014   7.083
  157   1HB   PHE  20          1HB       PHE  20   3.648   2.097   6.079
  158   2HB   PHE  20          2HB       PHE  20   4.755   3.041   7.071
  159    HD1  PHE  20           HD1      PHE  20   4.824   0.110   4.737
  160    HD2  PHE  20           HD2      PHE  20   6.817   3.650   6.125
  161    HE1  PHE  20           HE1      PHE  20   6.611  -0.233   3.054
  162    HE2  PHE  20           HE2      PHE  20   8.597   3.308   4.439
  163    HZ   PHE  20           HZ       PHE  20   8.498   1.366   2.905
  164    H    ASN  21           H        ASN  21   6.292  -1.015   7.822
  165    HA   ASN  21           HA       ASN  21   8.136   0.370   9.667
  166   1HB   ASN  21          1HB       ASN  21   7.221  -2.294   9.041
  167   2HB   ASN  21          2HB       ASN  21   8.975  -2.230   8.963
  168   1HD2  ASN  21          2HD2      ASN  21   8.864  -3.622  10.992
  169   2HD2  ASN  21          1HD2      ASN  21   8.641  -2.850  12.487
  170    H    HIS  22           H        HIS  22   9.357   1.812   8.339
  171    HA   HIS  22           HA       HIS  22  10.274   1.440   5.723
  172   1HB   HIS  22          1HB       HIS  22  11.289   2.818   8.186
  173   2HB   HIS  22          2HB       HIS  22  12.327   2.776   6.763
  174    HD1  HIS  22           HD1      HIS  22   9.530   4.589   8.224
  175    HD2  HIS  22           HD2      HIS  22  10.904   3.892   4.346
  176    HE1  HIS  22           HE1      HIS  22   8.528   6.402   6.772
  177    H    SER  23           H        SER  23  11.538   0.072   8.734
  178    HA   SER  23           HA       SER  23  14.035  -0.921   7.957
  179   1HB   SER  23          1HB       SER  23  13.630  -1.489  10.125
  180   2HB   SER  23          2HB       SER  23  11.890  -1.571   9.863
  181    HG   SER  23           HG       SER  23  12.048  -3.644   9.471
  182    H    THR  24           H        THR  24  10.818  -2.337   7.356
  183    HA   THR  24           HA       THR  24  11.869  -4.650   5.924
  184    HB   THR  24           HB       THR  24   9.095  -3.844   5.424
  185    HG1  THR  24           1HG      THR  24   8.506  -4.009   7.623
  186   1HG2  THR  24          1HG2      THR  24   9.230  -6.100   5.234
  187   2HG2  THR  24          2HG2      THR  24   9.075  -6.097   6.991
  188   3HG2  THR  24          3HG2      THR  24  10.671  -6.189   6.246
  189    H    HIS  25           H        HIS  25  11.759  -1.426   5.120
  190    HA   HIS  25           HA       HIS  25  11.469  -2.041   2.210
  191   1HB   HIS  25          1HB       HIS  25  10.691   0.398   3.833
  192   2HB   HIS  25          2HB       HIS  25  10.486   0.227   2.092
  193    HD1  HIS  25           HD1      HIS  25   9.163  -1.027   5.363
  194    HD2  HIS  25           HD2      HIS  25   8.434  -1.602   1.301
  195    HE1  HIS  25           HE1      HIS  25   7.015  -2.356   5.205
  196    H    LYS  26           H        LYS  26  13.548  -0.928   4.673
  197    HA   LYS  26           HA       LYS  26  15.059   1.134   3.501
  198   1HB   LYS  26          1HB       LYS  26  15.982  -1.298   5.075
  199   2HB   LYS  26          2HB       LYS  26  16.895   0.202   4.892
  200   1HG   LYS  26          1HG       LYS  26  14.783   1.365   5.839
  201   2HG   LYS  26          2HG       LYS  26  14.308  -0.250   6.368
  202   1HD   LYS  26          1HD       LYS  26  16.435  -0.479   7.597
  203   2HD   LYS  26          2HD       LYS  26  16.911   1.137   7.072
  204   1HE   LYS  26          1HE       LYS  26  14.380   1.545   8.158
  205   2HE   LYS  26          2HE       LYS  26  15.123   0.366   9.256
  206   1HZ   LYS  26          1HZ       LYS  26  16.440   2.847   8.283
  207   2HZ   LYS  26          2HZ       LYS  26  17.088   1.730   9.389
  208   3HZ   LYS  26          3HZ       LYS  26  15.736   2.668   9.815
  209    H    ALA  27           H        ALA  27  14.884  -2.271   2.683
  210    HA   ALA  27           HA       ALA  27  17.238  -2.187   0.913
  211   1HB   ALA  27          1HB       ALA  27  16.443  -4.543   0.455
  212   2HB   ALA  27          2HB       ALA  27  15.077  -4.228   1.526
  213   3HB   ALA  27          3HB       ALA  27  16.722  -4.204   2.163
  214    H    VAL  28           H        VAL  28  14.012  -1.209   0.713
  215    HA   VAL  28           HA       VAL  28  13.543  -1.913  -2.098
  216    HB   VAL  28           HB       VAL  28  12.174  -0.243   0.013
  217   1HG1  VAL  28          1HG1      VAL  28  10.311   0.049  -1.581
  218   2HG1  VAL  28          2HG1      VAL  28  11.295  -0.681  -2.848
  219   3HG1  VAL  28          3HG1      VAL  28  11.775   0.858  -2.134
  220   1HG2  VAL  28          1HG2      VAL  28  11.289  -2.728  -1.474
  221   2HG2  VAL  28          2HG2      VAL  28  10.491  -1.989  -0.086
  222   3HG2  VAL  28          3HG2      VAL  28  12.070  -2.752   0.108
  223    H    LYS  29           H        LYS  29  12.864   0.118  -3.513
  224    HA   LYS  29           HA       LYS  29  15.227   1.898  -3.513
  225   1HB   LYS  29          1HB       LYS  29  13.374   0.779  -5.412
  226   2HB   LYS  29          2HB       LYS  29  13.421   2.537  -5.573
  227   1HG   LYS  29          1HG       LYS  29  15.260   2.125  -6.847
  228   2HG   LYS  29          2HG       LYS  29  16.063   2.009  -5.280
  229   1HD   LYS  29          1HD       LYS  29  14.786  -0.504  -5.955
  230   2HD   LYS  29          2HD       LYS  29  15.891  -0.007  -7.238
  231   1HE   LYS  29          1HE       LYS  29  17.630   0.420  -5.416
  232   2HE   LYS  29          2HE       LYS  29  16.534  -0.427  -4.306
  233   1HZ   LYS  29          1HZ       LYS  29  17.911  -1.459  -6.694
  234   2HZ   LYS  29          2HZ       LYS  29  16.431  -2.147  -6.223
  235   3HZ   LYS  29          3HZ       LYS  29  17.757  -2.166  -5.161
  236    H    CYS  30           H        CYS  30  14.959   3.508  -2.065
  237    HA   CYS  30           HA       CYS  30  12.655   4.719  -1.063
  238   1HB   CYS  30          1HB       CYS  30  15.403   5.773  -1.756
  239   2HB   CYS  30          2HB       CYS  30  14.204   6.802  -0.973
  240    H    GLY  31           H        GLY  31  14.044   4.990  -4.251
  241   1HA   GLY  31          1HA       GLY  31  12.402   7.322  -4.980
  242   2HA   GLY  31          2HA       GLY  31  13.502   6.455  -6.054
  243    H    ASP  32           H        ASP  32  12.043   3.921  -4.861
  244    HA   ASP  32           HA       ASP  32  10.140   3.707  -7.077
  245   1HB   ASP  32          1HB       ASP  32  11.699   2.022  -5.464
  246   2HB   ASP  32          2HB       ASP  32  10.040   1.634  -5.028
  247    H    CYS  33           H        CYS  33  10.037   4.104  -3.556
  248    HA   CYS  33           HA       CYS  33   7.071   4.089  -3.529
  249   1HB   CYS  33          1HB       CYS  33   9.343   4.109  -1.570
  250   2HB   CYS  33          2HB       CYS  33   7.804   4.765  -1.029
