*HEADER   ALLERGEN                                24-APR-98   2BBG    
*TITLE    RAGWEED POLLEN ALLERGEN FROM AMBROSIA TRIFIDA V, NMR,       
*TITLE  2 30 STRUCTURES                                               
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: POLLEN ALLERGEN 5;                               
*COMPND  3 CHAIN: NULL                                                
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: AMBROSIA TRIFIDA;                     
*SOURCE  3 ORGANISM_COMMON: GIANT RAGWEED;                            
*SOURCE  4 OTHER_DETAILS: POLLEN                                      
*KEYWDS   PROTEIN ALLERGEN, SMALL HIGHLY DISULFIDE BONDED             
*EXPDTA   NMR, 30 STRUCTURES                                          
*AUTHOR   G.L.WARREN,C.J.TUNER,G.A.PETSKO,A.T.BRUNGER                 
*REVDAT  1   17-JUN-98 2BBG    0                                      
 
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 9    and name HN  ))
        3.8728    0.8907    0.8907 { previous:     3.7934    0.8725    0.8725 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 17   and name HN  ))
        4.1382    0.9518    0.9518 { previous:     4.0976    0.9424    0.9424 }
 
 ASSIgn ((segid "    " and resid 9    and name HN  ))
        ((segid "    " and resid 10   and name HN  ))
        1.9886    0.2886    0.4574 { previous:     2.0317    0.3317    0.4673 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 11   and name HN  ))
        2.4900    0.5727    0.5727 { previous:     2.5084    0.5769    0.5769 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 12   and name HN  ))
        2.1947    0.4947    0.5048 { previous:     2.2232    0.5113    0.5113 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 13   and name HN  ))
        2.6277    0.6044    0.6044 { previous:     2.6406    0.6073    0.6073 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 13   and name HN  ))
        2.3158    0.5326    0.5326 { previous:     2.3302    0.5359    0.5359 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 14   and name HN  ))
        3.1463    0.7237    0.7237 { previous:     3.1381    0.7218    0.7218 }
 
 ASSIgn ((segid "    " and resid 15   and name HN  ))
        ((segid "    " and resid 16   and name HN  ))
        2.9142    0.6703    0.6703 { previous:     2.9315    0.6742    0.6742 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 27   and name HN  ))
        3.0066    0.6915    0.6915 { previous:     3.0188    0.6943    0.6943 }
 
 ASSIgn ((segid "    " and resid 23   and name HN  ))
        ((segid "    " and resid 24   and name HN  ))
        2.2781    0.5240    0.5240 { previous:     2.1311    0.4311    0.4901 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 31   and name HN  ))
        2.7856    0.6407    0.6407 { previous:     2.7989    0.6438    0.6438 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 34   and name HN  ))
        3.2968    0.7583    0.7583 { previous:     3.3172    0.7630    0.7630 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 33   and name HN  ))
        2.6808    0.6166    0.6166 { previous:     2.6973    0.6204    0.6204 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 34   and name HN  ))
        2.5434    0.5850    0.5850 { previous:     2.5553    0.5877    0.5877 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 35   and name HN  ))
        2.2881    0.5263    0.5263 { previous:     2.2943    0.5277    0.5277 }
 
 ASSIgn ((segid "    " and resid 36   and name HN  ))
        ((segid "    " and resid 37   and name HN  ))
        3.2737    0.7530    0.7530 { previous:     3.3240    0.7645    0.7645 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 39   and name HN  ))
        2.2283    0.5125    0.5125 { previous:     2.2425    0.5158    0.5158 }
 
 ASSIgn ((segid "    " and resid 3    and name HA1 )
      OR (segid "    " and resid 3    and name HA2 ))
        ((segid "    " and resid 4    and name HN  ))
        2.6977    0.6205    0.6205 { previous:     2.7136    0.6241    0.6241 }
 
 ASSIgn ((segid "    " and resid 4    and name HA  ))
        ((segid "    " and resid 5    and name HN  ))
        3.1754    0.7304    0.7304 { previous:     3.1374    0.7216    0.7216 }
 
 ASSIgn ((segid "    " and resid 5    and name HA  ))
        ((segid "    " and resid 6    and name HN  ))
        2.2521    0.5180    0.5180 { previous:     2.2593    0.5196    0.5196 }
 
 ASSIgn ((segid "    " and resid 6    and name HA  ))
        ((segid "    " and resid 7    and name HN  ))
        2.4775    0.5698    0.5698 { previous:     2.4875    0.5721    0.5721 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 8    and name HN  ))
        2.1742    0.4742    0.5001 { previous:     2.1475    0.4475    0.4939 }
 
 ASSIgn ((segid "    " and resid 9    and name HA  ))
        ((segid "    " and resid 10   and name HN  ))
        4.1790    0.9612    0.9612 { previous:     4.0517    0.9319    0.9319 }
 
 ASSIgn ((segid "    " and resid 13   and name HA  ))
        ((segid "    " and resid 14   and name HN  ))
        2.4242    0.5576    0.5576 { previous:     2.4551    0.5647    0.5647 }
 
 ASSIgn ((segid "    " and resid 14   and name HA  ))
        ((segid "    " and resid 15   and name HN  ))
        2.1614    0.4614    0.4971 { previous:     2.1371    0.4371    0.4915 }
 
 ASSIgn ((segid "    " and resid 16   and name HA  ))
        ((segid "    " and resid 17   and name HN  ))
        3.7502    0.8626    0.8626 { previous:     3.7486    0.8622    0.8622 }
 
 ASSIgn ((segid "    " and resid 17   and name HA  ))
        ((segid "    " and resid 18   and name HN  ))
        3.0963    0.7121    0.7121 { previous:     3.0586    0.7035    0.7035 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 19   and name HN  ))
        2.3183    0.5332    0.5332 { previous:     2.3166    0.5328    0.5328 }
 
 ASSIgn ((segid "    " and resid 19   and name HA  ))
        ((segid "    " and resid 20   and name HN  ))
        2.6829    0.6171    0.6171 { previous:     2.6998    0.6210    0.6210 }
 
 ASSIgn ((segid "    " and resid 22   and name HA  ))
        ((segid "    " and resid 23   and name HN  ))
        2.3753    0.5463    0.5463 { previous:     2.3844    0.5484    0.5484 }
 
 ASSIgn ((segid "    " and resid 26   and name HA  ))
        ((segid "    " and resid 27   and name HN  ))
        2.8081    0.6459    0.6459 { previous:     2.9255    0.6729    0.6729 }
 
 ASSIgn ((segid "    " and resid 28   and name HA  ))
        ((segid "    " and resid 29   and name HN  ))
        2.3369    0.5375    0.5375 { previous:     2.3271    0.5352    0.5352 }
 
 ASSIgn ((segid "    " and resid 29   and name HA  ))
        ((segid "    " and resid 30   and name HN  ))
        3.2768    0.7537    0.7537 { previous:     3.2610    0.7500    0.7500 }
 
 ASSIgn ((segid "    " and resid 31   and name HA  ))
        ((segid "    " and resid 32   and name HN  ))
        2.8039    0.6449    0.6449 { previous:     2.8107    0.6465    0.6465 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 35   and name HN  ))
        3.0764    0.7076    0.7076 { previous:     3.1040    0.7139    0.7139 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 36   and name HN  ))
        4.1605    0.9569    0.9569 { previous:     4.1912    0.9640    0.9640 }
 
 ASSIgn ((segid "    " and resid 36   and name HA  ))
        ((segid "    " and resid 37   and name HN  ))
        3.3291    0.7657    0.7657 { previous:     3.3383    0.7678    0.7678 }
 
 ASSIgn ((segid "    " and resid 37   and name HA  ))
        ((segid "    " and resid 38   and name HN  ))
        2.7866    0.6409    0.6409 { previous:     2.7933    0.6425    0.6425 }
 
 ASSIgn ((segid "    " and resid 38   and name HA  ))
        ((segid "    " and resid 39   and name HN  ))
        3.2171    0.7399    0.7399 { previous:     3.2112    0.7386    0.7386 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 19   and name HA  ))
        3.4676    0.7976    0.7976 { previous:     3.4744    0.7991    0.7991 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 9    and name HA  ))
        4.0659    0.9352    0.9352 { previous:     4.0179    0.9241    0.9241 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 9    and name HA  ))
        3.4218    0.7870    0.7870 { previous:     3.3451    0.7694    0.7694 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 9    and name HA  ))
        4.0871    0.9400    0.9400 { previous:     4.1220    0.9481    0.9481 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 14   and name HA  ))
        3.7978    0.8735    0.8735 { previous:     3.8010    0.8742    0.8742 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 22   and name HA  ))
        3.9162    0.9007    0.9007 { previous:     4.0206    0.9247    0.9247 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 18   and name HA  ))
        3.5213    0.8099    0.8099 { previous:     3.5842    0.8244    0.8244 }
 
 ASSIgn ((segid "    " and resid 36   and name HN  ))
        ((segid "    " and resid 33   and name HA  ))
        3.1932    0.7344    0.7344 { previous:     3.2015    0.7363    0.7363 }
 
 ASSIgn ((segid "    " and resid 37   and name HN  ))
        ((segid "    " and resid 34   and name HA  ))
        3.2555    0.7488    0.7488 { previous:     3.1801    0.7314    0.7314 }
 
 ASSIgn ((segid "    " and resid 2    and name HN  ))
        ((segid "    " and resid 1    and name HB1 ))
        4.1688    0.9588    0.9588 { previous:     3.6807    0.8466    0.8466 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 5    and name HB2 ))
        3.5742    0.8221    0.8221 { previous:     3.5515    0.8168    0.8168 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 6    and name HB2 ))
        3.1783    0.7310    0.7310 { previous:     3.1603    0.7269    0.7269 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 6    and name HB1 ))
        3.8782    0.8920    0.8920 { previous:     3.8872    0.8941    0.8941 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 9    and name HB  ))
        3.7968    0.8733    0.8733 { previous:     3.9222    0.9021    0.9021 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 11   and name HB2 ))
        3.7287    0.8576    0.8576 { previous:     3.7523    0.8630    0.8630 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 13   and name HB1 ))
        3.4958    0.8040    0.8040 { previous:     3.5158    0.8086    0.8086 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 16   and name HB2 ))
        2.6584    0.6114    0.6114 { previous:     2.6690    0.6139    0.6139 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 16   and name HB1 ))
        2.1417    0.4417    0.4926 { previous:     2.1493    0.4493    0.4943 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 18   and name HB1 ))
        2.9236    0.6724    0.6724 { previous:     2.9302    0.6739    0.6739 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 29   and name HB2 ))
        3.4696    0.7980    0.7980 { previous:     3.5077    0.8068    0.8068 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 29   and name HB1 ))
        3.0738    0.7070    0.7070 { previous:     3.0595    0.7037    0.7037 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 29   and name HB2 ))
        3.6445    0.8382    0.8382 { previous:     3.7026    0.8516    0.8516 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 34   and name HB  ))
        2.3457    0.5395    0.5395 { previous:     2.3549    0.5416    0.5416 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 31   and name HB2 ))
        4.4743    1.0291    1.0291 { previous:     4.4768    1.0297    1.0297 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 34   and name HB  ))
        2.4671    0.5674    0.5674 { previous:     2.4692    0.5679    0.5679 }
 
 ASSIgn ((segid "    " and resid 37   and name HN  ))
        ((segid "    " and resid 36   and name HB1 )
      OR (segid "    " and resid 36   and name HB2 ))
        2.5362    0.5833    0.5833 { previous:     2.5473    0.5859    0.5859 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 37   and name HB1 )
      OR (segid "    " and resid 37   and name HB2 ))
        2.0363    0.3363    0.4684 { previous:     2.0483    0.3483    0.4711 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 37   and name HB1 )
      OR (segid "    " and resid 37   and name HB2 ))
        3.8192    0.8784    0.8784 { previous:     3.8199    0.8786    0.8786 }
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 7    and name HG1 ))
        3.5075    0.8067    0.8067 { previous:     3.4048    0.7831    0.7831 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 28   and name HB1 ))
        2.9353    0.6751    0.6751 { previous:     3.0284    0.6965    0.6965 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 28   and name HB2 ))
        4.0357    0.9282    0.9282 { previous:     4.0526    0.9321    0.9321 }
 
 ASSIgn ((segid "    " and resid 37   and name HB1 )
      OR (segid "    " and resid 37   and name HB2 ))
        ((segid "    " and resid 38   and name HD22))
        4.3408    0.9984    0.9984 { previous:     4.3104    0.9914    0.9914 }
 
 ASSIgn ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        ((segid "    " and resid 7    and name HN  ))
        3.4566    0.7950    0.7950 { previous:     3.4871    0.8020    0.8020 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 32   and name HN  ))
        3.6353    0.8361    0.8361 { previous:     3.6631    0.8425    0.8425 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 30   and name HN  ))
        4.2433    0.9760    0.9760 { previous:     4.1693    0.9589    0.9589 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 31   and name HN  ))
        4.7274    1.0873    1.0873 { previous:     4.6915    1.0790    1.0790 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 35   and name HN  ))
        5.0442    1.1602    1.1602 { previous:     5.1274    1.1793    1.1793 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 7    and name HN  ))
        5.7389    1.3200    1.3200 { previous:     5.6282    1.2945    1.2945 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 10   and name HB1 ))
        2.9124    0.6699    0.6699 { previous:     2.9045    0.6680    0.6680 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 10   and name HB2 ))
        3.3190    0.7634    0.7634 { previous:     3.2296    0.7428    0.7428 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 19   and name HA  ))
        4.3892    1.0095    1.0095 { previous:     4.2608    0.9800    0.9800 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 7    and name HB1 ))
        4.2791    0.9842    0.9842 { previous:     4.1802    0.9615    0.9615 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 32   and name HD1 )
      OR (segid "    " and resid 32   and name HD2 ))
        5.6158    1.2916    1.2916 { previous:     5.4349    1.2500    1.2500 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 32   and name HE1 )
      OR (segid "    " and resid 32   and name HE2 ))
        4.3475    0.9999    0.9999 { previous:     4.3932    1.0104    1.0104 }
 
 ASSIgn ((segid "    " and resid 29   and name HE1 )
      OR (segid "    " and resid 29   and name HE2 ))
        ((segid "    " and resid 34   and name HA  ))
        5.3616    1.2332    1.2332 { previous:     5.5245    1.2706    1.2706 }
 
 ASSIgn ((segid "    " and resid 2    and name HN  ))
        ((segid "    " and resid 2    and name HB2 ))
        2.5957    0.5970    0.5970 { previous:     2.5050    0.5762    0.5762 }
 
 ASSIgn ((segid "    " and resid 4    and name HN  ))
        ((segid "    " and resid 4    and name HB2 ))
        2.7060    0.6224    0.6224 { previous:     2.7439    0.6311    0.6311 }
 
 ASSIgn ((segid "    " and resid 5    and name HN  ))
        ((segid "    " and resid 5    and name HB1 ))
        3.1761    0.7305    0.7305 { previous:     3.2009    0.7362    0.7362 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        3.0684    0.7057    0.7057 { previous:     3.0527    0.7021    0.7021 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 7    and name HA  ))
        3.4134    0.7851    0.7851 { previous:     3.4313    0.7892    0.7892 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 7    and name HB1 ))
        2.5186    0.5793    0.5793 { previous:     2.5149    0.5784    0.5784 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 7    and name HB2 ))
        3.5855    0.8247    0.8247 { previous:     3.6038    0.8289    0.8289 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 7    and name HG2 ))
        2.5013    0.5753    0.5753 { previous:     2.4965    0.5742    0.5742 }
 
 ASSIgn ((segid "    " and resid 7    and name HB2 ))
        ((segid "    " and resid 7    and name HG1 ))
        1.8898    0.1898    0.4346 { previous:     1.9049    0.2049    0.4381 }
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 8    and name HA1 ))
        3.0836    0.7092    0.7092 { previous:     2.9476    0.6779    0.6779 }
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 8    and name HA2 ))
        2.3988    0.5517    0.5517 { previous:     2.2907    0.5269    0.5269 }
 
 ASSIgn ((segid "    " and resid 8    and name HA1 ))
        ((segid "    " and resid 8    and name HA2 ))
        1.7812    0.0812    0.4097 { previous:     1.7793    0.0793    0.4092 }
 
 ASSIgn ((segid "    " and resid 9    and name HN  ))
        ((segid "    " and resid 9    and name HA  ))
        2.7015    0.6213    0.6213 { previous:     2.6607    0.6120    0.6120 }
 
 ASSIgn ((segid "    " and resid 9    and name HN  ))
        ((segid "    " and resid 9    and name HB  ))
        2.3433    0.5390    0.5390 { previous:     2.4018    0.5524    0.5524 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 10   and name HA  ))
        3.3228    0.7643    0.7643 { previous:     3.3921    0.7802    0.7802 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 10   and name HB1 ))
        2.5564    0.5880    0.5880 { previous:     2.6540    0.6104    0.6104 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 10   and name HB2 ))
        2.2776    0.5239    0.5239 { previous:     2.3479    0.5400    0.5400 }
 
 ASSIgn ((segid "    " and resid 10   and name HD22))
        ((segid "    " and resid 10   and name HD21))
        1.9403    0.2403    0.4463 { previous:     1.9468    0.2468    0.4478 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 11   and name HB2 ))
        2.2402    0.5152    0.5152 { previous:     2.2676    0.5216    0.5216 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 11   and name HB1 ))
        3.8730    0.8908    0.8908 { previous:     3.9012    0.8973    0.8973 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 12   and name HA1 ))
        3.0027    0.6906    0.6906 { previous:     3.0108    0.6925    0.6925 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 12   and name HA2 ))
        2.2769    0.5237    0.5237 { previous:     2.2830    0.5251    0.5251 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 13   and name HB1 ))
        2.2885    0.5263    0.5263 { previous:     2.3363    0.5373    0.5373 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 13   and name HG1 )
      OR (segid "    " and resid 13   and name HG2 ))
        2.5829    0.5941    0.5941 { previous:     2.5900    0.5957    0.5957 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 14   and name HA  ))
        2.9418    0.6766    0.6766 { previous:     2.9262    0.6730    0.6730 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 14   and name HB  ))
        2.1648    0.4648    0.4979 { previous:     2.1720    0.4720    0.4995 }
 