  251    H    HIS  34           H        HIS  34   9.715   6.323  -2.577
  252    HA   HIS  34           HA       HIS  34   7.886   8.649  -2.703
  253   1HB   HIS  34          1HB       HIS  34  10.790   8.179  -1.971
  254   2HB   HIS  34          2HB       HIS  34  10.079   9.789  -2.013
  255    HD1  HIS  34           HD1      HIS  34   7.667   9.863  -0.528
  256    HD2  HIS  34           HD2      HIS  34  10.562   7.053   0.517
  257    HE1  HIS  34           HE1      HIS  34   7.169   9.172   1.858
  258    H    HIS  35           H        HIS  35   8.492   7.159  -5.178
  259    HA   HIS  35           HA       HIS  35  10.399   7.881  -6.927
  260   1HB   HIS  35          1HB       HIS  35   8.550   8.069  -8.634
  261   2HB   HIS  35          2HB       HIS  35   8.412   6.675  -7.577
  262    HD1  HIS  35           HD1      HIS  35   6.991  10.069  -8.142
  263    HD2  HIS  35           HD2      HIS  35   6.137   6.680  -5.895
  264    HE1  HIS  35           HE1      HIS  35   4.689  10.437  -7.165
  265    HA   PRO  36           HA       PRO  36  10.837  12.200  -7.378
  266   1HB   PRO  36          1HB       PRO  36  11.176  12.463 -10.088
  267   2HB   PRO  36          2HB       PRO  36  12.423  11.803  -9.010
  268   1HG   PRO  36          1HG       PRO  36  10.475  10.363 -10.751
  269   2HG   PRO  36          2HG       PRO  36  12.193  10.032 -10.469
  270   1HD   PRO  36          1HD       PRO  36  10.236   8.618  -9.262
  271   2HD   PRO  36          2HD       PRO  36  11.794   8.950  -8.470
  272    H    VAL  37           H        VAL  37   9.171  13.633  -7.170
  273    HA   VAL  37           HA       VAL  37   6.768  13.321  -8.911
  274    HB   VAL  37           HB       VAL  37   7.379  14.102  -6.136
  275   1HG1  VAL  37          1HG1      VAL  37   6.720  16.317  -7.008
  276   2HG1  VAL  37          2HG1      VAL  37   5.484  15.670  -5.929
  277   3HG1  VAL  37          3HG1      VAL  37   5.246  15.616  -7.676
  278   1HG2  VAL  37          1HG2      VAL  37   5.265  12.727  -7.712
  279   2HG2  VAL  37          2HG2      VAL  37   4.748  13.489  -6.207
  280   3HG2  VAL  37          3HG2      VAL  37   6.014  12.262  -6.185
  281    H    ASN  38           H        ASN  38   9.477  14.752  -9.384
  282    HA   ASN  38           HA       ASN  38   8.534  16.873 -11.055
  283   1HB   ASN  38          1HB       ASN  38   8.055  17.633  -8.610
  284   2HB   ASN  38          2HB       ASN  38   9.784  17.856  -8.488
  285   1HD2  ASN  38          2HD2      ASN  38   9.430  18.477 -11.637
  286   2HD2  ASN  38          1HD2      ASN  38   9.076  20.136 -11.602
  287    H    GLY  39           H        GLY  39  11.182  17.265  -8.798
  288   1HA   GLY  39          1HA       GLY  39  13.126  16.439 -10.901
  289   2HA   GLY  39          2HA       GLY  39  13.364  17.926  -9.974
  290    H    LYS  40           H        LYS  40  11.832  15.835  -7.938
  291    HA   LYS  40           HA       LYS  40  14.168  14.244  -7.104
  292   1HB   LYS  40          1HB       LYS  40  14.395  15.428  -4.954
  293   2HB   LYS  40          2HB       LYS  40  14.649  16.542  -6.298
  294   1HG   LYS  40          1HG       LYS  40  12.209  17.176  -6.117
  295   2HG   LYS  40          2HG       LYS  40  12.140  16.227  -4.632
  296   1HD   LYS  40          1HD       LYS  40  13.859  17.620  -3.609
  297   2HD   LYS  40          2HD       LYS  40  14.065  18.519  -5.113
  298   1HE   LYS  40          1HE       LYS  40  11.724  19.315  -4.964
  299   2HE   LYS  40          2HE       LYS  40  11.529  18.428  -3.438
  300   1HZ   LYS  40          1HZ       LYS  40  12.201  20.546  -2.770
  301   2HZ   LYS  40          2HZ       LYS  40  13.331  20.698  -4.030
  302   3HZ   LYS  40          3HZ       LYS  40  13.638  19.645  -2.732
  303    H    GLU  41           H        GLU  41  13.502  12.512  -5.836
  304    HA   GLU  41           HA       GLU  41  10.768  11.749  -5.706
  305   1HB   GLU  41          1HB       GLU  41  13.355  10.949  -4.453
  306   2HB   GLU  41          2HB       GLU  41  11.872  10.247  -3.809
  307   1HG   GLU  41          1HG       GLU  41  11.506   8.993  -5.680
  308   2HG   GLU  41          2HG       GLU  41  12.068  10.270  -6.760
  309    H    ASP  42           H        ASP  42   9.204  12.766  -4.505
  310    HA   ASP  42           HA       ASP  42   9.729  14.508  -2.294
  311   1HB   ASP  42          1HB       ASP  42   7.308  12.985  -3.273
  312   2HB   ASP  42          2HB       ASP  42   7.231  14.125  -1.929
  313    H    TYR  43           H        TYR  43  10.793  13.655  -0.527
  314    HA   TYR  43           HA       TYR  43  10.217  10.922   0.406
  315   1HB   TYR  43          1HB       TYR  43  12.025  13.148   1.402
  316   2HB   TYR  43          2HB       TYR  43  12.034  11.496   2.021
  317    HD1  TYR  43           HD1      TYR  43  12.596   9.589   0.454
  318    HD2  TYR  43           HD2      TYR  43  13.128  13.712  -0.633
  319    HE1  TYR  43           HE1      TYR  43  14.104   8.908  -1.392
  320    HE2  TYR  43           HE2      TYR  43  14.638  13.029  -2.479
  321    HH   TYR  43           HH       TYR  43  15.277   9.588  -3.151
  322    H    GLN  44           H        GLN  44   7.834  11.869   0.769
  323    HA   GLN  44           HA       GLN  44   7.672  12.632   3.656
  324   1HB   GLN  44          1HB       GLN  44   5.854  14.240   2.977
  325   2HB   GLN  44          2HB       GLN  44   7.446  14.675   2.354
  326   1HG   GLN  44          1HG       GLN  44   6.707  13.225   0.281
  327   2HG   GLN  44          2HG       GLN  44   5.082  13.550   0.885
  328   1HE2  GLN  44          2HE2      GLN  44   4.467  15.892   1.123
  329   2HE2  GLN  44          1HE2      GLN  44   5.224  17.052   0.139
  330    H    LYS  45           H        LYS  45   5.375  12.271   4.479
  331    HA   LYS  45           HA       LYS  45   4.480   9.676   4.251
  332   1HB   LYS  45          1HB       LYS  45   3.225  12.309   4.874
  333   2HB   LYS  45          2HB       LYS  45   2.157  10.916   4.710
  334   1HG   LYS  45          1HG       LYS  45   2.924   9.936   6.617
  335   2HG   LYS  45          2HG       LYS  45   4.588  10.440   6.321
  336   1HD   LYS  45          1HD       LYS  45   3.990  11.723   8.195
  337   2HD   LYS  45          2HD       LYS  45   3.707  12.836   6.855
  338   1HE   LYS  45          1HE       LYS  45   1.322  11.309   7.177
  339   2HE   LYS  45          2HE       LYS  45   1.806  11.885   8.785
  340   1HZ   LYS  45          1HZ       LYS  45   2.012  14.093   7.974
  341   2HZ   LYS  45          2HZ       LYS  45   0.495  13.526   7.457
  342   3HZ   LYS  45          3HZ       LYS  45   1.795  13.603   6.365
  343    H    CYS  46           H        CYS  46   3.619   8.481   2.641
  344    HA   CYS  46           HA       CYS  46   3.320   9.125  -0.011
  345   1HB   CYS  46          1HB       CYS  46   1.588   7.316   1.691
  346   2HB   CYS  46          2HB       CYS  46   1.737   7.207  -0.059
  347    H    ALA  47           H        ALA  47   0.791   9.505   2.468
  348    HA   ALA  47           HA       ALA  47  -0.920  10.905   0.461
  349   1HB   ALA  47          1HB       ALA  47  -2.028   9.122   1.550
  350   2HB   ALA  47          2HB       ALA  47  -2.590  10.563   2.398
  351   3HB   ALA  47          3HB       ALA  47  -1.340   9.548   3.115
  352    H    THR  48           H        THR  48   1.033  12.593   1.062
  353    HA   THR  48           HA       THR  48   1.008  14.105   3.427
  354    HB   THR  48           HB       THR  48   1.265  15.474   0.781
  355    HG1  THR  48           1HG      THR  48   3.290  14.374   0.535
  356   1HG2  THR  48          1HG2      THR  48   2.775  16.756   1.900
  357   2HG2  THR  48          2HG2      THR  48   3.475  15.370   2.737
  358   3HG2  THR  48          3HG2      THR  48   1.987  16.103   3.337
  359    H    ALA  49           H        ALA  49   0.319  16.737   2.735
  360    HA   ALA  49           HA       ALA  49  -2.569  16.702   3.161
  361   1HB   ALA  49          1HB       ALA  49  -0.827  18.288   4.133
  362   2HB   ALA  49          2HB       ALA  49  -2.250  19.074   3.449
  363   3HB   ALA  49          3HB       ALA  49  -0.739  19.039   2.540
  364    H    GLY  50           H        GLY  50  -0.624  16.585   0.391
  365   1HA   GLY  50          1HA       GLY  50  -2.963  17.207  -1.322
  366   2HA   GLY  50          2HA       GLY  50  -1.477  18.116  -1.627
  367    H    CYS  51           H        CYS  51  -1.048  14.986  -0.383
  368    HA   CYS  51           HA       CYS  51   0.027  14.039  -2.978
  369   1HB   CYS  51          1HB       CYS  51   0.601  13.966  -0.131
  370   2HB   CYS  51          2HB       CYS  51   0.695  12.374  -0.812
  371    H    HIS  52           H        HIS  52  -0.317  11.261  -1.394
  372    HA   HIS  52           HA       HIS  52  -2.770  10.502  -2.793
  373   1HB   HIS  52          1HB       HIS  52  -0.862   9.104  -0.904
  374   2HB   HIS  52          2HB       HIS  52  -2.216   8.297  -1.665
  375    HD1  HIS  52           HD1      HIS  52  -2.210   8.670  -4.391
  376    HD2  HIS  52           HD2      HIS  52   1.435   8.909  -2.422
  377    HE1  HIS  52           HE1      HIS  52  -0.426   8.318  -6.162
  378    H    ASP  53           H        ASP  53  -3.609  12.465  -1.128
  379    HA   ASP  53           HA       ASP  53  -4.553  11.199   1.397
  380   1HB   ASP  53          1HB       ASP  53  -3.420  13.346   1.546
  381   2HB   ASP  53          2HB       ASP  53  -4.514  14.041   0.352
  382    H    ASN  54           H        ASN  54  -5.747  10.814  -1.482
  383    HA   ASN  54           HA       ASN  54  -8.393  12.062  -1.256
  384   1HB   ASN  54          1HB       ASN  54  -6.782  10.836  -3.226
  385   2HB   ASN  54          2HB       ASN  54  -8.212   9.823  -3.084
  386   1HD2  ASN  54          2HD2      ASN  54  -9.803  10.480  -4.513
  387   2HD2  ASN  54          1HD2      ASN  54 -10.124  12.087  -4.954
  388    H    MET  55           H        MET  55  -9.508  11.294   0.545
  389    HA   MET  55           HA       MET  55  -9.419   8.481   1.340
  390   1HB   MET  55          1HB       MET  55 -10.419  11.065   2.289
  391   2HB   MET  55          2HB       MET  55 -11.532   9.744   2.641
  392   1HG   MET  55          1HG       MET  55  -8.945   8.756   3.204
  393   2HG   MET  55          2HG       MET  55  -9.018  10.371   3.912
  394   1HE   MET  55          1HE       MET  55  -9.670   6.907   3.974
  395   2HE   MET  55          2HE       MET  55 -11.393   7.022   3.631
  396   3HE   MET  55          3HE       MET  55 -10.854   6.533   5.234
  397    H    ASP  56           H        ASP  56 -10.589   9.388  -1.391
  398    HA   ASP  56           HA       ASP  56 -13.430   8.709  -1.219
  399   1HB   ASP  56          1HB       ASP  56 -11.868  10.132  -2.923
  400   2HB   ASP  56          2HB       ASP  56 -11.929   8.595  -3.786
  401    H    LYS  57           H        LYS  57 -10.440   6.995  -1.533
  402    HA   LYS  57           HA       LYS  57  -9.992   4.684  -1.764
  403   1HB   LYS  57          1HB       LYS  57 -12.965   4.523  -1.206
  404   2HB   LYS  57          2HB       LYS  57 -11.779   3.250  -0.928
  405   1HG   LYS  57          1HG       LYS  57 -10.746   4.449   0.833
  406   2HG   LYS  57          2HG       LYS  57 -11.522   5.963   0.369
  407   1HD   LYS  57          1HD       LYS  57 -12.863   3.522   1.565
  408   2HD   LYS  57          2HD       LYS  57 -12.674   5.106   2.319
  409   1HE   LYS  57          1HE       LYS  57 -13.924   5.737  -0.069
  410   2HE   LYS  57          2HE       LYS  57 -14.694   4.205   0.386
  411   1HZ   LYS  57          1HZ       LYS  57 -15.760   6.122   1.462
  412   2HZ   LYS  57          2HZ       LYS  57 -14.288   6.515   2.212
  413   3HZ   LYS  57          3HZ       LYS  57 -15.076   5.059   2.594
  414    H    LYS  58           H        LYS  58 -11.439   6.443  -4.006
  415    HA   LYS  58           HA       LYS  58 -11.858   4.113  -5.841
  416   1HB   LYS  58          1HB       LYS  58 -13.512   6.653  -5.696
  417   2HB   LYS  58          2HB       LYS  58 -13.822   5.258  -6.730
  418   1HG   LYS  58          1HG       LYS  58 -13.618   4.167  -4.170
  419   2HG   LYS  58          2HG       LYS  58 -14.516   5.665  -3.927
  420   1HD   LYS  58          1HD       LYS  58 -16.253   5.011  -5.359
  421   2HD   LYS  58          2HD       LYS  58 -15.250   3.821  -6.188
  422   1HE   LYS  58          1HE       LYS  58 -15.199   2.451  -4.093
  423   2HE   LYS  58          2HE       LYS  58 -16.318   3.612  -3.349
  424   1HZ   LYS  58          1HZ       LYS  58 -17.271   1.577  -4.615
  425   2HZ   LYS  58          2HZ       LYS  58 -16.920   2.491  -6.004
  426   3HZ   LYS  58          3HZ       LYS  58 -17.987   3.100  -4.830
  427    H    ASP  59           H        ASP  59 -10.248   7.033  -5.228
  428    HA   ASP  59           HA       ASP  59 -10.060   8.171  -7.856
  429   1HB   ASP  59          1HB       ASP  59  -9.416   9.497  -6.008
  430   2HB   ASP  59          2HB       ASP  59  -8.412   8.217  -5.328
  431    H    LYS  60           H        LYS  60  -9.493   6.717  -9.494
  432    HA   LYS  60           HA       LYS  60  -7.297   4.788  -9.101
  433   1HB   LYS  60          1HB       LYS  60  -9.576   5.209 -10.822
  434   2HB   LYS  60          2HB       LYS  60  -8.136   4.946 -11.805
  435   1HG   LYS  60          1HG       LYS  60  -8.669   3.162  -9.446
  436   2HG   LYS  60          2HG       LYS  60  -9.514   2.874 -10.968
  437   1HD   LYS  60          1HD       LYS  60  -6.541   3.283 -10.999
  438   2HD   LYS  60          2HD       LYS  60  -7.191   1.714 -10.524