 ASSIgn ((segid "    " and resid 20   and name HN  ))
        ((segid "    " and resid 20   and name HB1 ))
        4.1793    0.9612    0.9612 { previous:     4.1375    0.9516    0.9516 }
 
 ASSIgn ((segid "    " and resid 15   and name HN  ))
        ((segid "    " and resid 15   and name HA2 ))
        2.6236    0.6034    0.6034 { previous:     2.6294    0.6048    0.6048 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 16   and name HB1 ))
        3.8560    0.8869    0.8869 { previous:     3.8474    0.8849    0.8849 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 16   and name HB2 ))
        2.5666    0.5903    0.5903 { previous:     2.5969    0.5973    0.5973 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 16   and name HG1 ))
        2.8399    0.6532    0.6532 { previous:     2.8814    0.6627    0.6627 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 16   and name HG2 ))
        3.9793    0.9152    0.9152 { previous:     3.8459    0.8846    0.8846 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 17   and name HB2 ))
        2.7673    0.6365    0.6365 { previous:     2.8194    0.6485    0.6485 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 17   and name HB1 ))
        3.7379    0.8597    0.8597 { previous:     3.7402    0.8602    0.8602 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        3.1087    0.7150    0.7150 { previous:     3.0816    0.7088    0.7088 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 19   and name HB1 ))
        3.2593    0.7496    0.7496 { previous:     3.2486    0.7472    0.7472 }
 
 ASSIgn ((segid "    " and resid 20   and name HN  ))
        ((segid "    " and resid 20   and name HB2 ))
        5.0691    1.1659    1.1659 { previous:     5.1391    1.1820    1.1820 }
 
 ASSIgn ((segid "    " and resid 22   and name HN  ))
        ((segid "    " and resid 22   and name HB  ))
        2.8315    0.6512    0.6512 { previous:     2.5346    0.5829    0.5829 }
 
 ASSIgn ((segid "    " and resid 23   and name HN  ))
        ((segid "    " and resid 23   and name HA2 ))
        3.1508    0.7247    0.7247 { previous:     2.6225    0.6032    0.6032 }
 
 ASSIgn ((segid "    " and resid 23   and name HN  ))
        ((segid "    " and resid 23   and name HA1 ))
        2.5513    0.5868    0.5868 { previous:     3.1364    0.7214    0.7214 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 24   and name HB2 ))
        3.8617    0.8882    0.8882 { previous:     3.7554    0.8637    0.8637 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 24   and name HB1 ))
        2.6305    0.6050    0.6050 { previous:     2.6311    0.6052    0.6052 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 24   and name HD1 )
      OR (segid "    " and resid 24   and name HD2 ))
        3.8910    0.8949    0.8949 { previous:     3.8794    0.8923    0.8923 }
 
 ASSIgn ((segid "    " and resid 25   and name HN  ))
        ((segid "    " and resid 25   and name HE1 )
      OR (segid "    " and resid 25   and name HE2 ))
        5.8574    1.3472    1.3472 { previous:     5.6901    1.3087    1.3087 }
 
 ASSIgn ((segid "    " and resid 25   and name HE1 )
      OR (segid "    " and resid 25   and name HE2 ))
        ((segid "    " and resid 25   and name HB1 )
      OR (segid "    " and resid 25   and name HB2 ))
        6.5336    1.5027    1.5027 { previous:     6.5271    1.5012    1.5012 }
 
 ASSIgn ((segid "    " and resid 27   and name HN  ))
        ((segid "    " and resid 27   and name HB  ))
        2.4863    0.5718    0.5718 { previous:     2.5122    0.5778    0.5778 }
 
 ASSIgn ((segid "    " and resid 28   and name HN  ))
        ((segid "    " and resid 28   and name HB2 ))
        2.5086    0.5770    0.5770 { previous:     2.4891    0.5725    0.5725 }
 
 ASSIgn ((segid "    " and resid 28   and name HN  ))
        ((segid "    " and resid 28   and name HB1 ))
        3.6552    0.8407    0.8407 { previous:     3.6479    0.8390    0.8390 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 29   and name HB1 ))
        3.3031    0.7597    0.7597 { previous:     3.2997    0.7589    0.7589 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        3.0033    0.6908    0.6908 { previous:     3.0264    0.6961    0.6961 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 30   and name HA  ))
        2.8983    0.6666    0.6666 { previous:     2.9393    0.6760    0.6760 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 30   and name HB1 ))
        2.2878    0.5262    0.5262 { previous:     2.2911    0.5269    0.5269 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 30   and name HB2 ))
        3.8345    0.8819    0.8819 { previous:     3.8116    0.8767    0.8767 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 31   and name HA  ))
        3.8522    0.8860    0.8860 { previous:     3.8629    0.8885    0.8885 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 31   and name HB2 ))
        2.8592    0.6576    0.6576 { previous:     2.8608    0.6580    0.6580 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 32   and name HA  ))
        2.9219    0.6720    0.6720 { previous:     2.9226    0.6722    0.6722 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 32   and name HB2 ))
        3.6869    0.8480    0.8480 { previous:     3.6922    0.8492    0.8492 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 32   and name HB1 ))
        2.1012    0.4012    0.4833 { previous:     2.0981    0.3981    0.4826 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 32   and name HG2 ))
        3.0358    0.6982    0.6982 { previous:     3.0111    0.6925    0.6925 }
 
 ASSIgn ((segid "    " and resid 32   and name HG1 ))
        ((segid "    " and resid 32   and name HD1 )
      OR (segid "    " and resid 32   and name HD2 ))
        2.9010    0.6672    0.6672 { previous:     2.9294    0.6738    0.6738 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 33   and name HA  ))
        2.4721    0.5686    0.5686 { previous:     2.4756    0.5694    0.5694 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 34   and name HA  ))
        2.3987    0.5517    0.5517 { previous:     2.4169    0.5559    0.5559 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 34   and name HB  ))
        1.7886    0.0886    0.4114 { previous:     1.7919    0.0919    0.4121 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 34   and name HG11)
      OR (segid "    " and resid 34   and name HG12))
        2.5199    0.5796    0.5796 { previous:     2.5110    0.5775    0.5775 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 35   and name HB1 ))
        2.8638    0.6587    0.6587 { previous:     2.9209    0.6718    0.6718 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 35   and name HB2 ))
        2.6560    0.6109    0.6109 { previous:     2.5834    0.5942    0.5942 }
 
 ASSIgn ((segid "    " and resid 36   and name HN  ))
        ((segid "    " and resid 36   and name HA  ))
        3.4021    0.7825    0.7825 { previous:     3.3620    0.7732    0.7732 }
 
 ASSIgn ((segid "    " and resid 36   and name HN  ))
        ((segid "    " and resid 36   and name HB1 )
      OR (segid "    " and resid 36   and name HB2 ))
        2.9436    0.6770    0.6770 { previous:     2.9815    0.6858    0.6858 }
 
 ASSIgn ((segid "    " and resid 36   and name HD21))
        ((segid "    " and resid 36   and name HB1 )
      OR (segid "    " and resid 36   and name HB2 ))
        2.5796    0.5933    0.5933 { previous:     2.5419    0.5846    0.5846 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 38   and name HB2 ))
        1.7926    0.0926    0.4123 { previous:     1.7934    0.0934    0.4125 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 38   and name HB1 ))
        3.2607    0.7500    0.7500 { previous:     3.2454    0.7464    0.7464 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 38   and name HD21))
        2.0147    0.3147    0.4634 { previous:     2.0115    0.3115    0.4626 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 39   and name HA  ))
        2.5566    0.5880    0.5880 { previous:     2.6520    0.6100    0.6100 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 39   and name HB2 ))
        2.2727    0.5227    0.5227 { previous:     2.2872    0.5261    0.5261 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 39   and name HB1 ))
        3.9540    0.9094    0.9094 { previous:     4.0251    0.9258    0.9258 }
 
 ASSIgn ((segid "    " and resid 40   and name HN  ))
        ((segid "    " and resid 40   and name HB  ))
        3.6380    0.8367    0.8367 { previous:     3.6618    0.8422    0.8422 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 18   and name HN  ))
        2.8899    0.6647    0.6647 { previous:     2.7878    0.6412    0.6412 }
 
 ASSIgn ((segid "    " and resid 7    and name HN  ))
        ((segid "    " and resid 8    and name HN  ))
        4.6156    1.0616    1.0616 { previous:     4.4914    1.0330    1.0330 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 15   and name HN  ))
        4.7462    1.0916    1.0916 { previous:     4.7408    1.0904    1.0904 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 29   and name HN  ))
        2.8789    0.6621    0.6621 { previous:     2.8683    0.6597    0.6597 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 26   and name HN  ))
        4.0455    0.9305    0.9305 { previous:     4.1048    0.9441    0.9441 }
 
 ASSIgn ((segid "    " and resid 2    and name HN  ))
        ((segid "    " and resid 3    and name HN  ))
        4.4969    1.0343    1.0343 { previous:     4.2147    0.9694    0.9694 }
 
 ASSIgn ((segid "    " and resid 22   and name HN  ))
        ((segid "    " and resid 25   and name HN  ))
        4.1126    0.9459    0.9459 { previous:     4.3464    0.9997    0.9997 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 30   and name HN  ))
        3.9053    0.8982    0.8982 { previous:     3.8895    0.8946    0.8946 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 32   and name HN  ))
        4.8831    1.1231    1.1231 { previous:     4.8529    1.1162    1.1162 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 36   and name HN  ))
        3.7285    0.8576    0.8576 { previous:     3.6711    0.8444    0.8444 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 37   and name HN  ))
        3.5574    0.8182    0.8182 { previous:     3.5928    0.8263    0.8263 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 39   and name HN  ))
        4.0369    0.9285    0.9285 { previous:     4.0610    0.9340    0.9340 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 40   and name HN  ))
        3.1209    0.7178    0.7178 { previous:     3.1254    0.7188    0.7188 }
 
 ASSIgn ((segid "    " and resid 10   and name HA  ))
        ((segid "    " and resid 11   and name HN  ))
        2.9167    0.6708    0.6708 { previous:     2.9325    0.6745    0.6745 }
 
 ASSIgn ((segid "    " and resid 12   and name HA1 ))
        ((segid "    " and resid 13   and name HN  ))
        3.4353    0.7901    0.7901 { previous:     3.4248    0.7877    0.7877 }
 
 ASSIgn ((segid "    " and resid 12   and name HA2 ))
        ((segid "    " and resid 13   and name HN  ))
        3.3567    0.7720    0.7720 { previous:     3.3736    0.7759    0.7759 }
 
 ASSIgn ((segid "    " and resid 15   and name HA1 ))
        ((segid "    " and resid 16   and name HN  ))
        3.1398    0.7222    0.7222 { previous:     3.1658    0.7281    0.7281 }
 
 ASSIgn ((segid "    " and resid 15   and name HA2 ))
        ((segid "    " and resid 16   and name HN  ))
        3.6866    0.8479    0.8479 { previous:     3.7103    0.8534    0.8534 }
 
 ASSIgn ((segid "    " and resid 21   and name HA  ))
        ((segid "    " and resid 22   and name HN  ))
        2.8610    0.6580    0.6580 { previous:     3.0560    0.7029    0.7029 }
 
 ASSIgn ((segid "    " and resid 23   and name HA2 ))
        ((segid "    " and resid 24   and name HN  ))
        3.0122    0.6928    0.6928 { previous:     2.9318    0.6743    0.6743 }
 
 ASSIgn ((segid "    " and resid 23   and name HA1 ))
        ((segid "    " and resid 24   and name HN  ))
        3.3643    0.7738    0.7738 { previous:     3.3959    0.7810    0.7810 }
 
 ASSIgn ((segid "    " and resid 30   and name HA  ))
        ((segid "    " and resid 31   and name HN  ))
        2.8106    0.6464    0.6464 { previous:     2.8441    0.6542    0.6542 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 33   and name HN  ))
        4.4443    1.0222    1.0222 { previous:     4.4521    1.0240    1.0240 }
 
 ASSIgn ((segid "    " and resid 33   and name HA  ))
        ((segid "    " and resid 34   and name HN  ))
        4.0377    0.9287    0.9287 { previous:     4.0626    0.9344    0.9344 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 9    and name HA  ))
        3.8603    0.8879    0.8879 { previous:     3.7842    0.8704    0.8704 }
 
 ASSIgn ((segid "    " and resid 12   and name HN  ))
        ((segid "    " and resid 10   and name HA  ))
        3.1319    0.7203    0.7203 { previous:     3.1341    0.7208    0.7208 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 13   and name HA  ))
        3.5830    0.8241    0.8241 { previous:     3.5633    0.8196    0.8196 }
 
 ASSIgn ((segid "    " and resid 17   and name HN  ))
        ((segid "    " and resid 30   and name HA  ))
        3.6708    0.8443    0.8443 { previous:     3.6577    0.8413    0.8413 }
 
 ASSIgn ((segid "    " and resid 18   and name HN  ))
        ((segid "    " and resid 7    and name HA  ))
        3.5499    0.8165    0.8165 { previous:     3.8849    0.8935    0.8935 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 28   and name HA  ))
        3.4509    0.7937    0.7937 { previous:     3.5660    0.8202    0.8202 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 31   and name HA  ))
        4.0742    0.9371    0.9371 { previous:     4.0631    0.9345    0.9345 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 31   and name HA  ))
        2.9835    0.6862    0.6862 { previous:     2.9892    0.6875    0.6875 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 36   and name HA  ))
        4.5385    1.0439    1.0439 { previous:     4.5350    1.0431    1.0431 }
 
 ASSIgn ((segid "    " and resid 40   and name HN  ))
        ((segid "    " and resid 38   and name HA  ))
        3.6328    0.8355    0.8355 { previous:     3.6249    0.8337    0.8337 }
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 7    and name HB1 ))
        4.7162    1.0847    1.0847 { previous:     4.5979    1.0575    1.0575 }
 
 ASSIgn ((segid "    " and resid 8    and name HN  ))
        ((segid "    " and resid 17   and name HB1 ))
        3.7110    0.8535    0.8535 { previous:     3.9784    0.9150    0.9150 }
 
 ASSIgn ((segid "    " and resid 11   and name HN  ))
        ((segid "    " and resid 9    and name HB  ))
        4.3564    1.0020    1.0020 { previous:     4.4212    1.0169    1.0169 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 11   and name HB2 ))
        3.2882    0.7563    0.7563 { previous:     3.2885    0.7564    0.7564 }
 
 ASSIgn ((segid "    " and resid 15   and name HN  ))
        ((segid "    " and resid 14   and name HB  ))
        5.0247    1.1557    1.1557 { previous:     4.9875    1.1471    1.1471 }
 
 ASSIgn ((segid "    " and resid 18   and name HN  ))
        ((segid "    " and resid 17   and name HB1 ))
        2.7824    0.6399    0.6399 { previous:     2.7287    0.6276    0.6276 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 28   and name HB2 ))
        3.9714    0.9134    0.9134 { previous:     3.9393    0.9060    0.9060 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 28   and name HB1 ))
        2.6050    0.5991    0.5991 { previous:     2.5920    0.5962    0.5962 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 30   and name HB1 ))
        3.8880    0.8942    0.8942 { previous:     3.8772    0.8917    0.8917 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 30   and name HB2 ))
        3.8038    0.8749    0.8749 { previous:     3.7685    0.8668    0.8668 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 31   and name HB1 ))
        3.6437    0.8381    0.8381 { previous:     3.6415    0.8376    0.8376 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 32   and name HB2 ))
        4.6385    1.0668    1.0668 { previous:     4.6585    1.0714    1.0714 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 31   and name HB1 ))
        3.0321    0.6974    0.6974 { previous:     3.0333    0.6977    0.6977 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 38   and name HB1 ))
        3.3104    0.7614    0.7614 { previous:     3.2941    0.7576    0.7576 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 37   and name HD1 )
      OR (segid "    " and resid 37   and name HD2 ))
        4.2489    0.9773    0.9773 { previous:     4.2240    0.9715    0.9715 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 7    and name HN  ))
        6.3164    1.4528    1.4528 { previous:     6.2737    1.4430    1.4430 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 18   and name HN  ))
        4.9770    1.1447    1.1447 { previous:     5.0171    1.1539    1.1539 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 17   and name HN  ))
        5.2522    1.2080    1.2080 { previous:     5.2950    1.2178    1.2178 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 7    and name HN  ))
        5.5922    1.2862    1.2862 { previous:     5.5489    1.2762    1.2762 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 8    and name HN  ))
        4.9423    1.1367    1.1367 { previous:     4.9270    1.1332    1.1332 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 32   and name HN  ))
        3.8321    0.8814    0.8814 { previous:     3.7745    0.8681    0.8681 }
 
 ASSIgn ((segid "    " and resid 4    and name HN  ))
        ((segid "    " and resid 4    and name HA  ))
        2.9481    0.6781    0.6781 { previous:     2.9432    0.6769    0.6769 }
 
 ASSIgn ((segid "    " and resid 5    and name HN  ))
        ((segid "    " and resid 5    and name HA  ))
        4.0346    0.9280    0.9280 { previous:     4.0264    0.9261    0.9261 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 6    and name HB2 ))
        3.9796    0.9153    0.9153 { previous:     3.9830    0.9161    0.9161 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 6    and name HB1 ))
        3.2838    0.7553    0.7553 { previous:     3.2802    0.7544    0.7544 }
 
 ASSIgn ((segid "    " and resid 6    and name HN  ))
        ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        5.0825    1.1690    1.1690 { previous:     5.0346    1.1580    1.1580 }
 
 ASSIgn ((segid "    " and resid 10   and name HD21))
        ((segid "    " and resid 10   and name HB1 ))
        2.5723    0.5916    0.5916 { previous:     2.6328    0.6055    0.6055 }
 
 ASSIgn ((segid "    " and resid 10   and name HD21))
        ((segid "    " and resid 10   and name HB2 ))
        3.8868    0.8940    0.8940 { previous:     3.9601    0.9108    0.9108 }
 
 ASSIgn ((segid "    " and resid 25   and name HN  ))
        ((segid "    " and resid 25   and name HA  ))
        3.1696    0.7290    0.7290 { previous:     3.1153    0.7165    0.7165 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 13   and name HA  ))
        2.5810    0.5936    0.5936 { previous:     2.6106    0.6004    0.6004 }
 
 ASSIgn ((segid "    " and resid 13   and name HN  ))
        ((segid "    " and resid 13   and name HD1 )
      OR (segid "    " and resid 13   and name HD2 ))
        3.4662    0.7972    0.7972 { previous:     3.3887    0.7794    0.7794 }
 
 ASSIgn ((segid "    " and resid 16   and name HN  ))
        ((segid "    " and resid 16   and name HD1 )
      OR (segid "    " and resid 16   and name HD2 ))
        5.8172    1.3380    1.3380 { previous:     5.8177    1.3381    1.3381 }
 
 ASSIgn ((segid "    " and resid 18   and name HN  ))
        ((segid "    " and resid 18   and name HA  ))
        3.0960    0.7121    0.7121 { previous:     3.0117    0.6927    0.6927 }
 
 ASSIgn ((segid "    " and resid 18   and name HN  ))
        ((segid "    " and resid 18   and name HB2 ))
        2.5530    0.5872    0.5872 { previous:     2.5371    0.5835    0.5835 }
 
 ASSIgn ((segid "    " and resid 18   and name HN  ))
        ((segid "    " and resid 18   and name HB1 ))
        3.8343    0.8819    0.8819 { previous:     3.7930    0.8724    0.8724 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 19   and name HB2 ))
        3.7821    0.8699    0.8699 { previous:     3.7960    0.8731    0.8731 }
 
 ASSIgn ((segid "    " and resid 22   and name HN  ))
        ((segid "    " and resid 22   and name HA  ))
        3.6544    0.8405    0.8405 { previous:     3.5083    0.8069    0.8069 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 24   and name HA  ))
        2.4995    0.5749    0.5749 { previous:     2.4752    0.5693    0.5693 }
 
 ASSIgn ((segid "    " and resid 24   and name HN  ))
        ((segid "    " and resid 24   and name HG1 )
      OR (segid "    " and resid 24   and name HG2 ))
        2.3279    0.5354    0.5354 { previous:     2.1329    0.4329    0.4906 }
 
 ASSIgn ((segid "    " and resid 25   and name HD1 )
      OR (segid "    " and resid 25   and name HD2 ))
        ((segid "    " and resid 25   and name HB1 )
      OR (segid "    " and resid 25   and name HB2 ))
        2.4346    0.5599    0.5599 { previous:     2.4772    0.5698    0.5698 }
 
 ASSIgn ((segid "    " and resid 26   and name HN  ))
        ((segid "    " and resid 26   and name HB1 ))
        3.7639    0.8657    0.8657 { previous:     3.8856    0.8937    0.8937 }
 
 ASSIgn ((segid "    " and resid 28   and name HN  ))
        ((segid "    " and resid 28   and name HA  ))
        3.2053    0.7372    0.7372 { previous:     3.2005    0.7361    0.7361 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 29   and name HB2 ))
        2.7970    0.6433    0.6433 { previous:     2.7796    0.6393    0.6393 }
 
 ASSIgn ((segid "    " and resid 29   and name HN  ))
        ((segid "    " and resid 29   and name HE1 )
      OR (segid "    " and resid 29   and name HE2 ))
        4.8406    1.1133    1.1133 { previous:     4.8225    1.1092    1.1092 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 31   and name HB1 ))
        4.3072    0.9907    0.9907 { previous:     4.2949    0.9878    0.9878 }
 
 ASSIgn ((segid "    " and resid 32   and name HN  ))
        ((segid "    " and resid 32   and name HD1 )
      OR (segid "    " and resid 32   and name HD2 ))
        6.2660    1.4412    1.4412 { previous:     6.1591    1.4166    1.4166 }
 
 ASSIgn ((segid "    " and resid 37   and name HN  ))
        ((segid "    " and resid 37   and name HD1 )
      OR (segid "    " and resid 37   and name HD2 ))
        5.0122    1.1528    1.1528 { previous:     5.0278    1.1564    1.1564 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 38   and name HA  ))
        2.3821    0.5479    0.5479 { previous:     2.3821    0.5479    0.5479 }
 
 ASSIgn ((segid "    " and resid 38   and name HD21))
        ((segid "    " and resid 38   and name HB2 ))
        2.1872    0.4872    0.5030 { previous:     2.1905    0.4905    0.5038 }
 
 ASSIgn ((segid "    " and resid 5    and name HA  ))
        ((segid "    " and resid 19   and name HA  ))
        2.7012    0.6213    0.6213 { previous:     2.7453    0.6314    0.6314 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 17   and name HA  ))
        2.9243    0.6726    0.6726 { previous:     3.0950    0.7118    0.7118 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 28   and name HA  ))
        1.9922    0.2922    0.4582 { previous:     2.0124    0.3124    0.4629 }
 
 ASSIgn ((segid "    " and resid 9    and name HA  ))
        ((segid "    " and resid 13   and name HB1 ))
        4.2977    0.9885    0.9885 { previous:     4.2865    0.9859    0.9859 }
 
 ASSIgn ((segid "    " and resid 11   and name HA  ))
        ((segid "    " and resid 12   and name HA1 ))
        3.1095    0.7152    0.7152 { previous:     3.1287    0.7196    0.7196 }
 
 ASSIgn ((segid "    " and resid 26   and name HA  ))
        ((segid "    " and resid 20   and name HB1 ))
        3.0100    0.6923    0.6923 { previous:     3.0094    0.6922    0.6922 }
 
 ASSIgn ((segid "    " and resid 3    and name HA1 )
      OR (segid "    " and resid 3    and name HA2 ))
        ((segid "    " and resid 21   and name HB2 ))
        5.0188    1.1543    1.1543 { previous:     4.9099    1.1293    1.1293 }
 
 ASSIgn ((segid "    " and resid 30   and name HA  ))
        ((segid "    " and resid 16   and name HB1 ))
        1.7939    0.0939    0.4126 { previous:     1.8705    0.1705    0.4302 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 17   and name HB2 ))
        2.4033    0.5528    0.5528 { previous:     2.4323    0.5594    0.5594 }
 
 ASSIgn ((segid "    " and resid 33   and name HA  ))
        ((segid "    " and resid 36   and name HB1 )
      OR (segid "    " and resid 36   and name HB2 ))
        3.0309    0.6971    0.6971 { previous:     3.0602    0.7038    0.7038 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 37   and name HB1 )
      OR (segid "    " and resid 37   and name HB2 ))
        2.3735    0.5459    0.5459 { previous:     2.4099    0.5543    0.5543 }
 
 ASSIgn ((segid "    " and resid 9    and name HA  ))
        ((segid "    " and resid 13   and name HG1 )
      OR (segid "    " and resid 13   and name HG2 ))
        2.7544    0.6335    0.6335 { previous:     2.8319    0.6513    0.6513 }
 
 ASSIgn ((segid "    " and resid 20   and name HA  ))
        ((segid "    " and resid 21   and name HD1 ))
        2.0893    0.3893    0.4805 { previous:     2.0067    0.3067    0.4615 }
 
 ASSIgn ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        ((segid "    " and resid 5    and name HA  ))
        4.2618    0.9802    0.9802 { previous:     4.2837    0.9852    0.9852 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 7    and name HA  ))
        3.2286    0.7426    0.7426 { previous:     3.1841    0.7324    0.7324 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 32   and name HA  ))
        2.8538    0.6564    0.6564 { previous:     2.8755    0.6614    0.6614 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 18   and name HA  ))
        4.5776    1.0528    1.0528 { previous:     4.5748    1.0522    1.0522 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 28   and name HA  ))
        2.9956    0.6890    0.6890 { previous:     3.0188    0.6943    0.6943 }
 
 ASSIgn ((segid "    " and resid 2    and name HA  ))
        ((segid "    " and resid 2    and name HB1 ))
        2.8892    0.6645    0.6645 { previous:     2.9429    0.6769    0.6769 }
 
 ASSIgn ((segid "    " and resid 2    and name HA  ))
        ((segid "    " and resid 2    and name HB2 ))
        4.0486    0.9312    0.9312 { previous:     4.1678    0.9586    0.9586 }
 
 ASSIgn ((segid "    " and resid 4    and name HA  ))
        ((segid "    " and resid 4    and name HB1 ))
        2.2251    0.5118    0.5118 { previous:     2.2485    0.5172    0.5172 }
 
 ASSIgn ((segid "    " and resid 5    and name HA  ))
        ((segid "    " and resid 5    and name HB2 ))
        2.7800    0.6394    0.6394 { previous:     2.8276    0.6503    0.6503 }
 
 ASSIgn ((segid "    " and resid 6    and name HA  ))
        ((segid "    " and resid 6    and name HB2 ))
        2.3434    0.5390    0.5390 { previous:     2.3547    0.5416    0.5416 }
 
 ASSIgn ((segid "    " and resid 6    and name HA  ))
        ((segid "    " and resid 6    and name HB1 ))
        2.3703    0.5452    0.5452 { previous:     2.3826    0.5480    0.5480 }
 
 ASSIgn ((segid "    " and resid 6    and name HA  ))
        ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        4.1536    0.9553    0.9553 { previous:     4.1779    0.9609    0.9609 }
 
 ASSIgn ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        ((segid "    " and resid 6    and name HB2 ))
        2.5310    0.5821    0.5821 { previous:     2.5358    0.5832    0.5832 }
 
 ASSIgn ((segid "    " and resid 6    and name HD1 )
      OR (segid "    " and resid 6    and name HD2 ))
        ((segid "    " and resid 6    and name HB1 ))
        2.4678    0.5676    0.5676 { previous:     2.4901    0.5727    0.5727 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 6    and name HB2 ))
        4.5132    1.0380    1.0380 { previous:     4.6207    1.0628    1.0628 }
 
 ASSIgn ((segid "    " and resid 6    and name HE1 )
      OR (segid "    " and resid 6    and name HE2 ))
        ((segid "    " and resid 6    and name HB1 ))
        5.1440    1.1831    1.1831 { previous:     5.2194    1.2005    1.2005 }
 
 ASSIgn ((segid "    " and resid 25   and name HD1 )
      OR (segid "    " and resid 25   and name HD2 ))
        ((segid "    " and resid 25   and name HE1 )
      OR (segid "    " and resid 25   and name HE2 ))
        3.1044    0.7140    0.7140 { previous:     3.1574    0.7262    0.7262 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 7    and name HB1 ))
        2.5348    0.5830    0.5830 { previous:     2.4217    0.5570    0.5570 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 7    and name HB2 ))
        2.3663    0.5443    0.5443 { previous:     2.2679    0.5216    0.5216 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 7    and name HG2 ))
        4.1842    0.9624    0.9624 { previous:     4.0465    0.9307    0.9307 }
 
 ASSIgn ((segid "    " and resid 7    and name HA  ))
        ((segid "    " and resid 7    and name HG1 ))
        3.5899    0.8257    0.8257 { previous:     3.4761    0.7995    0.7995 }
 
 ASSIgn ((segid "    " and resid 7    and name HB2 ))
        ((segid "    " and resid 7    and name HB1 ))
        1.7000    0.0000    0.3910 { previous:     1.7000    0.0000    0.3910 }
 
 ASSIgn ((segid "    " and resid 7    and name HB1 ))
        ((segid "    " and resid 7    and name HG2 ))
        2.6378    0.6067    0.6067 { previous:     2.6383    0.6068    0.6068 }
 
 ASSIgn ((segid "    " and resid 7    and name HB1 ))
        ((segid "    " and resid 7    and name HG1 ))
        2.9604    0.6809    0.6809 { previous:     2.9694    0.6830    0.6830 }
 
 ASSIgn ((segid "    " and resid 7    and name HB2 ))
        ((segid "    " and resid 7    and name HG2 ))
        2.9011    0.6672    0.6672 { previous:     2.9201    0.6716    0.6716 }
 
 ASSIgn ((segid "    " and resid 7    and name HG2 ))
        ((segid "    " and resid 7    and name HG1 ))
        1.8467    0.1467    0.4247 { previous:     1.8566    0.1566    0.4270 }
 
 ASSIgn ((segid "    " and resid 10   and name HA  ))
        ((segid "    " and resid 10   and name HB2 ))
        2.2439    0.5161    0.5161 { previous:     2.2666    0.5213    0.5213 }
 
 ASSIgn ((segid "    " and resid 11   and name HA  ))
        ((segid "    " and resid 11   and name HB2 ))
        3.1739    0.7300    0.7300 { previous:     3.1987    0.7357    0.7357 }
 
 ASSIgn ((segid "    " and resid 11   and name HA  ))
        ((segid "    " and resid 11   and name HB1 ))
        2.7179    0.6251    0.6251 { previous:     2.7343    0.6289    0.6289 }
 
 ASSIgn ((segid "    " and resid 13   and name HA  ))
        ((segid "    " and resid 13   and name HB2 ))
        2.3505    0.5406    0.5406 { previous:     2.4048    0.5531    0.5531 }
 
 ASSIgn ((segid "    " and resid 13   and name HA  ))
        ((segid "    " and resid 13   and name HB1 ))
        2.1749    0.4749    0.5002 { previous:     2.2463    0.5166    0.5166 }
 
 ASSIgn ((segid "    " and resid 13   and name HA  ))
        ((segid "    " and resid 13   and name HG1 ))
        3.4583    0.7954    0.7954 { previous:     3.4810    0.8006    0.8006 }
 
 ASSIgn ((segid "    " and resid 14   and name HA  ))
        ((segid "    " and resid 14   and name HB  ))
        2.7995    0.6439    0.6439 { previous:     2.8093    0.6461    0.6461 }
 
 ASSIgn ((segid "    " and resid 16   and name HA  ))
        ((segid "    " and resid 16   and name HB1 ))
        2.1096    0.4096    0.4852 { previous:     2.1429    0.4429    0.4929 }
 
 ASSIgn ((segid "    " and resid 16   and name HA  ))
        ((segid "    " and resid 16   and name HB2 ))
        2.6645    0.6128    0.6128 { previous:     2.7541    0.6334    0.6334 }
 
 ASSIgn ((segid "    " and resid 17   and name HA  ))
        ((segid "    " and resid 17   and name HB2 ))
        3.3236    0.7644    0.7644 { previous:     3.4066    0.7835    0.7835 }
 
 ASSIgn ((segid "    " and resid 17   and name HA  ))
        ((segid "    " and resid 17   and name HB1 ))
        2.0745    0.3745    0.4771 { previous:     2.1098    0.4098    0.4853 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 17   and name HA  ))
        2.9725    0.6837    0.6837 { previous:     3.1131    0.7160    0.7160 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 17   and name HB2 ))
        2.9327    0.6745    0.6745 { previous:     2.9596    0.6807    0.6807 }
 
 ASSIgn ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        ((segid "    " and resid 17   and name HB1 ))
        2.4626    0.5664    0.5664 { previous:     2.4656    0.5671    0.5671 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 17   and name HB1 ))
        4.7442    1.0912    1.0912 { previous:     4.7588    1.0945    1.0945 }
 
 ASSIgn ((segid "    " and resid 17   and name HE1 )
      OR (segid "    " and resid 17   and name HE2 ))
        ((segid "    " and resid 17   and name HD1 )
      OR (segid "    " and resid 17   and name HD2 ))
        2.6774    0.6158    0.6158 { previous:     2.6977    0.6205    0.6205 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 18   and name HB2 ))
        3.2922    0.7572    0.7572 { previous:     3.3397    0.7681    0.7681 }
 
 ASSIgn ((segid "    " and resid 18   and name HA  ))
        ((segid "    " and resid 18   and name HB1 ))
        2.6488    0.6092    0.6092 { previous:     2.6559    0.6108    0.6108 }
 
 ASSIgn ((segid "    " and resid 19   and name HA  ))
        ((segid "    " and resid 19   and name HB1 ))
        2.3309    0.5361    0.5361 { previous:     2.3543    0.5415    0.5415 }
 
 ASSIgn ((segid "    " and resid 19   and name HA  ))
        ((segid "    " and resid 19   and name HB2 ))
        2.8432    0.6539    0.6539 { previous:     2.8854    0.6636    0.6636 }
 
 ASSIgn ((segid "    " and resid 20   and name HA  ))
        ((segid "    " and resid 20   and name HB2 ))
        2.8339    0.6518    0.6518 { previous:     2.6294    0.6048    0.6048 }
 
 ASSIgn ((segid "    " and resid 20   and name HA  ))
        ((segid "    " and resid 20   and name HB1 ))
        2.5334    0.5827    0.5827 { previous:     2.5391    0.5840    0.5840 }
 
 ASSIgn ((segid "    " and resid 21   and name HA  ))
        ((segid "    " and resid 21   and name HB1 ))
        2.3314    0.5362    0.5362 { previous:     2.3455    0.5395    0.5395 }
 
 ASSIgn ((segid "    " and resid 21   and name HA  ))
        ((segid "    " and resid 21   and name HB2 ))
        2.9304    0.6740    0.6740 { previous:     2.9593    0.6806    0.6806 }
 
 ASSIgn ((segid "    " and resid 21   and name HB1 ))
        ((segid "    " and resid 21   and name HG2 ))
        3.0347    0.6980    0.6980 { previous:     3.1484    0.7241    0.7241 }
 
 ASSIgn ((segid "    " and resid 21   and name HB1 ))
        ((segid "    " and resid 21   and name HG1 ))
        2.3083    0.5309    0.5309 { previous:     2.3537    0.5414    0.5414 }
 
 ASSIgn ((segid "    " and resid 21   and name HB2 ))
        ((segid "    " and resid 21   and name HG2 ))
        2.7189    0.6253    0.6253 { previous:     2.8228    0.6492    0.6492 }
 
 ASSIgn ((segid "    " and resid 21   and name HG2 ))
        ((segid "    " and resid 21   and name HD2 ))
        2.1191    0.4191    0.4874 { previous:     2.1744    0.4744    0.5001 }
 
 ASSIgn ((segid "    " and resid 21   and name HG1 ))
        ((segid "    " and resid 21   and name HD2 ))
        3.2800    0.7544    0.7544 { previous:     3.3780    0.7769    0.7769 }
 
 ASSIgn ((segid "    " and resid 21   and name HG1 ))
        ((segid "    " and resid 21   and name HD1 ))
        2.3216    0.5340    0.5340 { previous:     2.3340    0.5368    0.5368 }
 