  439   1HE   LYS  60          1HE       LYS  60  -7.579   1.192 -12.692
  440   2HE   LYS  60          2HE       LYS  60  -8.571   2.651 -12.886
  441   1HZ   LYS  60          1HZ       LYS  60  -6.552   3.956 -13.123
  442   2HZ   LYS  60          2HZ       LYS  60  -6.605   2.737 -14.305
  443   3HZ   LYS  60          3HZ       LYS  60  -5.599   2.564 -12.948
  444    H    SER  61           H        SER  61  -6.839   7.816  -9.123
  445    HA   SER  61           HA       SER  61  -5.102   8.071 -11.536
  446   1HB   SER  61          1HB       SER  61  -6.848   9.765 -10.047
  447   2HB   SER  61          2HB       SER  61  -5.218  10.412  -9.879
  448    HG   SER  61           HG       SER  61  -5.186  10.869 -11.946
  449    H    ALA  62           H        ALA  62  -3.381  10.047 -10.335
  450    HA   ALA  62           HA       ALA  62  -1.635   8.241  -8.729
  451   1HB   ALA  62          1HB       ALA  62  -0.049   9.158 -10.045
  452   2HB   ALA  62          2HB       ALA  62  -0.473  10.771  -9.474
  453   3HB   ALA  62          3HB       ALA  62  -1.309  10.080 -10.865
  454    H    LYS  63           H        LYS  63  -4.025   9.901  -7.695
  455    HA   LYS  63           HA       LYS  63  -2.500  11.354  -5.555
  456   1HB   LYS  63          1HB       LYS  63  -3.945  12.521  -7.551
  457   2HB   LYS  63          2HB       LYS  63  -5.196  12.318  -6.322
  458   1HG   LYS  63          1HG       LYS  63  -4.266  14.422  -5.806
  459   2HG   LYS  63          2HG       LYS  63  -3.449  13.330  -4.688
  460   1HD   LYS  63          1HD       LYS  63  -1.432  13.499  -5.774
  461   2HD   LYS  63          2HD       LYS  63  -2.183  13.709  -7.356
  462   1HE   LYS  63          1HE       LYS  63  -2.680  16.018  -6.919
  463   2HE   LYS  63          2HE       LYS  63  -2.271  15.844  -5.201
  464   1HZ   LYS  63          1HZ       LYS  63  -0.040  14.961  -6.160
  465   2HZ   LYS  63          2HZ       LYS  63  -0.302  16.636  -6.049
  466   3HZ   LYS  63          3HZ       LYS  63  -0.485  15.841  -7.540
  467    H    GLY  64           H        GLY  64  -4.754   8.933  -6.301
  468   1HA   GLY  64          1HA       GLY  64  -6.269   9.240  -3.784
  469   2HA   GLY  64          2HA       GLY  64  -6.586   8.044  -5.031
  470    H    TYR  65           H        TYR  65  -5.744   8.184  -1.963
  471    HA   TYR  65           HA       TYR  65  -3.362   6.725  -1.572
  472   1HB   TYR  65          1HB       TYR  65  -5.325   7.804  -0.057
  473   2HB   TYR  65          2HB       TYR  65  -5.775   6.107   0.074
  474    HD1  TYR  65           HD1      TYR  65  -2.253   7.023  -0.443
  475    HD2  TYR  65           HD2      TYR  65  -5.258   6.102   2.483
  476    HE1  TYR  65           HE1      TYR  65  -0.491   6.697   1.263
  477    HE2  TYR  65           HE2      TYR  65  -3.491   5.771   4.190
  478    HH   TYR  65           HH       TYR  65  -1.147   6.519   4.573
  479    H    TYR  66           H        TYR  66  -6.668   5.360  -1.580
  480    HA   TYR  66           HA       TYR  66  -6.235   2.663  -1.564
  481   1HB   TYR  66          1HB       TYR  66  -8.295   4.327  -2.082
  482   2HB   TYR  66          2HB       TYR  66  -8.040   3.674  -3.699
  483    HD1  TYR  66           HD1      TYR  66  -8.094   1.184  -4.059
  484    HD2  TYR  66           HD2      TYR  66  -9.242   3.010  -0.348
  485    HE1  TYR  66           HE1      TYR  66  -9.263  -0.901  -3.398
  486    HE2  TYR  66           HE2      TYR  66 -10.413   0.925   0.314
  487    HH   TYR  66           HH       TYR  66 -10.803  -1.756  -1.930
  488    H    HIS  67           H        HIS  67  -6.612   4.294  -4.719
  489    HA   HIS  67           HA       HIS  67  -5.791   2.355  -6.452
  490   1HB   HIS  67          1HB       HIS  67  -6.443   4.527  -7.219
  491   2HB   HIS  67          2HB       HIS  67  -5.099   5.297  -6.374
  492    HD1  HIS  67           HD1      HIS  67  -5.576   2.632  -9.056
  493    HD2  HIS  67           HD2      HIS  67  -2.900   5.648  -8.013
  494    HE1  HIS  67           HE1      HIS  67  -3.754   2.603 -10.808
  495    H    ALA  68           H        ALA  68  -3.306   4.774  -5.760
  496    HA   ALA  68           HA       ALA  68  -1.062   3.302  -6.444
  497   1HB   ALA  68          1HB       ALA  68  -0.567   5.484  -5.939
  498   2HB   ALA  68          2HB       ALA  68  -0.127   4.793  -4.375
  499   3HB   ALA  68          3HB       ALA  68  -1.710   5.540  -4.597
  500    H    MET  69           H        MET  69  -3.010   2.904  -3.537
  501    HA   MET  69           HA       MET  69  -0.928   1.336  -2.167
  502   1HB   MET  69          1HB       MET  69  -3.799   2.055  -1.554
  503   2HB   MET  69          2HB       MET  69  -2.727   1.214  -0.437
  504   1HG   MET  69          1HG       MET  69  -1.496   3.607  -1.569
  505   2HG   MET  69          2HG       MET  69  -2.973   3.968  -0.677
  506   1HE   MET  69          1HE       MET  69   0.221   4.113  -0.774
  507   2HE   MET  69          2HE       MET  69   1.062   3.509   0.652
  508   3HE   MET  69          3HE       MET  69   0.107   4.985   0.761
  509    H    HIS  70           H        HIS  70  -3.964   0.676  -3.917
  510    HA   HIS  70           HA       HIS  70  -3.523  -2.228  -3.347
  511   1HB   HIS  70          1HB       HIS  70  -5.988  -0.736  -4.296
  512   2HB   HIS  70          2HB       HIS  70  -5.924  -2.425  -3.789
  513    HD1  HIS  70           HD1      HIS  70  -6.076   1.043  -2.468
  514    HD2  HIS  70           HD2      HIS  70  -5.443  -2.786  -0.951
  515    HE1  HIS  70           HE1      HIS  70  -6.289   1.228   0.049
  516    H    ASP  71           H        ASP  71  -3.267   0.110  -5.834
  517    HA   ASP  71           HA       ASP  71  -3.888  -1.730  -8.044
  518   1HB   ASP  71          1HB       ASP  71  -2.866   1.091  -7.731
  519   2HB   ASP  71          2HB       ASP  71  -2.945   0.320  -9.314
  520    H    LYS  72           H        LYS  72  -2.236  -2.270  -9.686
  521    HA   LYS  72           HA       LYS  72   0.478  -2.629  -8.465
  522   1HB   LYS  72          1HB       LYS  72  -0.908  -4.227 -10.638
  523   2HB   LYS  72          2HB       LYS  72   0.574  -4.666  -9.788
  524   1HG   LYS  72          1HG       LYS  72  -0.608  -5.609  -8.124
  525   2HG   LYS  72          2HG       LYS  72  -1.505  -4.111  -7.871
  526   1HD   LYS  72          1HD       LYS  72  -2.478  -5.262 -10.280
  527   2HD   LYS  72          2HD       LYS  72  -2.417  -6.552  -9.079
  528   1HE   LYS  72          1HE       LYS  72  -3.603  -3.852  -8.405
  529   2HE   LYS  72          2HE       LYS  72  -4.579  -5.141  -9.137
  530   1HZ   LYS  72          1HZ       LYS  72  -4.152  -4.965  -6.517
  531   2HZ   LYS  72          2HZ       LYS  72  -2.828  -5.934  -6.956
  532   3HZ   LYS  72          3HZ       LYS  72  -4.410  -6.438  -7.315