 ASSIgn ((segid "    " and resid 22   and name HA  ))
        ((segid "    " and resid 22   and name HB  ))
        2.7090    0.6231    0.6231 { previous:     2.7167    0.6248    0.6248 }
 
 ASSIgn ((segid "    " and resid 22   and name HA  ))
        ((segid "    " and resid 22   and name HG11)
      OR (segid "    " and resid 22   and name HG12))
        3.2458    0.7465    0.7465 { previous:     3.3146    0.7623    0.7623 }
 
 ASSIgn ((segid "    " and resid 24   and name HA  ))
        ((segid "    " and resid 24   and name HB2 ))
        2.2905    0.5268    0.5268 { previous:     2.2468    0.5168    0.5168 }
 
 ASSIgn ((segid "    " and resid 24   and name HA  ))
        ((segid "    " and resid 24   and name HB1 ))
        2.3200    0.5336    0.5336 { previous:     2.1886    0.4886    0.5034 }
 
 ASSIgn ((segid "    " and resid 25   and name HA  ))
        ((segid "    " and resid 25   and name HB1 )
      OR (segid "    " and resid 25   and name HB2 ))
        2.5836    0.5942    0.5942 { previous:     2.5602    0.5888    0.5888 }
 
 ASSIgn ((segid "    " and resid 25   and name HA  ))
        ((segid "    " and resid 25   and name HD1 )
      OR (segid "    " and resid 25   and name HD2 ))
        3.1508    0.7247    0.7247 { previous:     3.2292    0.7427    0.7427 }
 
 ASSIgn ((segid "    " and resid 25   and name HA  ))
        ((segid "    " and resid 25   and name HE1 )
      OR (segid "    " and resid 25   and name HE2 ))
        4.8565    1.1170    1.1170 { previous:     4.7169    1.0849    1.0849 }
 
 ASSIgn ((segid "    " and resid 26   and name HA  ))
        ((segid "    " and resid 26   and name HB1 ))
        3.4566    0.7950    0.7950 { previous:     3.4514    0.7938    0.7938 }
 
 ASSIgn ((segid "    " and resid 26   and name HA  ))
        ((segid "    " and resid 26   and name HB2 ))
        2.7363    0.6294    0.6294 { previous:     2.7913    0.6420    0.6420 }
 
 ASSIgn ((segid "    " and resid 27   and name HA  ))
        ((segid "    " and resid 27   and name HB  ))
        3.0498    0.7014    0.7014 { previous:     3.0588    0.7035    0.7035 }
 
 ASSIgn ((segid "    " and resid 28   and name HA  ))
        ((segid "    " and resid 28   and name HB2 ))
        2.9664    0.6823    0.6823 { previous:     2.9672    0.6824    0.6824 }
 
 ASSIgn ((segid "    " and resid 28   and name HA  ))
        ((segid "    " and resid 28   and name HB1 ))
        2.6204    0.6027    0.6027 { previous:     2.6275    0.6043    0.6043 }
 
 ASSIgn ((segid "    " and resid 29   and name HA  ))
        ((segid "    " and resid 29   and name HB1 ))
        2.2054    0.5054    0.5072 { previous:     2.2265    0.5121    0.5121 }
 
 ASSIgn ((segid "    " and resid 29   and name HA  ))
        ((segid "    " and resid 29   and name HB2 ))
        2.6899    0.6187    0.6187 { previous:     2.6995    0.6209    0.6209 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 29   and name HA  ))
        3.3487    0.7702    0.7702 { previous:     3.3430    0.7689    0.7689 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 29   and name HB1 ))
        2.5153    0.5785    0.5785 { previous:     2.5272    0.5813    0.5813 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 29   and name HB2 ))
        2.4531    0.5642    0.5642 { previous:     2.4680    0.5676    0.5676 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 29   and name HE1 )
      OR (segid "    " and resid 29   and name HE2 ))
        2.6263    0.6040    0.6040 { previous:     2.6104    0.6004    0.6004 }
 
 ASSIgn ((segid "    " and resid 30   and name HA  ))
        ((segid "    " and resid 30   and name HB1 ))
        2.4590    0.5656    0.5656 { previous:     2.4897    0.5726    0.5726 }
 
 ASSIgn ((segid "    " and resid 30   and name HA  ))
        ((segid "    " and resid 30   and name HB2 ))
        2.0436    0.3436    0.4700 { previous:     2.0941    0.3941    0.4817 }
 
 ASSIgn ((segid "    " and resid 31   and name HA  ))
        ((segid "    " and resid 31   and name HB1 ))
        2.2293    0.5127    0.5127 { previous:     2.2415    0.5155    0.5155 }
 
 ASSIgn ((segid "    " and resid 31   and name HA  ))
        ((segid "    " and resid 31   and name HB2 ))
        2.6064    0.5995    0.5995 { previous:     2.6221    0.6031    0.6031 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 32   and name HB2 ))
        2.6759    0.6155    0.6155 { previous:     2.6935    0.6195    0.6195 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 32   and name HB1 ))
        2.8756    0.6614    0.6614 { previous:     2.8916    0.6651    0.6651 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 32   and name HG2 ))
        3.8385    0.8829    0.8829 { previous:     3.7973    0.8734    0.8734 }
 
 ASSIgn ((segid "    " and resid 32   and name HA  ))
        ((segid "    " and resid 32   and name HG1 ))
        3.5483    0.8161    0.8161 { previous:     3.6130    0.8310    0.8310 }
 
 ASSIgn ((segid "    " and resid 32   and name HD1 )
      OR (segid "    " and resid 32   and name HD2 ))
        ((segid "    " and resid 32   and name HE1 )
      OR (segid "    " and resid 32   and name HE2 ))
        3.4979    0.8045    0.8045 { previous:     3.5479    0.8160    0.8160 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 34   and name HB  ))
        2.5389    0.5840    0.5840 { previous:     2.5623    0.5893    0.5893 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 34   and name HG11)
      OR (segid "    " and resid 34   and name HG12))
        2.4379    0.5607    0.5607 { previous:     2.4731    0.5688    0.5688 }
 
 ASSIgn ((segid "    " and resid 35   and name HB1 ))
        ((segid "    " and resid 35   and name HB2 ))
        2.0410    0.3410    0.4694 { previous:     2.0484    0.3484    0.4711 }
 
 ASSIgn ((segid "    " and resid 36   and name HA  ))
        ((segid "    " and resid 36   and name HB1 )
      OR (segid "    " and resid 36   and name HB2 ))
        2.8337    0.6518    0.6518 { previous:     2.8846    0.6635    0.6635 }
 
 ASSIgn ((segid "    " and resid 37   and name HA  ))
        ((segid "    " and resid 37   and name HB1 )
      OR (segid "    " and resid 37   and name HB2 ))
        2.6879    0.6182    0.6182 { previous:     2.7058    0.6223    0.6223 }
 
 ASSIgn ((segid "    " and resid 37   and name HA  ))
        ((segid "    " and resid 37   and name HD1 )
      OR (segid "    " and resid 37   and name HD2 ))
        3.4162    0.7857    0.7857 { previous:     3.4259    0.7880    0.7880 }
 
 ASSIgn ((segid "    " and resid 37   and name HA  ))
        ((segid "    " and resid 37   and name HE1 )
      OR (segid "    " and resid 37   and name HE2 ))
        6.2125    1.4289    1.4289 { previous:     6.2740    1.4430    1.4430 }
 
 ASSIgn ((segid "    " and resid 38   and name HA  ))
        ((segid "    " and resid 38   and name HB2 ))
        2.5398    0.5841    0.5841 { previous:     2.5250    0.5807    0.5807 }
 
 ASSIgn ((segid "    " and resid 38   and name HA  ))
        ((segid "    " and resid 38   and name HB1 ))
        2.2478    0.5170    0.5170 { previous:     2.2364    0.5144    0.5144 }
 
 ASSIgn ((segid "    " and resid 39   and name HA  ))
        ((segid "    " and resid 39   and name HB1 ))
        2.5367    0.5834    0.5834 { previous:     2.5279    0.5814    0.5814 }
 

 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 33   and name HB1 )
      OR (segid "    " and resid 33   and name HB2 )
      OR (segid "    " and resid 33   and name HB3 ))
        6.6198    1.5225    1.5225 { previous:     6.6405    1.5273   
        1.5273 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 33   and name HB1 )
      OR (segid "    " and resid 33   and name HB2 )
      OR (segid "    " and resid 33   and name HB3 ))
        2.7138    0.6242    0.6242 { previous:     2.7126    0.6239   
        0.6239 }
 
 ASSIgn ((segid "    " and resid 10   and name HN  ))
        ((segid "    " and resid 9    and name HG21)
      OR (segid "    " and resid 9    and name HG22)
      OR (segid "    " and resid 9    and name HG23))
        5.0241    1.1556    1.1556 { previous:     5.0377    1.1587   
        1.1587 }
 
 ASSIgn ((segid "    " and resid 15   and name HN  ))
        ((segid "    " and resid 14   and name HG21)
      OR (segid "    " and resid 14   and name HG22)
      OR (segid "    " and resid 14   and name HG23))
        5.8227    1.3392    1.3392 { previous:     5.7815    1.3297   
        1.3297 }
 
 ASSIgn ((segid "    " and resid 15   and name HN  ))
        ((segid "    " and resid 14   and name HG11)
      OR (segid "    " and resid 14   and name HG12)
      OR (segid "    " and resid 14   and name HG13))
        3.9859    0.9168    0.9168 { previous:     3.9330    0.9046   
        0.9046 }
 
 ASSIgn ((segid "    " and resid 23   and name HN  ))
        ((segid "    " and resid 22   and name HG21)
      OR (segid "    " and resid 22   and name HG22)
      OR (segid "    " and resid 22   and name HG23))
        3.0755    0.7074    0.7074 { previous:     3.0533    0.7023   
        0.7023 }
 
 ASSIgn ((segid "    " and resid 28   and name HN  ))
        ((segid "    " and resid 27   and name HG11)
      OR (segid "    " and resid 27   and name HG12)
      OR (segid "    " and resid 27   and name HG13))
        3.5309    0.8121    0.8121 { previous:     3.5259    0.8110   
        0.8110 }
 
 ASSIgn ((segid "    " and resid 39   and name HN  ))
        ((segid "    " and resid 27   and name HG11)
      OR (segid "    " and resid 27   and name HG12)
      OR (segid "    " and resid 27   and name HG13))
        5.4788    1.2601    1.2601 { previous:     5.4180    1.2461   
        1.2461 }
 
 ASSIgn ((segid "    " and resid 30   and name HN  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        4.2474    0.9769    0.9769 { previous:     4.2577    0.9793   
        0.9793 }
 
 ASSIgn ((segid "    " and resid 31   and name HN  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        3.3261    0.7650    0.7650 { previous:     3.3403    0.7683   
        0.7683 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        5.1771    1.1907    1.1907 { previous:     5.1787    1.1911   
        1.1911 }
 
 ASSIgn ((segid "    " and resid 38   and name HN  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        4.9260    1.1330    1.1330 { previous:     4.9384    1.1358   
        1.1358 }
 
 ASSIgn ((segid "    " and resid 29   and name HE1 )
      OR (segid "    " and resid 29   and name HE2 ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        5.5476    1.2759    1.2759 { previous:     5.5528    1.2772   
        1.2772 }
 
 ASSIgn ((segid "    " and resid 4    and name HN  ))
        ((segid "    " and resid 4    and name HD11)
      OR (segid "    " and resid 4    and name HD12)
      OR (segid "    " and resid 4    and name HD13))
        4.3880    1.0092    1.0092 { previous:     4.3600    1.0028   
        1.0028 }
 
 ASSIgn ((segid "    " and resid 9    and name HN  ))
        ((segid "    " and resid 9    and name HG21)
      OR (segid "    " and resid 9    and name HG22)
      OR (segid "    " and resid 9    and name HG23))
        4.8824    1.1230    1.1230 { previous:     4.8985    1.1266   
        1.1266 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 14   and name HG21)
      OR (segid "    " and resid 14   and name HG22)
      OR (segid "    " and resid 14   and name HG23))
        3.0782    0.7080    0.7080 { previous:     2.9991    0.6898   
        0.6898 }
 
 ASSIgn ((segid "    " and resid 14   and name HN  ))
        ((segid "    " and resid 14   and name HG11)
      OR (segid "    " and resid 14   and name HG12)
      OR (segid "    " and resid 14   and name HG13))
        4.7069    1.0826    1.0826 { previous:     4.7074    1.0827   
        1.0827 }
 
 ASSIgn ((segid "    " and resid 22   and name HN  ))
        ((segid "    " and resid 22   and name HG21)
      OR (segid "    " and resid 22   and name HG22)
      OR (segid "    " and resid 22   and name HG23))
        3.2527    0.7481    0.7481 { previous:     2.8991    0.6668   
        0.6668 }
 
 ASSIgn ((segid "    " and resid 33   and name HN  ))
        ((segid "    " and resid 33   and name HB1 )
      OR (segid "    " and resid 33   and name HB2 )
      OR (segid "    " and resid 33   and name HB3 ))
        2.6207    0.6028    0.6028 { previous:     2.6223    0.6031   
        0.6031 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        4.3418    0.9986    0.9986 { previous:     4.3379    0.9977   
        0.9977 }
 
 ASSIgn ((segid "    " and resid 40   and name HN  ))
        ((segid "    " and resid 40   and name HG21)
      OR (segid "    " and resid 40   and name HG22)
      OR (segid "    " and resid 40   and name HG23))
        3.8964    0.8962    0.8962 { previous:     3.9389    0.9059   
        0.9059 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 27   and name HG11)
      OR (segid "    " and resid 27   and name HG12)
      OR (segid "    " and resid 27   and name HG13))
        5.0920    1.1712    1.1712 { previous:     5.1534    1.1853   
        1.1853 }
 
 ASSIgn ((segid "    " and resid 19   and name HN  ))
        ((segid "    " and resid 27   and name HG21)
      OR (segid "    " and resid 27   and name HG22)
      OR (segid "    " and resid 27   and name HG23))
        5.5229    1.2703    1.2703 { previous:     5.5442    1.2752   
        1.2752 }
 
 ASSIgn ((segid "    " and resid 35   and name HN  ))
        ((segid "    " and resid 34   and name HG21)
      OR (segid "    " and resid 34   and name HG22)
      OR (segid "    " and resid 34   and name HG23))
        4.3636    1.0036    1.0036 { previous:     4.3694    1.0050   
        1.0050 }
 
 ASSIgn ((segid "    " and resid 34   and name HN  ))
        ((segid "    " and resid 34   and name HG21)
      OR (segid "    " and resid 34   and name HG22)
      OR (segid "    " and resid 34   and name HG23))
        4.0241    0.9255    0.9255 { previous:     4.0199    0.9246   
        0.9246 }
 
 ASSIgn ((segid "    " and resid 21   and name HA  ))
        ((segid "    " and resid 4    and name HD11)
      OR (segid "    " and resid 4    and name HD12)
      OR (segid "    " and resid 4    and name HD13))
        4.2918    0.9871    0.9871 { previous:     4.3443    0.9992   
        0.9992 }
 
 ASSIgn ((segid "    " and resid 21   and name HB1 ))
        ((segid "    " and resid 4    and name HD11)
      OR (segid "    " and resid 4    and name HD12)
      OR (segid "    " and resid 4    and name HD13))
        4.2541    0.9784    0.9784 { previous:     4.3460    0.9996   
        0.9996 }
 
 ASSIgn ((segid "    " and resid 39   and name HB2 ))
        ((segid "    " and resid 40   and name HG21)
      OR (segid "    " and resid 40   and name HG22)
      OR (segid "    " and resid 40   and name HG23))
        3.8931    0.8954    0.8954 { previous:     3.9691    0.9129   
        0.9129 }
 
 ASSIgn ((segid "    " and resid 25   and name HD1 )
      OR (segid "    " and resid 25   and name HD2 ))
        ((segid "    " and resid 22   and name HG21)
      OR (segid "    " and resid 22   and name HG22)
      OR (segid "    " and resid 22   and name HG23))
        5.2215    1.2009    1.2009 { previous:     4.9876    1.1472   
        1.1472 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 27   and name HG21)
      OR (segid "    " and resid 27   and name HG22)
      OR (segid "    " and resid 27   and name HG23))
        6.8735    1.5809    1.5809 { previous:     6.8085    1.5660   
        1.5660 }
 
 ASSIgn ((segid "    " and resid 29   and name HD1 )
      OR (segid "    " and resid 29   and name HD2 ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        4.5623    1.0493    1.0493 { previous:     4.6192    1.0624   
        1.0624 }
 
 ASSIgn ((segid "    " and resid 29   and name HE1 )
      OR (segid "    " and resid 29   and name HE2 ))
        ((segid "    " and resid 27   and name HG21)
      OR (segid "    " and resid 27   and name HG22)
      OR (segid "    " and resid 27   and name HG23))
        6.6892    1.5385    1.5385 { previous:     6.6228    1.5232   
        1.5232 }
 
 ASSIgn ((segid "    " and resid 4    and name HA  ))
        ((segid "    " and resid 4    and name HD21)
      OR (segid "    " and resid 4    and name HD22)
      OR (segid "    " and resid 4    and name HD23))
        3.2375    0.7446    0.7446 { previous:     3.2207    0.7408   
        0.7408 }
 
 ASSIgn ((segid "    " and resid 9    and name HA  ))
        ((segid "    " and resid 9    and name HG21)
      OR (segid "    " and resid 9    and name HG22)
      OR (segid "    " and resid 9    and name HG23))
        3.2575    0.7492    0.7492 { previous:     3.3038    0.7599   
        0.7599 }
 
 ASSIgn ((segid "    " and resid 14   and name HA  ))
        ((segid "    " and resid 14   and name HG21)
      OR (segid "    " and resid 14   and name HG22)
      OR (segid "    " and resid 14   and name HG23))
        2.9839    0.6863    0.6863 { previous:     2.9599    0.6808   
        0.6808 }
 
 ASSIgn ((segid "    " and resid 14   and name HA  ))
        ((segid "    " and resid 14   and name HG11)
      OR (segid "    " and resid 14   and name HG12)
      OR (segid "    " and resid 14   and name HG13))
        3.2663    0.7513    0.7513 { previous:     3.2823    0.7549   
        0.7549 }
 
 ASSIgn ((segid "    " and resid 22   and name HA  ))
        ((segid "    " and resid 22   and name HG21)
      OR (segid "    " and resid 22   and name HG22)
      OR (segid "    " and resid 22   and name HG23))
        3.3679    0.7746    0.7746 { previous:     3.4232    0.7873   
        0.7873 }
 
 ASSIgn ((segid "    " and resid 22   and name HA  ))
        ((segid "    " and resid 22   and name HD11)
      OR (segid "    " and resid 22   and name HD12)
      OR (segid "    " and resid 22   and name HD13))
        5.3727    1.2357    1.2357 { previous:     5.3894    1.2396   
        1.2396 }
 
 ASSIgn ((segid "    " and resid 27   and name HA  ))
        ((segid "    " and resid 27   and name HG11)
      OR (segid "    " and resid 27   and name HG12)
      OR (segid "    " and resid 27   and name HG13))
        2.7746    0.6382    0.6382 { previous:     2.7699    0.6371   
        0.6371 }
 
 ASSIgn ((segid "    " and resid 27   and name HA  ))
        ((segid "    " and resid 27   and name HG21)
      OR (segid "    " and resid 27   and name HG22)
      OR (segid "    " and resid 27   and name HG23))
        2.9360    0.6753    0.6753 { previous:     2.9105    0.6694   
        0.6694 }
 
 ASSIgn ((segid "    " and resid 33   and name HA  ))
        ((segid "    " and resid 33   and name HB1 )
      OR (segid "    " and resid 33   and name HB2 )
      OR (segid "    " and resid 33   and name HB3 ))
        2.8477    0.6550    0.6550 { previous:     2.8674    0.6595   
        0.6595 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 34   and name HG21)
      OR (segid "    " and resid 34   and name HG22)
      OR (segid "    " and resid 34   and name HG23))
        3.0997    0.7129    0.7129 { previous:     3.1191    0.7174   
        0.7174 }
 
 ASSIgn ((segid "    " and resid 34   and name HA  ))
        ((segid "    " and resid 34   and name HD11)
      OR (segid "    " and resid 34   and name HD12)
      OR (segid "    " and resid 34   and name HD13))
        3.6700    0.8441    0.8441 { previous:     3.7043    0.8520   
        0.8520 }
 
 ASSIgn ((segid "    " and resid 40   and name HA  )
      OR (segid "    " and resid 40   and name HB  ))
        ((segid "    " and resid 40   and name HG21)
      OR (segid "    " and resid 40   and name HG22)
      OR (segid "    " and resid 40   and name HG23))
        3.3041    0.7600    0.7600 { previous:     3.3528    0.7711   
        0.7711 }

assign (resid 23 and name hn) (resid 25 and name hn) 4.2 2.4 0.8
assign (resid 32 and name hn) (resid 35 and name hn) 4.2 0.8 0.8
assign (resid 11 and name ha) (resid 12 and name hn) 3.0 1.2 0.5
assign (resid 39 and name ha) (resid 40 and name hn) 3.0 1.2 0.5
assign (resid 35 and name hn) (resid 33 and name ha) 4.2 0.6 0.6
assign (resid 16 and name hn) (resid 13 and name hb1) 4.2 2.4 0.8
assign (resid 22 and name hn) (resid 21 and name hb#) 4.2 2.4 0.3
assign (resid 34 and name hn) (resid 38 and name hb2) 4.2 2.4 0.8
assign (resid 35 and name hn) (resid 33 and name hb#) 4.2 2.4 1.8
assign (resid 35 and name hn) (resid 31 and name hb#) 4.2 1.8 0.8
assign (resid 12 and name hn) (resid 9 and name hg2#) 4.2 2.4 1.8
assign (resid 30 and name hn) (resid 34 and name hg2#) 4.2 2.4 1.8
assign (resid 31 and name hn) (resid 34 and name hg2#) 4.2 2.4 1.8
assign (resid 33 and name hn) (resid 32 and name hg#) 4.2 2.4 0.8
assign (resid 19 and name ha) (resid 5 and name hb#) 4.2 2.4 0.8
assign (resid 36 and name ha) (resid 39 and name hb#) 4.2 1.7 0.2
assign (resid 15 and name ha#) (resid 16 and name hg#) 4.2 2.4 0.8
assign (resid 5 and name hb1) (resid 35 and name hb1) 4.2 2.4 0.8
assign (resid 5 and name hb2) (resid 35 and name hb1) 4.2 2.4 0.8
assign (resid 11 and name hb1) (resid 26 and name hb2) 4.2 2.4 0.8
assign (resid 18 and name hb1) (resid 28 and name hb1) 4.2 2.4 0.8
assign (resid 28 and name hb2) (resid 18 and name hb1) 4.2 2.4 0.8
assign (resid 39 and name hb2) (resid 19 and name hb2) 3.3 1.5 0.2
assign (resid 29 and name hd#) (resid 34 and name hb) 3.0 1.2 2.0
assign (resid 17 and name he#) (resid 32 and name hb1) 4.2 2.4 1.8
assign (resid 17 and name he#) (resid 32 and name hg#) 4.2 2.4 1.2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ASP   1           HT3      ASP   1  10.691   3.570   4.180
    2   2H    ASP   1           HT2      ASP   1  11.938   4.338   5.039
    3   3H    ASP   1           HT1      ASP   1  10.987   5.223   3.946
    4    HA   ASP   1           HA       ASP   1  11.898   4.076   2.076
    5   1HB   ASP   1           HB2      ASP   1  14.202   4.883   2.337
    6   2HB   ASP   1           HB1      ASP   1  13.086   6.004   3.116
    7    H    ASP   2           HN       ASP   2  12.295   2.431   5.077
    8    HA   ASP   2           HA       ASP   2  14.245   0.463   4.068
    9   1HB   ASP   2           HB2      ASP   2  12.493   0.575   6.597
   10   2HB   ASP   2           HB1      ASP   2  13.819  -0.565   6.333
   11    H    GLY   3           HN       GLY   3  13.603  -1.153   2.733
   12   1HA   GLY   3           HA2      GLY   3  11.685  -3.083   3.227
   13   2HA   GLY   3           HA1      GLY   3  10.807  -1.843   2.336
   14    H    LEU   4           HN       LEU   4  11.345  -4.512   1.396
   15    HA   LEU   4           HA       LEU   4  13.015  -3.874  -1.005
   16   1HB   LEU   4           HB2      LEU   4  12.856  -6.549   0.418
   17   2HB   LEU   4           HB1      LEU   4  13.973  -6.078  -0.859
   18    HG   LEU   4           HG       LEU   4  13.918  -4.594   1.770
   19   1HD1  LEU   4          HD13      LEU   4  14.268  -6.999   2.246
   20   2HD1  LEU   4          HD12      LEU   4  15.590  -7.025   1.078
   21   3HD1  LEU   4          HD11      LEU   4  15.727  -6.056   2.545
   22   1HD2  LEU   4          HD21      LEU   4  15.632  -4.740  -0.659
   23   2HD2  LEU   4          HD23      LEU   4  15.306  -3.370   0.404
   24   3HD2  LEU   4          HD22      LEU   4  16.477  -4.599   0.882
   25    H    CYS   5           HN       CYS   5  12.476  -5.813  -2.744
   26    HA   CYS   5           HA       CYS   5   9.582  -6.579  -2.537
   27   1HB   CYS   5           HB2      CYS   5   9.827  -4.309  -3.652
   28   2HB   CYS   5           HB1      CYS   5  10.713  -5.112  -4.945
   29    H    TYR   6           HN       TYR   6   9.017  -8.329  -3.868
   30    HA   TYR   6           HA       TYR   6  11.219  -9.595  -5.449
   31   1HB   TYR   6           HB2      TYR   6  10.998 -11.669  -4.268
   32   2HB   TYR   6           HB1      TYR   6  11.095 -10.421  -3.039
   33    HD1  TYR   6           HD1      TYR   6   8.902 -12.786  -4.784
   34    HD2  TYR   6           HD2      TYR   6   9.207  -9.911  -1.632
   35    HE1  TYR   6           HE1      TYR   6   6.764 -13.605  -3.845
   36    HE2  TYR   6           HE2      TYR   6   7.052 -10.710  -0.683
   37    HH   TYR   6           HH       TYR   6   5.641 -12.643  -0.722
   38    H    GLU   7           HN       GLU   7  10.288 -11.300  -6.957
   39    HA   GLU   7           HA       GLU   7   7.419 -10.636  -7.593
   40   1HB   GLU   7           HB2      GLU   7   8.086 -10.563  -9.869
   41   2HB   GLU   7           HB1      GLU   7   9.390  -9.752  -9.015
   42   1HG   GLU   7           HG2      GLU   7  10.519 -12.096  -9.013
   43   2HG   GLU   7           HG1      GLU   7   9.280 -12.474 -10.226
   44    H    GLY   8           HN       GLY   8   6.137 -12.302  -8.426
   45   1HA   GLY   8           HA2      GLY   8   6.655 -14.789  -9.300
   46   2HA   GLY   8           HA1      GLY   8   6.959 -15.014  -7.581
   47    H    THR   9           HN       THR   9   5.203 -15.844  -6.536
   48    HA   THR   9           HA       THR   9   2.487 -14.855  -7.171
   49    HB   THR   9           HB       THR   9   3.490 -17.679  -7.379
   50    HG1  THR   9           HG1      THR   9   2.425 -15.969  -9.367
   51   1HG2  THR   9          HG22      THR   9   0.814 -16.660  -6.974
   52   2HG2  THR   9          HG21      THR   9   0.927 -17.443  -8.550
   53   3HG2  THR   9          HG23      THR   9   1.352 -18.335  -7.090
   54    H    ASN  10           HN       ASN  10   4.505 -15.131  -4.698
   55    HA   ASN  10           HA       ASN  10   3.315 -17.118  -2.963
   56   1HB   ASN  10           HB2      ASN  10   5.630 -16.225  -2.922
   57   2HB   ASN  10           HB1      ASN  10   4.999 -14.716  -2.263
   58   1HD2  ASN  10          HD22      ASN  10   4.683 -16.064   1.045
   59   2HD2  ASN  10          HD21      ASN  10   4.526 -14.661   0.039
   60    H    CYS  11           HN       CYS  11   2.286 -14.004  -3.747
   61    HA   CYS  11           HA       CYS  11   0.427 -14.024  -1.392
   62   1HB   CYS  11           HB2      CYS  11   1.888 -11.796  -2.802
   63   2HB   CYS  11           HB1      CYS  11   0.424 -11.450  -1.871
   64    H    GLY  12           HN       GLY  12   0.304 -15.134  -4.159
   65   1HA   GLY  12           HA2      GLY  12  -1.532 -15.428  -5.622
   66   2HA   GLY  12           HA1      GLY  12  -2.422 -14.303  -4.585
   67    H    LYS  13           HN       LYS  13   0.604 -13.143  -5.597
   68    HA   LYS  13           HA       LYS  13  -0.652 -11.066  -7.199
   69   1HB   LYS  13           HB2      LYS  13   1.395  -9.949  -6.863
   70   2HB   LYS  13           HB1      LYS  13   1.067 -10.867  -5.409
   71   1HG   LYS  13           HG2      LYS  13   2.501 -12.731  -6.455
   72   2HG   LYS  13           HG1      LYS  13   3.041 -11.496  -7.581
   73   1HD   LYS  13           HD2      LYS  13   3.555 -10.095  -5.486
   74   2HD   LYS  13           HD1      LYS  13   3.412 -11.610  -4.603
   75   1HE   LYS  13           HE2      LYS  13   5.173 -11.463  -7.040
   76   2HE   LYS  13           HE1      LYS  13   5.778 -10.927  -5.458
   77   1HZ   LYS  13           HZ2      LYS  13   4.427 -13.522  -5.948
   78   2HZ   LYS  13           HZ1      LYS  13   6.112 -13.333  -5.839
   79   3HZ   LYS  13           HZ3      LYS  13   5.130 -13.006  -4.495
   80    H    VAL  14           HN       VAL  14  -1.018 -13.299  -8.525
   81    HA   VAL  14           HA       VAL  14   1.048 -14.052 -10.411
   82    HB   VAL  14           HB       VAL  14  -1.974 -14.255 -10.293
   83   1HG1  VAL  14          HG12      VAL  14  -0.089 -15.169 -12.471
   84   2HG1  VAL  14          HG11      VAL  14  -1.622 -15.992 -12.181
   85   3HG1  VAL  14          HG13      VAL  14  -1.608 -14.287 -12.634
   86   1HG2  VAL  14          HG21      VAL  14  -0.175 -15.638  -8.871
   87   2HG2  VAL  14          HG23      VAL  14  -1.654 -16.386  -9.473
   88   3HG2  VAL  14          HG22      VAL  14  -0.137 -16.611 -10.342
   89    H    GLY  15           HN       GLY  15   1.926 -12.473 -11.772
   90   1HA   GLY  15           HA2      GLY  15   1.578 -11.172 -13.840
   91   2HA   GLY  15           HA1      GLY  15  -0.058 -10.802 -13.290
   92    H    LYS  16           HN       LYS  16   1.144 -10.233 -10.466
   93    HA   LYS  16           HA       LYS  16   2.291  -7.551 -11.179
   94   1HB   LYS  16           HB2      LYS  16   0.546  -8.264  -8.829
   95   2HB   LYS  16           HB1      LYS  16   1.090  -6.660  -9.306
   96   1HG   LYS  16           HG2      LYS  16  -0.148  -6.849 -11.426
   97   2HG   LYS  16           HG1      LYS  16  -0.732  -8.442 -10.943
   98   1HD   LYS  16           HD2      LYS  16  -1.183  -6.012  -9.205
   99   2HD   LYS  16           HD1      LYS  16  -2.295  -6.432 -10.510
  100   1HE   LYS  16           HE2      LYS  16  -2.898  -8.490  -9.492
  101   2HE   LYS  16           HE1      LYS  16  -1.490  -8.461  -8.411
  102   1HZ   LYS  16           HZ2      LYS  16  -3.589  -6.362  -8.410
  103   2HZ   LYS  16           HZ1      LYS  16  -3.624  -7.704  -7.369
  104   3HZ   LYS  16           HZ3      LYS  16  -2.351  -6.589  -7.269
  105    H    TYR  17           HN       TYR  17   2.760  -7.154  -8.102
  106    HA   TYR  17           HA       TYR  17   4.831  -9.264  -7.675
  107   1HB   TYR  17           HB2      TYR  17   5.486  -6.311  -7.559
  108   2HB   TYR  17           HB1      TYR  17   6.574  -7.707  -7.523