  533    H    GLY  73           H        GLY  73  -1.036  -2.442 -11.700
  534   1HA   GLY  73          1HA       GLY  73   1.374  -1.544 -12.998
  535   2HA   GLY  73          2HA       GLY  73  -0.249  -1.458 -13.688
  536    H    THR  74           H        THR  74   1.485   0.085 -10.964
  537    HA   THR  74           HA       THR  74   0.147   2.662 -11.661
  538    HB   THR  74           HB       THR  74   1.228   3.151  -9.307
  539    HG1  THR  74           1HG      THR  74   2.490   1.228  -9.375
  540   1HG2  THR  74          1HG2      THR  74  -0.709   1.880  -8.228
  541   2HG2  THR  74          2HG2      THR  74  -1.085   1.284  -9.845
  542   3HG2  THR  74          3HG2      THR  74  -1.143   3.014  -9.507
  543    H    LYS  75           H        LYS  75   1.513   4.634 -11.568
  544    HA   LYS  75           HA       LYS  75   3.708   4.797 -13.203
  545   1HB   LYS  75          1HB       LYS  75   2.364   6.491 -11.596
  546   2HB   LYS  75          2HB       LYS  75   3.830   6.321 -10.633
  547   1HG   LYS  75          1HG       LYS  75   4.395   8.103 -12.023
  548   2HG   LYS  75          2HG       LYS  75   5.044   6.736 -12.922
  549   1HD   LYS  75          1HD       LYS  75   3.841   7.915 -14.563
  550   2HD   LYS  75          2HD       LYS  75   2.705   6.662 -14.061
  551   1HE   LYS  75          1HE       LYS  75   1.315   8.163 -12.988
  552   2HE   LYS  75          2HE       LYS  75   2.655   9.240 -12.545
  553   1HZ   LYS  75          1HZ       LYS  75   1.759   8.803 -15.340
  554   2HZ   LYS  75          2HZ       LYS  75   2.864   9.966 -14.781
  555   3HZ   LYS  75          3HZ       LYS  75   1.218  10.094 -14.383
  556    H    PHE  76           H        PHE  76   3.684   3.727  -9.837
  557    HA   PHE  76           HA       PHE  76   6.485   2.717 -10.169
  558   1HB   PHE  76          1HB       PHE  76   5.346   4.179  -7.769
  559   2HB   PHE  76          2HB       PHE  76   6.991   3.585  -7.941
  560    HD1  PHE  76           HD1      PHE  76   4.672   6.248  -8.649
  561    HD2  PHE  76           HD2      PHE  76   8.440   4.551  -9.817
  562    HE1  PHE  76           HE1      PHE  76   5.265   8.360  -9.796
  563    HE2  PHE  76           HE2      PHE  76   9.035   6.668 -10.964
  564    HZ   PHE  76           HZ       PHE  76   7.439   8.565 -10.951
  565    H    LYS  77           H        LYS  77   6.968   1.145  -8.231
  566    HA   LYS  77           HA       LYS  77   4.858  -0.826  -8.133
  567   1HB   LYS  77          1HB       LYS  77   6.390  -1.927  -6.541
  568   2HB   LYS  77          2HB       LYS  77   7.241  -1.388  -7.986
  569   1HG   LYS  77          1HG       LYS  77   7.800   0.741  -6.683
  570   2HG   LYS  77          2HG       LYS  77   7.231  -0.112  -5.248
  571   1HD   LYS  77          1HD       LYS  77   9.716  -0.305  -5.618
  572   2HD   LYS  77          2HD       LYS  77   8.883  -1.857  -5.555
  573   1HE   LYS  77          1HE       LYS  77   9.127  -0.593  -8.246
  574   2HE   LYS  77          2HE       LYS  77  10.602  -1.279  -7.536
  575   1HZ   LYS  77          1HZ       LYS  77   8.272  -2.902  -7.112
  576   2HZ   LYS  77          2HZ       LYS  77   9.806  -3.344  -7.691
  577   3HZ   LYS  77          3HZ       LYS  77   8.643  -2.714  -8.755
  578    H    SER  78           H        SER  78   3.084  -0.480  -7.032
  579    HA   SER  78           HA       SER  78   2.818   1.443  -4.871
  580   1HB   SER  78          1HB       SER  78   0.505  -0.042  -4.986
  581   2HB   SER  78          2HB       SER  78   0.859   1.345  -6.011
  582    HG   SER  78           HG       SER  78   0.362  -0.992  -6.866
  583    H    CYS  79           H        CYS  79   1.409   0.585  -2.906
  584    HA   CYS  79           HA       CYS  79   3.038  -1.065  -1.258
  585   1HB   CYS  79          1HB       CYS  79   0.109  -0.287  -1.157
  586   2HB   CYS  79          2HB       CYS  79   0.985  -0.997   0.196
  587    H    VAL  80           H        VAL  80  -0.277  -1.866  -2.315
  588    HA   VAL  80           HA       VAL  80   0.081  -4.711  -1.923
  589    HB   VAL  80           HB       VAL  80  -1.930  -2.948  -3.324
  590   1HG1  VAL  80          1HG1      VAL  80  -2.596  -4.777  -4.473
  591   2HG1  VAL  80          2HG1      VAL  80  -3.148  -5.411  -2.923
  592   3HG1  VAL  80          3HG1      VAL  80  -1.548  -5.838  -3.531
  593   1HG2  VAL  80          1HG2      VAL  80  -1.543  -3.321  -0.683
  594   2HG2  VAL  80          2HG2      VAL  80  -2.571  -4.716  -1.007
  595   3HG2  VAL  80          3HG2      VAL  80  -3.151  -3.091  -1.369
  596    H    GLY  81           H        GLY  81   0.636  -2.496  -4.577
  597   1HA   GLY  81          1HA       GLY  81   0.708  -4.470  -6.689
  598   2HA   GLY  81          2HA       GLY  81   1.397  -2.846  -6.776
  599    H    CYS  82           H        CYS  82   3.160  -3.008  -4.568
  600    HA   CYS  82           HA       CYS  82   5.369  -4.521  -5.763
  601   1HB   CYS  82          1HB       CYS  82   5.296  -2.232  -4.452
  602   2HB   CYS  82          2HB       CYS  82   5.352  -3.259  -3.023
  603    H    HIS  83           H        HIS  83   2.953  -4.950  -3.345
  604    HA   HIS  83           HA       HIS  83   4.267  -7.030  -1.810
  605   1HB   HIS  83          1HB       HIS  83   1.586  -5.733  -2.079
  606   2HB   HIS  83          2HB       HIS  83   1.662  -7.263  -1.228
  607    HD1  HIS  83           HD1      HIS  83   1.166  -5.950   1.034
  608    HD2  HIS  83           HD2      HIS  83   4.750  -4.933  -0.838
  609    HE1  HIS  83           HE1      HIS  83   2.540  -4.702   2.753
  610    H    LEU  84           H        LEU  84   1.514  -7.133  -4.146
  611    HA   LEU  84           HA       LEU  84   1.302  -9.923  -4.413
  612   1HB   LEU  84          1HB       LEU  84   0.350  -7.543  -5.579
  613   2HB   LEU  84          2HB       LEU  84   1.018  -8.475  -6.914
  614    HG   LEU  84           HG       LEU  84  -0.723  -9.835  -4.893
  615   1HD1  LEU  84          1HD1      LEU  84  -1.853  -8.492  -7.349
  616   2HD1  LEU  84          2HD1      LEU  84  -1.810  -7.671  -5.788
  617   3HD1  LEU  84          3HD1      LEU  84  -2.724  -9.168  -5.974
  618   1HD2  LEU  84          1HD2      LEU  84  -1.357 -11.051  -7.089
  619   2HD2  LEU  84          2HD2      LEU  84   0.265 -11.324  -6.453
  620   3HD2  LEU  84          3HD2      LEU  84   0.021 -10.208  -7.797
  621    H    GLU  85           H        GLU  85   3.626  -7.658  -5.815
  622    HA   GLU  85           HA       GLU  85   4.810  -9.615  -7.641
  623   1HB   GLU  85          1HB       GLU  85   4.908  -6.789  -7.042
  624   2HB   GLU  85          2HB       GLU  85   6.547  -7.432  -7.137
  625   1HG   GLU  85          1HG       GLU  85   5.921  -8.515  -9.321
  626   2HG   GLU  85          2HG       GLU  85   4.381  -7.660  -9.243