  109    HD1  TYR  17           HD1      TYR  17   4.281  -5.783  -9.771
  110    HD2  TYR  17           HD2      TYR  17   7.283  -8.802  -9.420
  111    HE1  TYR  17           HE1      TYR  17   4.530  -5.834 -12.241
  112    HE2  TYR  17           HE2      TYR  17   7.554  -8.858 -11.859
  113    HH   TYR  17           HH       TYR  17   5.329  -7.483 -13.976
  114    H    CYS  18           HN       CYS  18   5.924  -8.771  -5.292
  115    HA   CYS  18           HA       CYS  18   3.820  -7.555  -3.524
  116   1HB   CYS  18           HB2      CYS  18   5.143 -10.293  -3.385
  117   2HB   CYS  18           HB1      CYS  18   4.233  -9.598  -2.042
  118    H    CYS  19           HN       CYS  19   4.686  -7.029  -1.360
  119    HA   CYS  19           HA       CYS  19   7.644  -6.857  -1.247
  120   1HB   CYS  19           HB2      CYS  19   7.140  -4.505  -0.219
  121   2HB   CYS  19           HB1      CYS  19   7.003  -4.713  -1.967
  122    H    SER  20           HN       SER  20   8.434  -7.622   0.667
  123    HA   SER  20           HA       SER  20   7.115  -7.183   3.232
  124   1HB   SER  20           HB2      SER  20   6.845  -9.732   3.603
  125   2HB   SER  20           HB1      SER  20   5.708  -8.999   2.470
  126    HG   SER  20           HG       SER  20   8.114 -10.370   1.841
  127    HA   PRO  21           HA       PRO  21  11.490  -7.797   3.792
  128   1HB   PRO  21           HB2      PRO  21  11.699  -6.807   6.338
  129   2HB   PRO  21           HB1      PRO  21  11.560  -5.778   4.896
  130   1HG   PRO  21           HG2      PRO  21   9.490  -6.432   6.930
  131   2HG   PRO  21           HG1      PRO  21   9.684  -4.986   5.920
  132   1HD   PRO  21           HD2      PRO  21   7.896  -7.132   5.506
  133   2HD   PRO  21           HD1      PRO  21   8.276  -5.832   4.350
  134    H    ILE  22           HN       ILE  22   9.035  -9.509   5.134
  135    HA   ILE  22           HA       ILE  22  10.808 -11.630   6.040
  136    HB   ILE  22           HB       ILE  22  10.687  -9.885   7.895
  137   1HG1  ILE  22          HG12      ILE  22   9.644 -12.685   8.497
  138   2HG1  ILE  22          HG11      ILE  22  11.332 -12.169   8.519
  139   1HG2  ILE  22          HG23      ILE  22   7.994 -10.013   7.257
  140   2HG2  ILE  22          HG22      ILE  22   8.094 -10.819   8.822
  141   3HG2  ILE  22          HG21      ILE  22   8.697  -9.172   8.637
  142   1HD1  ILE  22          HD11      ILE  22  10.523 -10.425  10.292
  143   2HD1  ILE  22          HD13      ILE  22   9.130 -11.495  10.460
  144   3HD1  ILE  22          HD12      ILE  22  10.752 -12.101  10.792
  145    H    GLY  23           HN       GLY  23   8.234 -10.808   4.534
  146   1HA   GLY  23           HA2      GLY  23   6.463 -12.111   3.595
  147   2HA   GLY  23           HA1      GLY  23   7.021 -13.436   4.607
  148    H    LYS  24           HN       LYS  24   6.579 -10.629   6.404
  149    HA   LYS  24           HA       LYS  24   4.205 -11.781   7.672
  150   1HB   LYS  24           HB2      LYS  24   4.635 -10.215   9.423
  151   2HB   LYS  24           HB1      LYS  24   6.184 -10.866   8.901
  152   1HG   LYS  24           HG2      LYS  24   6.489  -8.855   7.439
  153   2HG   LYS  24           HG1      LYS  24   4.985  -8.202   8.084
  154   1HD   LYS  24           HD2      LYS  24   7.199  -9.056   9.935
  155   2HD   LYS  24           HD1      LYS  24   7.220  -7.459   9.186
  156   1HE   LYS  24           HE2      LYS  24   5.957  -6.868  11.012
  157   2HE   LYS  24           HE1      LYS  24   4.626  -7.593  10.088
  158   1HZ   LYS  24           HZ1      LYS  24   5.599  -9.788  11.080
  159   2HZ   LYS  24           HZ3      LYS  24   6.217  -8.752  12.272
  160   3HZ   LYS  24           HZ2      LYS  24   4.542  -8.831  12.002
  161    H    TYR  25           HN       TYR  25   5.033  -8.903   5.788
  162    HA   TYR  25           HA       TYR  25   2.368  -7.731   6.120
  163   1HB   TYR  25           HB2      TYR  25   4.896  -7.044   4.641
  164   2HB   TYR  25           HB1      TYR  25   3.412  -6.128   4.376
  165    HD1  TYR  25           HD2      TYR  25   2.268  -5.041   6.370
  166    HD2  TYR  25           HD1      TYR  25   6.230  -6.677   6.558
  167    HE1  TYR  25           HE2      TYR  25   2.705  -3.731   8.438
  168    HE2  TYR  25           HE1      TYR  25   6.679  -5.358   8.630
  169    HH   TYR  25           HH       TYR  25   4.579  -4.207  10.550
  170    H    CYS  26           HN       CYS  26   4.175  -9.324   3.468
  171    HA   CYS  26           HA       CYS  26   3.414  -9.966   1.288
  172   1HB   CYS  26           HB2      CYS  26   2.506 -11.754   2.706
  173   2HB   CYS  26           HB1      CYS  26   1.140 -10.740   3.186
  174    H    VAL  27           HN       VAL  27   3.227  -7.416   1.001
  175    HA   VAL  27           HA       VAL  27   0.349  -6.694   0.463
  176    HB   VAL  27           HB       VAL  27   2.819  -4.994   0.967
  177   1HG1  VAL  27          HG13      VAL  27   0.538  -4.316  -0.436
  178   2HG1  VAL  27          HG12      VAL  27   0.158  -3.776   1.199
  179   3HG1  VAL  27          HG11      VAL  27   1.603  -3.174   0.385
  180   1HG2  VAL  27          HG23      VAL  27   1.918  -6.262   2.942
  181   2HG2  VAL  27          HG22      VAL  27   1.801  -4.511   3.122
  182   3HG2  VAL  27          HG21      VAL  27   0.371  -5.452   2.699
  183    H    CYS  28           HN       CYS  28  -0.064  -6.903  -1.712
  184    HA   CYS  28           HA       CYS  28   2.226  -6.444  -3.590
  185   1HB   CYS  28           HB2      CYS  28  -0.304  -8.044  -3.992
  186   2HB   CYS  28           HB1      CYS  28   1.183  -8.152  -4.932
  187    H    TYR  29           HN       TYR  29   1.727  -5.626  -5.694
  188    HA   TYR  29           HA       TYR  29  -0.784  -4.091  -6.024
  189   1HB   TYR  29           HB2      TYR  29   2.012  -2.995  -6.142
  190   2HB   TYR  29           HB1      TYR  29   0.552  -2.125  -6.566
  191    HD1  TYR  29           HD1      TYR  29   2.370  -3.765  -3.838
  192    HD2  TYR  29           HD2      TYR  29  -0.805  -1.132  -4.937
  193    HE1  TYR  29           HE1      TYR  29   2.170  -3.044  -1.486
  194    HE2  TYR  29           HE2      TYR  29  -1.036  -0.399  -2.587
  195    HH   TYR  29           HH       TYR  29   0.990  -0.509  -0.421
  196    H    ASP  30           HN       ASP  30  -0.632  -3.056  -8.369
  197    HA   ASP  30           HA       ASP  30   0.277  -5.145 -10.184
  198   1HB   ASP  30           HB2      ASP  30  -0.987  -4.004 -11.778
  199   2HB   ASP  30           HB1      ASP  30  -1.861  -3.767 -10.268
  200    H    SER  31           HN       SER  31   1.237  -1.792  -9.485
  201    HA   SER  31           HA       SER  31   3.339  -1.846 -11.566
  202   1HB   SER  31           HB2      SER  31   3.081   0.121  -9.347
  203   2HB   SER  31           HB1      SER  31   3.680   0.385 -10.977
  204    HG   SER  31           HG       SER  31   1.704   1.030 -11.304
  205    H    LYS  32           HN       LYS  32   5.219  -3.160 -11.110
  206    HA   LYS  32           HA       LYS  32   5.901  -4.153  -8.554
  207   1HB   LYS  32           HB2      LYS  32   8.016  -4.719  -9.567
  208   2HB   LYS  32           HB1      LYS  32   6.913  -4.613 -10.944
  209   1HG   LYS  32           HG2      LYS  32   7.721  -2.415 -11.529
  210   2HG   LYS  32           HG1      LYS  32   8.643  -2.299 -10.036
  211   1HD   LYS  32           HD2      LYS  32   9.224  -3.945 -12.511
  212   2HD   LYS  32           HD1      LYS  32  10.304  -2.871 -11.621
  213   1HE   LYS  32           HE2      LYS  32   9.287  -5.567 -10.576
  214   2HE   LYS  32           HE1      LYS  32  10.919  -5.257 -11.207
  215   1HZ   LYS  32           HZ1      LYS  32  11.187  -3.509  -9.551
  216   2HZ   LYS  32           HZ3      LYS  32   9.644  -3.833  -8.926
  217   3HZ   LYS  32           HZ2      LYS  32  10.870  -5.002  -8.804
  218    H    ALA  33           HN       ALA  33   6.531  -1.009 -10.061
  219    HA   ALA  33           HA       ALA  33   8.238   0.156  -8.136
  220   1HB   ALA  33           HB3      ALA  33   7.497   1.004 -10.441
  221   2HB   ALA  33           HB2      ALA  33   5.962   1.445  -9.687
  222   3HB   ALA  33           HB1      ALA  33   7.458   2.222  -9.163
  223    H    ILE  34           HN       ILE  34   4.585   0.024  -8.319
  224    HA   ILE  34           HA       ILE  34   4.132   1.522  -5.996
  225    HB   ILE  34           HB       ILE  34   2.773  -0.615  -7.512
  226   1HG1  ILE  34          HG12      ILE  34   2.498   2.362  -7.104
  227   2HG1  ILE  34          HG11      ILE  34   2.710   1.476  -8.609
  228   1HG2  ILE  34          HG21      ILE  34   2.161  -0.748  -5.031
  229   2HG2  ILE  34          HG23      ILE  34   1.560   0.900  -5.170
  230   3HG2  ILE  34          HG22      ILE  34   0.805  -0.392  -6.097
  231   1HD1  ILE  34          HD13      ILE  34   0.463   0.405  -8.160
  232   2HD1  ILE  34          HD12      ILE  34   0.267   1.566  -6.847
  233   3HD1  ILE  34          HD11      ILE  34   0.409   2.133  -8.512
  234    H    CYS  35           HN       CYS  35   5.231  -1.650  -6.474
  235    HA   CYS  35           HA       CYS  35   4.722  -2.777  -3.861
  236   1HB   CYS  35           HB2      CYS  35   5.512  -4.159  -5.761
  237   2HB   CYS  35           HB1      CYS  35   7.025  -3.233  -5.818
  238    H    ASN  36           HN       ASN  36   7.870  -1.554  -5.127
  239    HA   ASN  36           HA       ASN  36   9.074  -1.089  -2.569
  240   1HB   ASN  36           HB2      ASN  36   9.340   0.299  -5.274
  241   2HB   ASN  36           HB1      ASN  36  10.443   0.589  -3.923
  242   1HD2  ASN  36          HD22      ASN  36  11.596  -2.292  -6.184
  243   2HD2  ASN  36          HD21      ASN  36  10.969  -0.768  -6.590
  244    H    LYS  37           HN       LYS  37   7.407   1.297  -4.618
  245    HA   LYS  37           HA       LYS  37   7.523   3.521  -2.910
  246   1HB   LYS  37           HB2      LYS  37   7.028   3.309  -5.377
  247   2HB   LYS  37           HB1      LYS  37   5.388   2.854  -4.922
  248   1HG   LYS  37           HG2      LYS  37   6.657   5.404  -3.911
  249   2HG   LYS  37           HG1      LYS  37   5.810   5.347  -5.455
  250   1HD   LYS  37           HD2      LYS  37   3.944   4.160  -3.942
  251   2HD   LYS  37           HD1      LYS  37   4.721   5.119  -2.686
  252   1HE   LYS  37           HE2      LYS  37   3.815   6.319  -5.327
  253   2HE   LYS  37           HE1      LYS  37   2.796   6.297  -3.873
  254   1HZ   LYS  37           HZ3      LYS  37   4.692   7.299  -2.657
  255   2HZ   LYS  37           HZ2      LYS  37   5.511   7.478  -4.135
  256   3HZ   LYS  37           HZ1      LYS  37   4.057   8.314  -3.859
  257    H    ASN  38           HN       ASN  38   4.330   2.165  -3.717
  258    HA   ASN  38           HA       ASN  38   2.994   3.250  -1.556
  259   1HB   ASN  38           HB2      ASN  38   2.616   1.113  -3.535
  260   2HB   ASN  38           HB1      ASN  38   1.364   1.421  -2.326
  261   1HD2  ASN  38          HD22      ASN  38   1.855   3.918  -5.465
  262   2HD2  ASN  38          HD21      ASN  38   2.805   2.523  -5.256
  263    H    CYS  39           HN       CYS  39   4.612   0.195  -1.866
  264    HA   CYS  39           HA       CYS  39   3.431  -1.265   0.238
  265   1HB   CYS  39           HB2      CYS  39   6.309  -1.034  -0.613
  266   2HB   CYS  39           HB1      CYS  39   5.740  -2.267   0.517
  267    H    THR  40           HN       THR  40   5.612   1.486   0.527
  268    HA   THR  40           HA       THR  40   6.164   1.069   3.369
  269    HB   THR  40           HB       THR  40   6.991   3.506   3.085
  270    HG1  THR  40           HG1      THR  40   6.814   3.008   0.342
  271   1HG2  THR  40          HG21      THR  40   8.015   1.051   1.696
  272   2HG2  THR  40          HG23      THR  40   8.773   2.591   1.284
  273   3HG2  THR  40          HG22      THR  40   8.774   2.028   2.955
   