  627    H    THR  86           H        THR  86   5.745  -8.098  -4.536
  628    HA   THR  86           HA       THR  86   8.228  -9.524  -4.241
  629    HB   THR  86           HB       THR  86   6.324  -7.977  -2.500
  630    HG1  THR  86           1HG      THR  86   8.960  -7.758  -3.452
  631   1HG2  THR  86          1HG2      THR  86   7.173  -9.925  -1.147
  632   2HG2  THR  86          2HG2      THR  86   7.685  -8.351  -0.534
  633   3HG2  THR  86          3HG2      THR  86   8.812  -9.352  -1.452
  634    H    ALA  87           H        ALA  87   5.039 -10.621  -4.190
  635    HA   ALA  87           HA       ALA  87   5.792 -13.007  -2.532
  636   1HB   ALA  87          1HB       ALA  87   4.060 -11.360  -1.635
  637   2HB   ALA  87          2HB       ALA  87   3.520 -13.033  -1.761
  638   3HB   ALA  87          3HB       ALA  87   3.025 -11.855  -2.976
  639    H    GLY  88           H        GLY  88   5.463 -12.079  -5.630
  640   1HA   GLY  88          1HA       GLY  88   3.566 -13.786  -6.832
  641   2HA   GLY  88          2HA       GLY  88   5.054 -13.259  -7.616
  642    H    ALA  89           H        ALA  89   6.431 -14.613  -5.134
  643    HA   ALA  89           HA       ALA  89   6.291 -17.394  -6.256
  644   1HB   ALA  89          1HB       ALA  89   8.338 -15.764  -6.599
  645   2HB   ALA  89          2HB       ALA  89   8.626 -17.457  -6.198
  646   3HB   ALA  89          3HB       ALA  89   8.725 -16.224  -4.941
  647    H    ASP  90           H        ASP  90   5.448 -15.634  -3.586
  648    HA   ASP  90           HA       ASP  90   5.954 -17.958  -1.775
  649   1HB   ASP  90          1HB       ASP  90   7.473 -16.077  -1.356
  650   2HB   ASP  90          2HB       ASP  90   6.104 -14.990  -1.193
  651    H    ALA  91           H        ALA  91   3.759 -18.571  -2.406
  652    HA   ALA  91           HA       ALA  91   1.372 -17.227  -2.359
  653   1HB   ALA  91          1HB       ALA  91   2.060 -19.857  -1.007
  654   2HB   ALA  91          2HB       ALA  91   1.613 -19.638  -2.699
  655   3HB   ALA  91          3HB       ALA  91   0.424 -19.351  -1.428
  656    H    ALA  92           H        ALA  92   3.451 -17.779   0.408
  657    HA   ALA  92           HA       ALA  92   1.474 -17.091   2.435
  658   1HB   ALA  92          1HB       ALA  92   3.144 -18.000   3.667
  659   2HB   ALA  92          2HB       ALA  92   4.177 -16.628   3.265
  660   3HB   ALA  92          3HB       ALA  92   4.164 -18.056   2.230
  661    H    LYS  93           H        LYS  93   4.123 -15.434   0.761
  662    HA   LYS  93           HA       LYS  93   3.800 -12.884   2.064
  663   1HB   LYS  93          1HB       LYS  93   5.202 -14.128  -0.222
  664   2HB   LYS  93          2HB       LYS  93   4.941 -12.396  -0.377
  665   1HG   LYS  93          1HG       LYS  93   6.046 -11.982   1.741
  666   2HG   LYS  93          2HG       LYS  93   6.159 -13.714   2.061
  667   1HD   LYS  93          1HD       LYS  93   7.827 -14.039   0.465
  668   2HD   LYS  93          2HD       LYS  93   7.364 -12.608  -0.456
  669   1HE   LYS  93          1HE       LYS  93   8.395 -11.134   1.100
  670   2HE   LYS  93          2HE       LYS  93   8.503 -12.398   2.343
  671   1HZ   LYS  93          1HZ       LYS  93   9.825 -12.582  -0.309
  672   2HZ   LYS  93          2HZ       LYS  93  10.036 -13.617   1.022
  673   3HZ   LYS  93          3HZ       LYS  93  10.610 -12.019   1.085
  674    H    LYS  94           H        LYS  94   2.164 -14.539  -0.537
  675    HA   LYS  94           HA       LYS  94   0.993 -12.191  -1.795
  676   1HB   LYS  94          1HB       LYS  94   0.941 -15.109  -1.981
  677   2HB   LYS  94          2HB       LYS  94  -0.650 -14.402  -2.266
  678   1HG   LYS  94          1HG       LYS  94   0.672 -12.719  -3.790
  679   2HG   LYS  94          2HG       LYS  94   1.904 -13.983  -3.792
  680   1HD   LYS  94          1HD       LYS  94  -0.574 -15.285  -4.221
  681   2HD   LYS  94          2HD       LYS  94  -0.560 -13.876  -5.281
  682   1HE   LYS  94          1HE       LYS  94   1.543 -14.557  -6.278
  683   2HE   LYS  94          2HE       LYS  94   1.723 -15.873  -5.100
  684   1HZ   LYS  94          1HZ       LYS  94  -0.565 -15.580  -6.975
  685   2HZ   LYS  94          2HZ       LYS  94  -0.306 -16.863  -5.891
  686   3HZ   LYS  94          3HZ       LYS  94   0.741 -16.636  -7.210
  687    H    LYS  95           H        LYS  95   0.542 -13.563   1.229
  688    HA   LYS  95           HA       LYS  95  -2.298 -12.594   1.388
  689   1HB   LYS  95          1HB       LYS  95  -2.598 -14.650   2.332
  690   2HB   LYS  95          2HB       LYS  95  -0.862 -14.960   2.310
  691   1HG   LYS  95          1HG       LYS  95  -0.551 -13.872   4.423
  692   2HG   LYS  95          2HG       LYS  95  -2.190 -13.218   4.399
  693   1HD   LYS  95          1HD       LYS  95  -3.127 -15.185   5.084
  694   2HD   LYS  95          2HD       LYS  95  -1.986 -16.165   4.163
  695   1HE   LYS  95          1HE       LYS  95  -0.239 -15.777   5.842
  696   2HE   LYS  95          2HE       LYS  95  -1.330 -14.715   6.753
  697   1HZ   LYS  95          1HZ       LYS  95  -1.372 -17.013   7.588
  698   2HZ   LYS  95          2HZ       LYS  95  -1.898 -17.550   6.065
  699   3HZ   LYS  95          3HZ       LYS  95  -2.883 -16.524   6.995
  700    H    GLU  96           H        GLU  96   0.842 -12.808   2.922
  701    HA   GLU  96           HA       GLU  96   0.456 -10.951   5.054
  702   1HB   GLU  96          1HB       GLU  96   2.502 -12.504   3.654
  703   2HB   GLU  96          2HB       GLU  96   3.126 -10.993   4.289
  704   1HG   GLU  96          1HG       GLU  96   1.825 -11.689   6.461
  705   2HG   GLU  96          2HG       GLU  96   1.900 -13.303   5.749
  706    H    LEU  97           H        LEU  97   1.765 -10.631   1.762
  707    HA   LEU  97           HA       LEU  97   2.232  -7.749   2.020
  708   1HB   LEU  97          1HB       LEU  97   2.323  -9.613  -0.356
  709   2HB   LEU  97          2HB       LEU  97   3.100  -8.035  -0.226
  710    HG   LEU  97           HG       LEU  97   3.764 -10.567   1.277
  711   1HD1  LEU  97          1HD1      LEU  97   6.072  -9.320   0.467
  712   2HD1  LEU  97          2HD1      LEU  97   4.950  -8.893  -0.824
  713   3HD1  LEU  97          3HD1      LEU  97   5.243 -10.587  -0.436
  714   1HD2  LEU  97          1HD2      LEU  97   4.484  -7.696   1.932
  715   2HD2  LEU  97          2HD2      LEU  97   5.401  -9.076   2.537
  716   3HD2  LEU  97          3HD2      LEU  97   3.707  -8.875   2.988
  717    H    THR  98           H        THR  98   0.270  -9.654  -0.295
  718    HA   THR  98           HA       THR  98  -1.343  -7.253  -0.849
  719    HB   THR  98           HB       THR  98  -2.373  -8.853  -2.525
  720    HG1  THR  98           1HG      THR  98  -1.639 -10.862  -2.604
  721   1HG2  THR  98          1HG2      THR  98  -0.727  -8.235  -3.953
  722   2HG2  THR  98          2HG2      THR  98   0.505  -9.098  -3.032
  723   3HG2  THR  98          3HG2      THR  98   0.017  -7.475  -2.547
  724    H    GLY  99           H        GLY  99  -1.654 -10.191   1.011
  725   1HA   GLY  99          1HA       GLY  99  -4.420 -10.555   1.092
  726   2HA   GLY  99          2HA       GLY  99  -3.380 -10.796   2.498
  727    H    CYS 100           H        CYS 100  -6.065  -9.252   1.698
  728    HA   CYS 100           HA       CYS 100  -5.505  -6.576   2.718
  729   1HB   CYS 100          1HB       CYS 100  -8.267  -7.577   2.794
  730   2HB   CYS 100          2HB       CYS 100  -7.633  -6.146   2.024
  731    H    LYS 101           H        LYS 101  -7.680  -9.124   3.922
  732    HA   LYS 101           HA       LYS 101  -7.266  -8.056   6.664
  733   1HB   LYS 101          1HB       LYS 101  -9.302  -9.286   7.163
  734   2HB   LYS 101          2HB       LYS 101  -9.543  -8.428   5.641
  735   1HG   LYS 101          1HG       LYS 101  -8.491 -10.761   4.722
  736   2HG   LYS 101          2HG       LYS 101  -9.342 -11.338   6.156
  737   1HD   LYS 101          1HD       LYS 101 -11.429 -10.441   5.389
  738   2HD   LYS 101          2HD       LYS 101 -10.638  -9.539   4.096
  739   1HE   LYS 101          1HE       LYS 101  -9.926 -11.706   3.064
  740   2HE   LYS 101          2HE       LYS 101 -10.855 -12.562   4.311
  741   1HZ   LYS 101          1HZ       LYS 101 -12.092 -10.383   2.754
  742   2HZ   LYS 101          2HZ       LYS 101 -12.842 -11.670   3.573
  743   3HZ   LYS 101          3HZ       LYS 101 -12.026 -11.951   2.111
  744    H    GLY 102           H        GLY 102  -5.650  -9.038   7.819
  745   1HA   GLY 102          1HA       GLY 102  -4.943 -11.069   9.017
  746   2HA   GLY 102          2HA       GLY 102  -5.379 -12.004   7.586
  747    H    SER 103           H        SER 103  -4.012  -9.385   6.268
  748    HA   SER 103           HA       SER 103  -1.477 -10.754   5.758
  749   1HB   SER 103          1HB       SER 103  -1.165  -8.851   4.231
  750   2HB   SER 103          2HB       SER 103  -2.786  -9.508   4.057
  751    HG   SER 103           HG       SER 103  -3.601  -7.754   4.952
  752    H    LYS 104           H        LYS 104   0.068  -8.301   5.515
  753    HA   LYS 104           HA       LYS 104   0.819  -7.920   8.380
  754   1HB   LYS 104          1HB       LYS 104   2.151  -7.469   5.694
  755   2HB   LYS 104          2HB       LYS 104   2.899  -7.035   7.229
  756   1HG   LYS 104          1HG       LYS 104   1.883  -9.751   7.318
  757   2HG   LYS 104          2HG       LYS 104   3.008  -9.543   5.974
  758   1HD   LYS 104          1HD       LYS 104   4.795  -9.222   7.351
  759   2HD   LYS 104          2HD       LYS 104   3.854  -8.283   8.511
  760   1HE   LYS 104          1HE       LYS 104   3.459 -11.270   8.231
  761   2HE   LYS 104          2HE       LYS 104   4.688 -10.588   9.317
  762   1HZ   LYS 104          1HZ       LYS 104   1.981  -9.452   9.344
  763   2HZ   LYS 104          2HZ       LYS 104   3.126  -9.542  10.597
  764   3HZ   LYS 104          3HZ       LYS 104   2.244 -10.923  10.147
  765    H    CYS 105           H        CYS 105  -0.336  -6.379   5.514
  766    HA   CYS 105           HA       CYS 105   0.171  -3.637   6.333
  767   1HB   CYS 105          1HB       CYS 105  -0.350  -5.082   4.035
  768   2HB   CYS 105          2HB       CYS 105  -1.852  -4.232   4.299
  769    H    HIS 106           H        HIS 106  -2.584  -5.879   6.498
  770    HA   HIS 106           HA       HIS 106  -4.172  -3.727   7.864
  771   1HB   HIS 106          1HB       HIS 106  -4.789  -6.012   6.034
  772   2HB   HIS 106          2HB       HIS 106  -6.033  -5.499   7.173
  773    HD1  HIS 106           HD1      HIS 106  -5.282  -2.435   7.100
  774    HD2  HIS 106           HD2      HIS 106  -5.962  -4.824   3.735
  775    HE1  HIS 106           HE1      HIS 106  -5.827  -0.853   5.205
  776    H    SER 107           H        SER 107  -2.871  -4.435   9.850
  777    HA   SER 107           HA       SER 107  -3.087  -7.061  10.969
  778   1HB   SER 107          1HB       SER 107  -2.608  -4.279  12.041
  779   2HB   SER 107          2HB       SER 107  -2.620  -5.678  13.111
  780    HG   SER 107           HG       SER 107  -0.524  -5.163  12.280
  781    HHA  HEC 201           HHA      HEC 201   6.111   8.895   5.704
  782    HHB  HEC 201           HHB      HEC 201  12.229   9.684   4.896
  783    HHC  HEC 201           HHC      HEC 201  12.460   4.702   1.040
  784    HHD  HEC 201           HHD      HEC 201   6.346   3.750   1.836
  785   1HMA  HEC 201          1HMA      HEC 201  11.488  10.591   6.987
  786   2HMA  HEC 201          2HMA      HEC 201  10.015  10.730   7.953
  787   3HMA  HEC 201          3HMA      HEC 201  10.365  11.920   6.698
  788   1HAA  HEC 201          1HAA      HEC 201   6.592  10.035   7.183
  789   2HAA  HEC 201          2HAA      HEC 201   7.941  10.978   7.812
  790   1HBA  HEC 201          1HBA      HEC 201   6.949  11.722   5.113
  791   2HBA  HEC 201          2HBA      HEC 201   5.893  12.098   6.473
  792   1HMB  HEC 201          1HMB      HEC 201  15.168   7.962   4.478
  793   2HMB  HEC 201          2HMB      HEC 201  14.165   9.413   4.483
  794   3HMB  HEC 201          3HMB      HEC 201  15.067   8.968   3.033
  795    HAB  HEC 201           HAB      HEC 201  14.339   5.322   1.251
  796   1HBB  HEC 201          1HBB      HEC 201  16.660   6.247   2.504
  797   2HBB  HEC 201          2HBB      HEC 201  15.851   4.710   2.814
  798   3HBB  HEC 201          3HBB      HEC 201  15.483   6.118   3.811
  799   1HMC  HEC 201          1HMC      HEC 201  10.550   2.353  -0.934
  800   2HMC  HEC 201          2HMC      HEC 201  11.939   3.171  -0.219
  801   3HMC  HEC 201          3HMC      HEC 201  11.299   1.706   0.525
  802    HAC  HEC 201           HAC      HEC 201   6.886   2.409   0.664
  803   1HBC  HEC 201          1HBC      HEC 201   9.393   0.789   0.690
  804   2HBC  HEC 201          2HBC      HEC 201   8.053   0.232  -0.312
  805   3HBC  HEC 201          3HBC      HEC 201   7.827   0.443   1.423
  806   1HMD  HEC 201          1HMD      HEC 201   4.212   3.727   4.157
  807   2HMD  HEC 201          2HMD      HEC 201   3.120   5.052   3.757
  808   3HMD  HEC 201          3HMD      HEC 201   4.012   4.233   2.479
  809   1HAD  HEC 201          1HAD      HEC 201   4.302   8.278   5.531
  810   2HAD  HEC 201          2HAD      HEC 201   3.261   7.704   4.236
  811   1HBD  HEC 201          1HBD      HEC 201   2.831   5.633   5.464
  812   2HBD  HEC 201          2HBD      HEC 201   3.938   6.138   6.739
  813    HHA  HEC 202           HHA      HEC 202   1.618   7.644  -9.512
  814    HHB  HEC 202           HHB      HEC 202   2.830   4.103  -4.794