  No H/Q in entry =         273
  Start of MODEL    2
    1   1H    ASP   1           HT2      ASP   1  10.534   0.514   9.021
    2   2H    ASP   1           HT1      ASP   1  10.058   2.140   8.887
    3   3H    ASP   1           HT3      ASP   1   9.133   1.061   9.812
    4    HA   ASP   1           HA       ASP   1   8.374  -0.103   7.907
    5   1HB   ASP   1           HB2      ASP   1   7.809   2.482   8.554
    6   2HB   ASP   1           HB1      ASP   1   8.291   2.673   6.867
    7    H    ASP   2           HN       ASP   2   9.991  -1.242   6.721
    8    HA   ASP   2           HA       ASP   2  10.873   0.101   4.231
    9   1HB   ASP   2           HB2      ASP   2  12.661  -0.849   6.509
   10   2HB   ASP   2           HB1      ASP   2  13.281  -0.771   4.852
   11    H    GLY   3           HN       GLY   3  12.239  -1.624   2.941
   12   1HA   GLY   3           HA2      GLY   3  12.246  -4.354   3.375
   13   2HA   GLY   3           HA1      GLY   3  10.634  -4.038   2.740
   14    H    LEU   4           HN       LEU   4  11.550  -5.481   0.963
   15    HA   LEU   4           HA       LEU   4  12.912  -3.776  -1.090
   16   1HB   LEU   4           HB2      LEU   4  13.329  -6.755  -0.723
   17   2HB   LEU   4           HB1      LEU   4  14.301  -5.630  -1.666
   18    HG   LEU   4           HG       LEU   4  14.025  -5.300   1.323
   19   1HD1  LEU   4          HD12      LEU   4  15.795  -7.167  -0.237
   20   2HD1  LEU   4          HD11      LEU   4  16.350  -6.471   1.287
   21   3HD1  LEU   4          HD13      LEU   4  14.899  -7.475   1.253
   22   1HD2  LEU   4          HD23      LEU   4  15.690  -4.203  -0.891
   23   2HD2  LEU   4          HD22      LEU   4  15.109  -3.411   0.576
   24   3HD2  LEU   4          HD21      LEU   4  16.508  -4.482   0.646
   25    H    CYS   5           HN       CYS   5  12.598  -5.060  -3.385
   26    HA   CYS   5           HA       CYS   5   9.716  -5.989  -3.421
   27   1HB   CYS   5           HB2      CYS   5  10.428  -3.794  -4.589
   28   2HB   CYS   5           HB1      CYS   5  11.212  -4.828  -5.781
   29    H    TYR   6           HN       TYR   6   9.276  -7.922  -4.354
   30    HA   TYR   6           HA       TYR   6  11.422  -9.313  -5.895
   31   1HB   TYR   6           HB2      TYR   6  11.291 -11.262  -4.505
   32   2HB   TYR   6           HB1      TYR   6  11.441  -9.895  -3.416
   33    HD1  TYR   6           HD1      TYR   6   9.191 -12.453  -4.774
   34    HD2  TYR   6           HD2      TYR   6   9.624  -9.253  -1.966
   35    HE1  TYR   6           HE1      TYR   6   7.126 -13.195  -3.625
   36    HE2  TYR   6           HE2      TYR   6   7.543  -9.980  -0.808
   37    HH   TYR   6           HH       TYR   6   6.252 -12.174  -0.574
   38    H    GLU   7           HN       GLU   7  10.426 -11.171  -7.186
   39    HA   GLU   7           HA       GLU   7   7.525 -10.559  -7.723
   40   1HB   GLU   7           HB2      GLU   7   8.063 -10.706 -10.028
   41   2HB   GLU   7           HB1      GLU   7   9.412  -9.822  -9.329
   42   1HG   GLU   7           HG2      GLU   7  10.542 -12.162  -9.167
   43   2HG   GLU   7           HG1      GLU   7   9.238 -12.648 -10.267
   44    H    GLY   8           HN       GLY   8   6.189 -12.273  -8.307
   45   1HA   GLY   8           HA2      GLY   8   6.643 -14.829  -9.001
   46   2HA   GLY   8           HA1      GLY   8   7.044 -14.914  -7.289
   47    H    THR   9           HN       THR   9   5.347 -15.667  -6.105
   48    HA   THR   9           HA       THR   9   2.605 -14.693  -6.638
   49    HB   THR   9           HB       THR   9   3.570 -17.536  -6.716
   50    HG1  THR   9           HG1      THR   9   3.678 -17.238  -8.777
   51   1HG2  THR   9          HG21      THR   9   0.936 -16.463  -6.220
   52   2HG2  THR   9          HG23      THR   9   0.943 -17.327  -7.757
   53   3HG2  THR   9          HG22      THR   9   1.445 -18.149  -6.281
   54    H    ASN  10           HN       ASN  10   4.768 -14.811  -4.290
   55    HA   ASN  10           HA       ASN  10   3.709 -16.678  -2.352
   56   1HB   ASN  10           HB2      ASN  10   6.016 -15.762  -2.543
   57   2HB   ASN  10           HB1      ASN  10   5.413 -14.231  -1.910
   58   1HD2  ASN  10          HD22      ASN  10   5.364 -15.428   1.472
   59   2HD2  ASN  10          HD21      ASN  10   5.115 -14.075   0.417
   60    H    CYS  11           HN       CYS  11   2.599 -13.636  -3.276
   61    HA   CYS  11           HA       CYS  11   0.909 -13.495  -0.803
   62   1HB   CYS  11           HB2      CYS  11   2.252 -11.368  -2.462
   63   2HB   CYS  11           HB1      CYS  11   0.853 -10.962  -1.460
   64    H    GLY  12           HN       GLY  12   0.601 -14.806  -3.459
   65   1HA   GLY  12           HA2      GLY  12  -1.328 -15.211  -4.767
   66   2HA   GLY  12           HA1      GLY  12  -2.150 -14.005  -3.766
   67    H    LYS  13           HN       LYS  13   0.794 -12.924  -5.053
   68    HA   LYS  13           HA       LYS  13  -0.573 -10.993  -6.744
   69   1HB   LYS  13           HB2      LYS  13   1.476  -9.835  -6.614
   70   2HB   LYS  13           HB1      LYS  13   1.238 -10.633  -5.073
   71   1HG   LYS  13           HG2      LYS  13   2.638 -12.563  -6.038
   72   2HG   LYS  13           HG1      LYS  13   3.099 -11.425  -7.293
   73   1HD   LYS  13           HD2      LYS  13   3.642  -9.859  -5.268
   74   2HD   LYS  13           HD1      LYS  13   3.711 -11.370  -4.369
   75   1HE   LYS  13           HE2      LYS  13   5.174 -11.282  -6.970
   76   2HE   LYS  13           HE1      LYS  13   5.884 -10.409  -5.597
   77   1HZ   LYS  13           HZ1      LYS  13   5.451 -12.425  -4.240
   78   2HZ   LYS  13           HZ3      LYS  13   5.026 -13.247  -5.658
   79   3HZ   LYS  13           HZ2      LYS  13   6.608 -12.663  -5.463
   80    H    VAL  14           HN       VAL  14  -1.011 -13.295  -7.880
   81    HA   VAL  14           HA       VAL  14   0.950 -14.231  -9.795
   82    HB   VAL  14           HB       VAL  14  -2.068 -14.360  -9.538
   83   1HG1  VAL  14          HG11      VAL  14  -0.536 -14.873 -11.907
   84   2HG1  VAL  14          HG13      VAL  14  -1.101 -16.420 -11.275
   85   3HG1  VAL  14          HG12      VAL  14  -2.258 -15.141 -11.644
   86   1HG2  VAL  14          HG21      VAL  14  -0.145 -15.661  -8.114
   87   2HG2  VAL  14          HG23      VAL  14  -1.747 -16.328  -8.428
   88   3HG2  VAL  14          HG22      VAL  14  -0.382 -16.797  -9.442
   89    H    GLY  15           HN       GLY  15   1.803 -12.732 -11.263
   90   1HA   GLY  15           HA2      GLY  15   1.428 -11.588 -13.413
   91   2HA   GLY  15           HA1      GLY  15  -0.214 -11.207 -12.886
   92    H    LYS  16           HN       LYS  16   0.985 -10.428 -10.122
   93    HA   LYS  16           HA       LYS  16   1.988  -7.742 -11.009
   94   1HB   LYS  16           HB2      LYS  16   0.480  -8.461  -8.502
   95   2HB   LYS  16           HB1      LYS  16   0.907  -6.850  -9.061
   96   1HG   LYS  16           HG2      LYS  16  -0.487  -7.164 -11.075
   97   2HG   LYS  16           HG1      LYS  16  -0.966  -8.757 -10.489
   98   1HD   LYS  16           HD2      LYS  16  -1.341  -6.380  -8.693
   99   2HD   LYS  16           HD1      LYS  16  -2.490  -6.654 -10.003
  100   1HE   LYS  16           HE2      LYS  16  -2.737  -9.042  -9.143
  101   2HE   LYS  16           HE1      LYS  16  -1.831  -8.523  -7.708
  102   1HZ   LYS  16           HZ3      LYS  16  -4.176  -7.032  -8.742
  103   2HZ   LYS  16           HZ2      LYS  16  -4.324  -8.260  -7.577
  104   3HZ   LYS  16           HZ1      LYS  16  -3.416  -6.864  -7.235
  105    H    TYR  17           HN       TYR  17   2.717  -7.182  -8.025
  106    HA   TYR  17           HA       TYR  17   4.886  -9.204  -7.671
  107   1HB   TYR  17           HB2      TYR  17   5.448  -6.229  -7.819
  108   2HB   TYR  17           HB1      TYR  17   6.588  -7.584  -7.752
  109    HD1  TYR  17           HD1      TYR  17   4.057  -5.942  -9.968
  110    HD2  TYR  17           HD2      TYR  17   7.210  -8.803  -9.602
  111    HE1  TYR  17           HE1      TYR  17   4.124  -6.198 -12.438
  112    HE2  TYR  17           HE2      TYR  17   7.299  -9.061 -12.040
  113    HH   TYR  17           HH       TYR  17   5.263  -8.577 -14.009
  114    H    CYS  18           HN       CYS  18   6.180  -8.514  -5.445
  115    HA   CYS  18           HA       CYS  18   4.207  -7.283  -3.549
  116   1HB   CYS  18           HB2      CYS  18   5.626  -9.967  -3.453
  117   2HB   CYS  18           HB1      CYS  18   4.948  -9.221  -2.005
  118    H    CYS  19           HN       CYS  19   5.236  -6.611  -1.517
  119    HA   CYS  19           HA       CYS  19   8.176  -6.261  -1.662
  120   1HB   CYS  19           HB2      CYS  19   7.619  -3.884  -0.735
  121   2HB   CYS  19           HB1      CYS  19   7.365  -4.203  -2.452
  122    H    SER  20           HN       SER  20   8.804  -7.512   0.066
  123    HA   SER  20           HA       SER  20   8.237  -6.654   2.764
  124   1HB   SER  20           HB2      SER  20   7.118  -8.986   3.305
  125   2HB   SER  20           HB1      SER  20   6.132  -7.713   2.579
  126    HG   SER  20           HG       SER  20   6.301  -8.700   0.620
  127    HA   PRO  21           HA       PRO  21  12.017  -8.961   2.880
  128   1HB   PRO  21           HB2      PRO  21  12.609  -8.696   5.545
  129   2HB   PRO  21           HB1      PRO  21  12.808  -7.376   4.372
  130   1HG   PRO  21           HG2      PRO  21  10.656  -7.772   6.395
  131   2HG   PRO  21           HG1      PRO  21  11.361  -6.275   5.752
  132   1HD   PRO  21           HD2      PRO  21   8.916  -7.426   5.006
  133   2HD   PRO  21           HD1      PRO  21   9.789  -6.161   4.107
  134    H    ILE  22           HN       ILE  22   9.146  -9.774   4.354
  135    HA   ILE  22           HA       ILE  22   9.744 -12.633   4.463
  136    HB   ILE  22           HB       ILE  22  10.723 -11.426   6.561
  137   1HG1  ILE  22          HG12      ILE  22   8.765 -13.725   6.967
  138   2HG1  ILE  22          HG11      ILE  22  10.461 -13.891   6.517
  139   1HG2  ILE  22          HG23      ILE  22   8.293 -10.295   6.678
  140   2HG2  ILE  22          HG22      ILE  22   8.046 -11.646   7.779
  141   3HG2  ILE  22          HG21      ILE  22   9.338 -10.486   8.083
  142   1HD1  ILE  22          HD11      ILE  22  10.762 -12.388   8.731
  143   2HD1  ILE  22          HD13      ILE  22   9.257 -13.206   9.152
  144   3HD1  ILE  22          HD12      ILE  22  10.700 -14.150   8.785
  145    H    GLY  23           HN       GLY  23   7.600 -13.500   5.902
  146   1HA   GLY  23           HA2      GLY  23   5.354 -12.638   4.201
  147   2HA   GLY  23           HA1      GLY  23   5.331 -13.987   5.329
  148    H    LYS  24           HN       LYS  24   6.517 -11.143   6.742
  149    HA   LYS  24           HA       LYS  24   4.113 -10.977   8.388
  150   1HB   LYS  24           HB2      LYS  24   5.398  -9.557   9.802
  151   2HB   LYS  24           HB1      LYS  24   6.477 -10.824   9.231
  152   1HG   LYS  24           HG2      LYS  24   7.137  -9.190   7.360
  153   2HG   LYS  24           HG1      LYS  24   6.317  -7.954   8.308
  154   1HD   LYS  24           HD2      LYS  24   8.329  -9.722   9.657
  155   2HD   LYS  24           HD1      LYS  24   8.897  -8.380   8.662
  156   1HE   LYS  24           HE2      LYS  24   7.160  -6.962  10.024
  157   2HE   LYS  24           HE1      LYS  24   7.269  -8.291  11.194
  158   1HZ   LYS  24           HZ2      LYS  24   9.803  -8.043  10.753
  159   2HZ   LYS  24           HZ1      LYS  24   9.384  -6.475  10.248
  160   3HZ   LYS  24           HZ3      LYS  24   9.033  -6.977  11.829
  161    H    TYR  25           HN       TYR  25   5.806  -8.800   6.116
  162    HA   TYR  25           HA       TYR  25   3.649  -6.806   6.313
  163   1HB   TYR  25           HB2      TYR  25   6.286  -7.031   4.873
  164   2HB   TYR  25           HB1      TYR  25   5.152  -5.735   4.494
  165    HD1  TYR  25           HD2      TYR  25   4.312  -4.267   6.459
  166    HD2  TYR  25           HD1      TYR  25   7.733  -6.847   6.700
  167    HE1  TYR  25           HE2      TYR  25   5.128  -2.995   8.431
  168    HE2  TYR  25           HE1      TYR  25   8.563  -5.566   8.674
  169    HH   TYR  25           HH       TYR  25   8.296  -3.357   9.662
  170    H    CYS  26           HN       CYS  26   5.082  -8.833   3.733
  171    HA   CYS  26           HA       CYS  26   4.227  -9.315   1.539
  172   1HB   CYS  26           HB2      CYS  26   3.255 -11.062   2.941
  173   2HB   CYS  26           HB1      CYS  26   1.992  -9.969   3.521
  174    H    VAL  27           HN       VAL  27   4.157  -6.810   1.038
  175    HA   VAL  27           HA       VAL  27   1.277  -5.935   0.788
  176    HB   VAL  27           HB       VAL  27   3.862  -4.336   0.815
  177   1HG1  VAL  27          HG12      VAL  27   1.394  -3.670  -0.237
  178   2HG1  VAL  27          HG11      VAL  27   1.310  -3.004   1.394
  179   3HG1  VAL  27          HG13      VAL  27   2.613  -2.515   0.308
  180   1HG2  VAL  27          HG22      VAL  27   2.003  -5.268   2.940
  181   2HG2  VAL  27          HG21      VAL  27   3.714  -4.853   3.045
  182   3HG2  VAL  27          HG23      VAL  27   2.495  -3.578   3.037
  183    H    CYS  28           HN       CYS  28   0.631  -6.431  -1.284
  184    HA   CYS  28           HA       CYS  28   2.656  -6.120  -3.472
  185   1HB   CYS  28           HB2      CYS  28   0.138  -7.785  -3.389
  186   2HB   CYS  28           HB1      CYS  28   1.482  -7.955  -4.515
  187    H    TYR  29           HN       TYR  29   1.891  -5.516  -5.567
  188    HA   TYR  29           HA       TYR  29  -0.680  -4.058  -5.737
  189   1HB   TYR  29           HB2      TYR  29   2.054  -2.928  -6.254
  190   2HB   TYR  29           HB1      TYR  29   0.536  -2.128  -6.604
  191    HD1  TYR  29           HD1      TYR  29   2.652  -3.482  -3.935
  192    HD2  TYR  29           HD2      TYR  29  -0.672  -1.002  -4.947
  193    HE1  TYR  29           HE1      TYR  29   2.666  -2.550  -1.648
  194    HE2  TYR  29           HE2      TYR  29  -0.688  -0.058  -2.662
  195    HH   TYR  29           HH       TYR  29   0.197  -1.039  -0.261
  196    H    ASP  30           HN       ASP  30  -0.802  -3.202  -8.158
  197    HA   ASP  30           HA       ASP  30  -0.066  -5.418  -9.902
  198   1HB   ASP  30           HB2      ASP  30  -1.536  -4.426 -11.415
  199   2HB   ASP  30           HB1      ASP  30  -2.232  -4.084  -9.835
  200    H    SER  31           HN       SER  31   0.866  -1.996  -9.609
  201    HA   SER  31           HA       SER  31   2.733  -2.199 -11.895
  202   1HB   SER  31           HB2      SER  31   2.657  -0.038  -9.848
  203   2HB   SER  31           HB1      SER  31   3.068   0.083 -11.552
  204    HG   SER  31           HG       SER  31   0.951  -0.196 -12.078
  205    H    LYS  32           HN       LYS  32   4.719  -3.378 -11.557
  206    HA   LYS  32           HA       LYS  32   5.696  -4.154  -9.021
  207   1HB   LYS  32           HB2      LYS  32   7.717  -4.725 -10.208
  208   2HB   LYS  32           HB1      LYS  32   6.474  -4.762 -11.462
  209   1HG   LYS  32           HG2      LYS  32   7.147  -2.645 -12.345
  210   2HG   LYS  32           HG1      LYS  32   8.136  -2.291 -10.933
  211   1HD   LYS  32           HD2      LYS  32   8.700  -4.188 -13.225
  212   2HD   LYS  32           HD1      LYS  32   9.753  -2.957 -12.530
  213   1HE   LYS  32           HE2      LYS  32   9.821  -4.388 -10.387
  214   2HE   LYS  32           HE1      LYS  32   9.054  -5.681 -11.339
  215   1HZ   LYS  32           HZ2      LYS  32  11.513  -4.216 -12.158
  216   2HZ   LYS  32           HZ1      LYS  32  11.513  -5.747 -11.421
  217   3HZ   LYS  32           HZ3      LYS  32  10.809  -5.545 -12.950
  218    H    ALA  33           HN       ALA  33   6.048  -1.112 -10.807
  219    HA   ALA  33           HA       ALA  33   7.896   0.238  -9.148
  220   1HB   ALA  33           HB3      ALA  33   6.914   0.893 -11.425
  221   2HB   ALA  33           HB2      ALA  33   5.440   1.343 -10.562
  222   3HB   ALA  33           HB1      ALA  33   6.949   2.202 -10.239
  223    H    ILE  34           HN       ILE  34   4.250  -0.006  -8.967
  224    HA   ILE  34           HA       ILE  34   3.972   1.644  -6.717
  225    HB   ILE  34           HB       ILE  34   2.541  -0.624  -7.949
  226   1HG1  ILE  34          HG12      ILE  34   2.221   2.367  -7.730
  227   2HG1  ILE  34          HG11      ILE  34   2.317   1.377  -9.182
  228   1HG2  ILE  34          HG22      ILE  34   2.170  -0.566  -5.408
  229   2HG2  ILE  34          HG21      ILE  34   1.474   1.034  -5.639
  230   3HG2  ILE  34          HG23      ILE  34   0.713  -0.369  -6.381
  231   1HD1  ILE  34          HD11      ILE  34   0.155   0.280  -8.384
  232   2HD1  ILE  34          HD13      ILE  34   0.045   1.600  -7.222
  233   3HD1  ILE  34          HD12      ILE  34   0.022   1.945  -8.953
  234    H    CYS  35           HN       CYS  35   5.110  -1.529  -7.086
  235    HA   CYS  35           HA       CYS  35   4.887  -2.510  -4.382
  236   1HB   CYS  35           HB2      CYS  35   5.549  -4.064  -6.107
  237   2HB   CYS  35           HB1      CYS  35   6.870  -3.011  -6.641
  238    H    ASN  36           HN       ASN  36   7.849  -1.241  -5.997
  239    HA   ASN  36           HA       ASN  36   9.247  -0.597  -3.565
  240   1HB   ASN  36           HB2      ASN  36  10.295  -0.652  -5.799
  241   2HB   ASN  36           HB1      ASN  36   9.288   0.699  -6.339
  242   1HD2  ASN  36          HD22      ASN  36  11.256   3.164  -4.696
  243   2HD2  ASN  36          HD21      ASN  36   9.775   2.840  -5.460
  244    H    LYS  37           HN       LYS  37   7.361   1.604  -5.632
  245    HA   LYS  37           HA       LYS  37   7.533   3.942  -4.090
  246   1HB   LYS  37           HB2      LYS  37   6.854   3.531  -6.491
  247   2HB   LYS  37           HB1      LYS  37   5.268   3.080  -5.873
  248   1HG   LYS  37           HG2      LYS  37   6.546   5.726  -5.164
  249   2HG   LYS  37           HG1      LYS  37   5.583   5.532  -6.626
  250   1HD   LYS  37           HD2      LYS  37   3.913   4.404  -4.809
  251   2HD   LYS  37           HD1      LYS  37   4.720   5.592  -3.788
  252   1HE   LYS  37           HE2      LYS  37   3.897   6.634  -6.438
  253   2HE   LYS  37           HE1      LYS  37   2.555   6.172  -5.371
  254   1HZ   LYS  37           HZ2      LYS  37   3.752   7.379  -3.563
  255   2HZ   LYS  37           HZ1      LYS  37   4.815   7.991  -4.739
  256   3HZ   LYS  37           HZ3      LYS  37   3.166   8.383  -4.801
  257    H    ASN  38           HN       ASN  38   4.332   2.452  -4.545
  258    HA   ASN  38           HA       ASN  38   3.144   3.656  -2.357
  259   1HB   ASN  38           HB2      ASN  38   2.659   1.394  -4.164
  260   2HB   ASN  38           HB1      ASN  38   1.498   1.759  -2.883
  261   1HD2  ASN  38          HD22      ASN  38   1.697   4.064  -6.198
  262   2HD2  ASN  38          HD21      ASN  38   2.691   2.701  -5.977
  263    H    CYS  39           HN       CYS  39   4.814   0.623  -2.599
  264    HA   CYS  39           HA       CYS  39   3.811  -0.726  -0.330
  265   1HB   CYS  39           HB2      CYS  39   6.610  -0.496  -1.411
  266   2HB   CYS  39           HB1      CYS  39   6.184  -1.625  -0.123
  267    H    THR  40           HN       THR  40   5.963   2.066  -0.366
  268    HA   THR  40           HA       THR  40   6.680   1.854   2.462
  269    HB   THR  40           HB       THR  40   7.463   4.274   1.945
  270    HG1  THR  40           HG1      THR  40   6.920   5.034   0.086
  271   1HG2  THR  40          HG22      THR  40   8.432   1.733   0.651
  272   2HG2  THR  40          HG21      THR  40   9.180   3.257   0.168
  273   3HG2  THR  40          HG23      THR  40   9.227   2.748   1.857
   