  815    HHC  HEC 202           HHC      HEC 202   4.602   8.982  -1.272
  816    HHD  HEC 202           HHD      HEC 202   2.580  12.891  -5.885
  817   1HMA  HEC 202          1HMA      HEC 202   0.416   3.221  -7.548
  818   2HMA  HEC 202          2HMA      HEC 202   0.914   3.212  -5.856
  819   3HMA  HEC 202          3HMA      HEC 202   2.074   2.797  -7.119
  820   1HAA  HEC 202          1HAA      HEC 202   1.112   5.209  -9.997
  821   2HAA  HEC 202          2HAA      HEC 202  -0.012   4.395  -8.950
  822   1HBA  HEC 202          1HBA      HEC 202  -1.332   6.402  -8.695
  823   2HBA  HEC 202          2HBA      HEC 202  -0.149   7.340  -9.603
  824   1HMB  HEC 202          1HMB      HEC 202   4.543   3.742  -1.518
  825   2HMB  HEC 202          2HMB      HEC 202   2.836   3.646  -1.956
  826   3HMB  HEC 202          3HMB      HEC 202   4.077   3.307  -3.163
  827    HAB  HEC 202           HAB      HEC 202   4.259   7.056   0.094
  828   1HBB  HEC 202          1HBB      HEC 202   6.491   6.923   0.336
  829   2HBB  HEC 202          2HBB      HEC 202   6.621   6.292  -1.305
  830   3HBB  HEC 202          3HBB      HEC 202   6.418   5.184   0.050
  831   1HMC  HEC 202          1HMC      HEC 202   5.789  11.482  -1.186
  832   2HMC  HEC 202          2HMC      HEC 202   4.692  12.860  -1.116
  833   3HMC  HEC 202          3HMC      HEC 202   4.216  11.318  -0.406
  834    HAC  HEC 202           HAC      HEC 202   2.701  13.990  -4.128
  835   1HBC  HEC 202          1HBC      HEC 202   5.321  13.899  -2.653
  836   2HBC  HEC 202          2HBC      HEC 202   4.306  15.326  -2.445
  837   3HBC  HEC 202          3HBC      HEC 202   4.867  14.870  -4.054
  838   1HMD  HEC 202          1HMD      HEC 202   0.886  13.291  -8.327
  839   2HMD  HEC 202          2HMD      HEC 202   1.897  12.960  -9.735
  840   3HMD  HEC 202          3HMD      HEC 202   2.630  13.549  -8.242
  841   1HAD  HEC 202          1HAD      HEC 202   1.908   9.255 -10.768
  842   2HAD  HEC 202          2HAD      HEC 202   1.059  10.795 -10.871
  843   1HBD  HEC 202          1HBD      HEC 202   3.684  11.527 -10.317
  844   2HBD  HEC 202          2HBD      HEC 202   3.850  10.168 -11.429
  845    HHA  HEC 203           HHA      HEC 203   6.981  -6.872   4.636
  846    HHB  HEC 203           HHB      HEC 203   2.644  -2.041   4.963
  847    HHC  HEC 203           HHC      HEC 203   4.562   0.041  -0.434
  848    HHD  HEC 203           HHD      HEC 203   8.829  -4.549  -0.914
  849   1HMA  HEC 203          1HMA      HEC 203   2.108  -3.827   6.584
  850   2HMA  HEC 203          2HMA      HEC 203   3.423  -3.457   7.700
  851   3HMA  HEC 203          3HMA      HEC 203   2.890  -5.126   7.485
  852   1HAA  HEC 203          1HAA      HEC 203   4.644  -6.142   7.727
  853   2HAA  HEC 203          2HAA      HEC 203   4.555  -7.337   6.441
  854   1HBA  HEC 203          1HBA      HEC 203   6.825  -7.646   6.384
  855   2HBA  HEC 203          2HBA      HEC 203   7.168  -5.962   6.787
  856   1HMB  HEC 203          1HMB      HEC 203   1.122  -0.381   4.192
  857   2HMB  HEC 203          2HMB      HEC 203   2.427   0.441   5.047
  858   3HMB  HEC 203          3HMB      HEC 203   1.648   1.219   3.668
  859    HAB  HEC 203           HAB      HEC 203   2.656   0.902   0.161
  860   1HBB  HEC 203          1HBB      HEC 203   4.448   2.374   0.279
  861   2HBB  HEC 203          2HBB      HEC 203   4.366   2.494   2.036
  862   3HBB  HEC 203          3HBB      HEC 203   3.200   3.364   1.037
  863   1HMC  HEC 203          1HMC      HEC 203   5.993  -0.775  -3.509
  864   2HMC  HEC 203          2HMC      HEC 203   7.161   0.250  -2.675
  865   3HMC  HEC 203          3HMC      HEC 203   5.461   0.290  -2.207
  866    HAC  HEC 203           HAC      HEC 203   9.049  -3.466  -2.535
  867   1HBC  HEC 203          1HBC      HEC 203   9.187  -0.865  -2.499
  868   2HBC  HEC 203          2HBC      HEC 203   8.200  -0.945  -3.954
  869   3HBC  HEC 203          3HBC      HEC 203   9.789  -1.709  -3.925
  870   1HMD  HEC 203          1HMD      HEC 203  10.292  -5.965  -0.237
  871   2HMD  HEC 203          2HMD      HEC 203   9.734  -7.626  -0.039
  872   3HMD  HEC 203          3HMD      HEC 203  10.815  -6.910   1.158
  873   1HAD  HEC 203          1HAD      HEC 203  10.040  -7.716   3.317
  874   2HAD  HEC 203          2HAD      HEC 203   8.521  -7.943   4.176
  875   1HBD  HEC 203          1HBD      HEC 203   7.694  -9.428   2.458
  876   2HBD  HEC 203          2HBD      HEC 203   9.083  -9.082   1.427
  877    HHA  HEC 204           HHA      HEC 204  -6.890   2.244   3.884
  878    HHB  HEC 204           HHB      HEC 204 -10.275  -2.303   1.163
  879    HHC  HEC 204           HHC      HEC 204  -4.987  -5.892   0.931
  880    HHD  HEC 204           HHD      HEC 204  -1.616  -0.962   2.676
  881   1HMA  HEC 204          1HMA      HEC 204 -11.540   0.928   1.712
  882   2HMA  HEC 204          2HMA      HEC 204 -11.800   0.073   3.234
  883   3HMA  HEC 204          3HMA      HEC 204 -11.593  -0.835   1.737
  884   1HAA  HEC 204          1HAA      HEC 204 -10.080   2.135   4.560
  885   2HAA  HEC 204          2HAA      HEC 204  -8.615   2.885   3.938
  886   1HBA  HEC 204          1HBA      HEC 204  -9.769   3.150   1.721
  887   2HBA  HEC 204          2HBA      HEC 204 -11.242   2.553   2.480
  888   1HMB  HEC 204          1HMB      HEC 204 -10.785  -3.890  -0.035
  889   2HMB  HEC 204          2HMB      HEC 204 -10.406  -5.611   0.045
  890   3HMB  HEC 204          3HMB      HEC 204 -10.017  -4.687  -1.407
  891    HAB  HEC 204           HAB      HEC 204  -6.651  -6.960   0.249
  892   1HBB  HEC 204          1HBB      HEC 204  -5.946  -6.236  -1.884
  893   2HBB  HEC 204          2HBB      HEC 204  -7.578  -5.761  -2.360
  894   3HBB  HEC 204          3HBB      HEC 204  -7.160  -7.469  -2.222
  895   1HMC  HEC 204          1HMC      HEC 204  -1.874  -6.032   0.351
  896   2HMC  HEC 204          2HMC      HEC 204  -1.633  -6.156   2.094
  897   3HMC  HEC 204          3HMC      HEC 204  -3.177  -6.623   1.381
  898    HAC  HEC 204           HAC      HEC 204  -0.597  -2.500   2.975
  899   1HBC  HEC 204          1HBC      HEC 204   0.301  -4.336   0.730
  900   2HBC  HEC 204          2HBC      HEC 204   1.291  -3.195   1.642
  901   3HBC  HEC 204          3HBC      HEC 204   0.066  -2.601   0.522
  902   1HMD  HEC 204          1HMD      HEC 204  -1.109   1.453   2.694
  903   2HMD  HEC 204          2HMD      HEC 204  -1.716   2.674   3.812
  904   3HMD  HEC 204          3HMD      HEC 204  -1.272   1.075   4.409
  905   1HAD  HEC 204          1HAD      HEC 204  -3.767   3.866   3.621
  906   2HAD  HEC 204          2HAD      HEC 204  -5.425   3.507   4.093
  907   1HBD  HEC 204          1HBD      HEC 204  -4.160   2.230   6.078
  908   2HBD  HEC 204          2HBD      HEC 204  -2.938   3.451   5.723