  No H/Q in entry =         273
  Start of MODEL    3
    1   1H    ASP   1           HT3      ASP   1  10.297   2.529   7.335
    2   2H    ASP   1           HT2      ASP   1   9.224   3.846   7.301
    3   3H    ASP   1           HT1      ASP   1   9.068   2.590   6.167
    4    HA   ASP   1           HA       ASP   1  10.095   4.386   5.023
    5   1HB   ASP   1           HB2      ASP   1  11.373   4.568   7.694
    6   2HB   ASP   1           HB1      ASP   1  12.403   5.007   6.330
    7    H    ASP   2           HN       ASP   2  10.414   1.381   5.355
    8    HA   ASP   2           HA       ASP   2  12.853   1.122   3.691
    9   1HB   ASP   2           HB2      ASP   2  12.453   0.046   6.515
   10   2HB   ASP   2           HB1      ASP   2  13.559  -0.762   5.394
   11    H    GLY   3           HN       GLY   3  12.898  -0.974   2.605
   12   1HA   GLY   3           HA2      GLY   3  11.276  -3.177   3.020
   13   2HA   GLY   3           HA1      GLY   3  10.256  -2.076   2.101
   14    H    LEU   4           HN       LEU   4  11.119  -4.596   1.155
   15    HA   LEU   4           HA       LEU   4  12.813  -3.782  -1.172
   16   1HB   LEU   4           HB2      LEU   4  12.833  -6.482   0.216
   17   2HB   LEU   4           HB1      LEU   4  13.954  -5.897  -1.012
   18    HG   LEU   4           HG       LEU   4  13.662  -4.460   1.629
   19   1HD1  LEU   4          HD13      LEU   4  14.591  -7.115   1.318
   20   2HD1  LEU   4          HD12      LEU   4  16.024  -6.106   1.507
   21   3HD1  LEU   4          HD11      LEU   4  14.757  -6.078   2.734
   22   1HD2  LEU   4          HD21      LEU   4  15.495  -4.429  -0.723
   23   2HD2  LEU   4          HD23      LEU   4  14.966  -3.097   0.306
   24   3HD2  LEU   4          HD22      LEU   4  16.232  -4.190   0.860
   25    H    CYS   5           HN       CYS   5  12.459  -5.764  -2.958
   26    HA   CYS   5           HA       CYS   5   9.584  -6.631  -2.811
   27   1HB   CYS   5           HB2      CYS   5   9.838  -4.385  -3.971
   28   2HB   CYS   5           HB1      CYS   5  10.749  -5.219  -5.228
   29    H    TYR   6           HN       TYR   6   9.072  -8.423  -4.041
   30    HA   TYR   6           HA       TYR   6  11.243  -9.698  -5.643
   31   1HB   TYR   6           HB2      TYR   6  11.092 -11.751  -4.412
   32   2HB   TYR   6           HB1      TYR   6  11.229 -10.475  -3.219
   33    HD1  TYR   6           HD1      TYR   6   9.019 -12.955  -4.763
   34    HD2  TYR   6           HD2      TYR   6   9.378  -9.924  -1.765
   35    HE1  TYR   6           HE1      TYR   6   6.954 -13.800  -3.676
   36    HE2  TYR   6           HE2      TYR   6   7.301 -10.747  -0.672
   37    HH   TYR   6           HH       TYR   6   5.627 -12.215  -0.764
   38    H    GLU   7           HN       GLU   7  10.250 -11.483  -7.057
   39    HA   GLU   7           HA       GLU   7   7.383 -10.773  -7.645
   40   1HB   GLU   7           HB2      GLU   7   7.993 -10.812  -9.937
   41   2HB   GLU   7           HB1      GLU   7   9.339 -10.003  -9.149
   42   1HG   GLU   7           HG2      GLU   7  10.407 -12.375  -9.078
   43   2HG   GLU   7           HG1      GLU   7   9.129 -12.768 -10.244
   44    H    GLY   8           HN       GLY   8   6.050 -12.417  -8.440
   45   1HA   GLY   8           HA2      GLY   8   6.463 -14.957  -9.199
   46   2HA   GLY   8           HA1      GLY   8   6.756 -15.116  -7.469
   47    H    THR   9           HN       THR   9   4.965 -15.842  -6.412
   48    HA   THR   9           HA       THR   9   2.285 -14.762  -7.075
   49    HB   THR   9           HB       THR   9   3.185 -17.630  -7.201
   50    HG1  THR   9           HG1      THR   9   3.225 -17.352  -9.298
   51   1HG2  THR   9          HG21      THR   9   0.545 -16.496  -6.834
   52   2HG2  THR   9          HG23      THR   9   0.634 -17.345  -8.378
   53   3HG2  THR   9          HG22      THR   9   1.025 -18.192  -6.880
   54    H    ASN  10           HN       ASN  10   4.322 -15.087  -4.606
   55    HA   ASN  10           HA       ASN  10   3.012 -16.949  -2.820
   56   1HB   ASN  10           HB2      ASN  10   5.393 -16.264  -2.838
   57   2HB   ASN  10           HB1      ASN  10   4.914 -14.688  -2.204
   58   1HD2  ASN  10          HD22      ASN  10   4.529 -15.929   1.140
   59   2HD2  ASN  10          HD21      ASN  10   4.479 -14.541   0.104
   60    H    CYS  11           HN       CYS  11   2.131 -13.835  -3.686
   61    HA   CYS  11           HA       CYS  11   0.392 -13.651  -1.249
   62   1HB   CYS  11           HB2      CYS  11   1.976 -11.574  -2.748
   63   2HB   CYS  11           HB1      CYS  11   0.587 -11.094  -1.763
   64    H    GLY  12           HN       GLY  12   0.053 -14.799  -3.970
   65   1HA   GLY  12           HA2      GLY  12  -1.868 -14.960  -5.344
   66   2HA   GLY  12           HA1      GLY  12  -2.603 -13.731  -4.304
   67    H    LYS  13           HN       LYS  13   0.464 -12.877  -5.476
   68    HA   LYS  13           HA       LYS  13  -0.671 -10.739  -7.088
   69   1HB   LYS  13           HB2      LYS  13   1.487  -9.809  -6.882
   70   2HB   LYS  13           HB1      LYS  13   1.148 -10.653  -5.383
   71   1HG   LYS  13           HG2      LYS  13   2.330 -12.673  -6.432
   72   2HG   LYS  13           HG1      LYS  13   2.922 -11.544  -7.637
   73   1HD   LYS  13           HD2      LYS  13   3.565 -10.165  -5.450
   74   2HD   LYS  13           HD1      LYS  13   3.612 -11.783  -4.758
   75   1HE   LYS  13           HE2      LYS  13   4.925 -12.137  -7.160
   76   2HE   LYS  13           HE1      LYS  13   5.472 -10.529  -6.659
   77   1HZ   LYS  13           HZ3      LYS  13   5.311 -12.694  -4.674
   78   2HZ   LYS  13           HZ2      LYS  13   6.649 -12.619  -5.717
   79   3HZ   LYS  13           HZ1      LYS  13   6.301 -11.317  -4.686
   80    H    VAL  14           HN       VAL  14  -1.269 -13.006  -8.318
   81    HA   VAL  14           HA       VAL  14   0.651 -13.954 -10.269
   82    HB   VAL  14           HB       VAL  14  -2.369 -13.955 -10.017
   83   1HG1  VAL  14          HG13      VAL  14  -1.755 -14.012 -12.431
   84   2HG1  VAL  14          HG12      VAL  14  -0.718 -15.403 -12.115
   85   3HG1  VAL  14          HG11      VAL  14  -2.462 -15.536 -11.894
   86   1HG2  VAL  14          HG23      VAL  14  -0.745 -15.374  -8.536
   87   2HG2  VAL  14          HG22      VAL  14  -2.144 -16.164  -9.259
   88   3HG2  VAL  14          HG21      VAL  14  -0.552 -16.358  -9.990
   89    H    GLY  15           HN       GLY  15   1.569 -12.465 -11.700
   90   1HA   GLY  15           HA2      GLY  15   1.249 -11.189 -13.783
   91   2HA   GLY  15           HA1      GLY  15  -0.358 -10.729 -13.215
   92    H    LYS  16           HN       LYS  16   0.933 -10.177 -10.432
   93    HA   LYS  16           HA       LYS  16   2.158  -7.547 -11.194
   94   1HB   LYS  16           HB2      LYS  16   0.451  -8.190  -8.796
   95   2HB   LYS  16           HB1      LYS  16   1.040  -6.608  -9.291
   96   1HG   LYS  16           HG2      LYS  16  -0.244  -6.796 -11.404
   97   2HG   LYS  16           HG1      LYS  16  -0.908  -8.330 -10.846
   98   1HD   LYS  16           HD2      LYS  16  -1.201  -6.194  -8.858
   99   2HD   LYS  16           HD1      LYS  16  -2.012  -5.822 -10.379
  100   1HE   LYS  16           HE2      LYS  16  -2.359  -8.573  -9.225
  101   2HE   LYS  16           HE1      LYS  16  -3.283  -7.227  -8.529
  102   1HZ   LYS  16           HZ1      LYS  16  -3.093  -7.725 -11.447
  103   2HZ   LYS  16           HZ3      LYS  16  -4.353  -8.336 -10.492
  104   3HZ   LYS  16           HZ2      LYS  16  -4.141  -6.657 -10.643
  105    H    TYR  17           HN       TYR  17   2.735  -7.164  -8.127
  106    HA   TYR  17           HA       TYR  17   4.740  -9.351  -7.770
  107   1HB   TYR  17           HB2      TYR  17   5.492  -6.417  -7.699
  108   2HB   TYR  17           HB1      TYR  17   6.542  -7.843  -7.648
  109    HD1  TYR  17           HD1      TYR  17   4.280  -5.895  -9.902
  110    HD2  TYR  17           HD2      TYR  17   7.165  -9.025  -9.531
  111    HE1  TYR  17           HE1      TYR  17   4.474  -6.019 -12.374
  112    HE2  TYR  17           HE2      TYR  17   7.380  -9.158 -11.973
  113    HH   TYR  17           HH       TYR  17   5.247  -8.060 -14.057
  114    H    CYS  18           HN       CYS  18   5.939  -8.873  -5.410
  115    HA   CYS  18           HA       CYS  18   3.910  -7.617  -3.587
  116   1HB   CYS  18           HB2      CYS  18   5.171 -10.383  -3.485
  117   2HB   CYS  18           HB1      CYS  18   4.327  -9.667  -2.111
  118    H    CYS  19           HN       CYS  19   4.847  -7.114  -1.441
  119    HA   CYS  19           HA       CYS  19   7.807  -6.974  -1.416
  120   1HB   CYS  19           HB2      CYS  19   7.357  -4.573  -0.478
  121   2HB   CYS  19           HB1      CYS  19   7.179  -4.855  -2.212
  122    H    SER  20           HN       SER  20   8.666  -7.577   0.537
  123    HA   SER  20           HA       SER  20   7.330  -7.053   3.083
  124   1HB   SER  20           HB2      SER  20   7.190  -9.576   3.609
  125   2HB   SER  20           HB1      SER  20   6.037  -8.998   2.405
  126    HG   SER  20           HG       SER  20   8.432 -10.443   2.043
  127    HA   PRO  21           HA       PRO  21  11.705  -7.340   3.739
  128   1HB   PRO  21           HB2      PRO  21  11.788  -6.472   6.336
  129   2HB   PRO  21           HB1      PRO  21  11.574  -5.385   4.946
  130   1HG   PRO  21           HG2      PRO  21   9.541  -6.350   6.897
  131   2HG   PRO  21           HG1      PRO  21   9.621  -4.826   5.990
  132   1HD   PRO  21           HD2      PRO  21   8.026  -7.066   5.395
  133   2HD   PRO  21           HD1      PRO  21   8.347  -5.688   4.314
  134    H    ILE  22           HN       ILE  22   9.370  -9.273   5.069
  135    HA   ILE  22           HA       ILE  22  11.296 -11.322   5.810
  136    HB   ILE  22           HB       ILE  22  11.190  -9.644   7.719
  137   1HG1  ILE  22          HG12      ILE  22  10.273 -12.487   8.332
  138   2HG1  ILE  22          HG11      ILE  22  11.947 -11.939   8.224
  139   1HG2  ILE  22          HG21      ILE  22   8.466  -9.907   7.210
  140   2HG2  ILE  22          HG23      ILE  22   8.701 -10.689   8.772
  141   3HG2  ILE  22          HG22      ILE  22   9.208  -9.017   8.538
  142   1HD1  ILE  22          HD12      ILE  22  11.407 -10.296  10.098
  143   2HD1  ILE  22          HD11      ILE  22   9.885 -11.163  10.302
  144   3HD1  ILE  22          HD13      ILE  22  11.416 -11.998  10.560
  145    H    GLY  23           HN       GLY  23   8.631 -10.609   4.440
  146   1HA   GLY  23           HA2      GLY  23   6.885 -11.974   3.542
  147   2HA   GLY  23           HA1      GLY  23   7.546 -13.292   4.497
  148    H    LYS  24           HN       LYS  24   7.033 -10.539   6.365
  149    HA   LYS  24           HA       LYS  24   4.781 -11.846   7.702
  150   1HB   LYS  24           HB2      LYS  24   5.207 -10.311   9.479
  151   2HB   LYS  24           HB1      LYS  24   6.764 -10.861   8.870
  152   1HG   LYS  24           HG2      LYS  24   6.881  -8.795   7.449
  153   2HG   LYS  24           HG1      LYS  24   5.390  -8.241   8.211
  154   1HD   LYS  24           HD2      LYS  24   7.770  -9.039   9.876
  155   2HD   LYS  24           HD1      LYS  24   7.639  -7.413   9.205
  156   1HE   LYS  24           HE2      LYS  24   6.203  -6.828  10.856
  157   2HE   LYS  24           HE1      LYS  24   5.119  -8.163  10.414
  158   1HZ   LYS  24           HZ3      LYS  24   7.630  -8.556  11.944
  159   2HZ   LYS  24           HZ2      LYS  24   6.122  -8.324  12.695
  160   3HZ   LYS  24           HZ1      LYS  24   6.380  -9.676  11.699
  161    H    TYR  25           HN       TYR  25   5.360  -8.897   5.831
  162    HA   TYR  25           HA       TYR  25   2.643  -7.898   6.313
  163   1HB   TYR  25           HB2      TYR  25   5.069  -6.996   4.783
  164   2HB   TYR  25           HB1      TYR  25   3.522  -6.167   4.601
  165    HD1  TYR  25           HD2      TYR  25   2.372  -5.245   6.674
  166    HD2  TYR  25           HD1      TYR  25   6.436  -6.622   6.677
  167    HE1  TYR  25           HE2      TYR  25   2.783  -4.007   8.790
  168    HE2  TYR  25           HE1      TYR  25   6.858  -5.374   8.799
  169    HH   TYR  25           HH       TYR  25   5.684  -4.438  10.634
  170    H    CYS  26           HN       CYS  26   4.451  -9.197   3.498
  171    HA   CYS  26           HA       CYS  26   3.639  -9.921   1.372
  172   1HB   CYS  26           HB2      CYS  26   2.746 -11.713   2.780
  173   2HB   CYS  26           HB1      CYS  26   1.403 -10.694   3.312
  174    H    VAL  27           HN       VAL  27   3.453  -7.399   1.025
  175    HA   VAL  27           HA       VAL  27   0.572  -6.642   0.557
  176    HB   VAL  27           HB       VAL  27   3.080  -4.976   0.984
  177   1HG1  VAL  27          HG12      VAL  27   0.794  -4.273  -0.395
  178   2HG1  VAL  27          HG11      VAL  27   0.448  -3.701   1.236
  179   3HG1  VAL  27          HG13      VAL  27   1.893  -3.140   0.394
  180   1HG2  VAL  27          HG23      VAL  27   1.876  -6.317   2.920
  181   2HG2  VAL  27          HG22      VAL  27   2.376  -4.647   3.180
  182   3HG2  VAL  27          HG21      VAL  27   0.693  -5.015   2.801
  183    H    CYS  28           HN       CYS  28   0.089  -6.811  -1.625
  184    HA   CYS  28           HA       CYS  28   2.364  -6.451  -3.546
  185   1HB   CYS  28           HB2      CYS  28  -0.231  -7.962  -3.886
  186   2HB   CYS  28           HB1      CYS  28   1.214  -8.107  -4.883
  187    H    TYR  29           HN       TYR  29   1.850  -5.621  -5.656
  188    HA   TYR  29           HA       TYR  29  -0.583  -3.942  -5.902
  189   1HB   TYR  29           HB2      TYR  29   2.272  -3.038  -6.143
  190   2HB   TYR  29           HB1      TYR  29   0.868  -2.084  -6.566
  191    HD1  TYR  29           HD1      TYR  29   2.585  -3.794  -3.809
  192    HD2  TYR  29           HD2      TYR  29  -0.341  -0.904  -4.956
  193    HE1  TYR  29           HE1      TYR  29   2.478  -2.991  -1.475
  194    HE2  TYR  29           HE2      TYR  29  -0.471  -0.083  -2.630
  195    HH   TYR  29           HH       TYR  29   1.533  -0.301  -0.488
  196    H    ASP  30           HN       ASP  30  -0.475  -2.934  -8.258
  197    HA   ASP  30           HA       ASP  30   0.205  -5.085 -10.100
  198   1HB   ASP  30           HB2      ASP  30  -1.078  -3.881 -11.632
  199   2HB   ASP  30           HB1      ASP  30  -1.856  -3.603 -10.076
  200    H    SER  31           HN       SER  31   1.365  -1.768  -9.538
  201    HA   SER  31           HA       SER  31   3.364  -2.002 -11.707
  202   1HB   SER  31           HB2      SER  31   3.316   0.051  -9.553
  203   2HB   SER  31           HB1      SER  31   3.850   0.224 -11.217
  204    HG   SER  31           HG       SER  31   1.653   1.041 -10.541
  205    H    LYS  32           HN       LYS  32   5.246  -3.325 -11.315
  206    HA   LYS  32           HA       LYS  32   5.986  -4.335  -8.780
  207   1HB   LYS  32           HB2      LYS  32   8.059  -4.948  -9.875
  208   2HB   LYS  32           HB1      LYS  32   6.895  -4.820 -11.201
  209   1HG   LYS  32           HG2      LYS  32   7.732  -2.678 -11.863
  210   2HG   LYS  32           HG1      LYS  32   8.678  -2.517 -10.384
  211   1HD   LYS  32           HD2      LYS  32  10.252  -3.176 -12.082
  212   2HD   LYS  32           HD1      LYS  32   9.935  -4.645 -11.145
  213   1HE   LYS  32           HE2      LYS  32   8.624  -5.608 -12.865
  214   2HE   LYS  32           HE1      LYS  32   8.216  -4.028 -13.566
  215   1HZ   LYS  32           HZ1      LYS  32  11.006  -5.016 -13.438
  216   2HZ   LYS  32           HZ3      LYS  32   9.995  -5.364 -14.755
  217   3HZ   LYS  32           HZ2      LYS  32  10.379  -3.752 -14.384
  218    H    ALA  33           HN       ALA  33   6.675  -1.216 -10.314
  219    HA   ALA  33           HA       ALA  33   8.461  -0.110  -8.420
  220   1HB   ALA  33           HB3      ALA  33   7.729   0.746 -10.725
  221   2HB   ALA  33           HB2      ALA  33   6.224   1.260  -9.959
  222   3HB   ALA  33           HB1      ALA  33   7.757   1.977  -9.459
  223    H    ILE  34           HN       ILE  34   4.804  -0.069  -8.563
  224    HA   ILE  34           HA       ILE  34   4.454   1.474  -6.247
  225    HB   ILE  34           HB       ILE  34   2.977  -0.610  -7.723
  226   1HG1  ILE  34          HG12      ILE  34   2.850   2.380  -7.359
  227   2HG1  ILE  34          HG11      ILE  34   2.993   1.460  -8.853
  228   1HG2  ILE  34          HG22      ILE  34   2.399  -0.640  -5.212
  229   2HG2  ILE  34          HG21      ILE  34   1.805   1.001  -5.436
  230   3HG2  ILE  34          HG23      ILE  34   1.049  -0.331  -6.301
  231   1HD1  ILE  34          HD12      ILE  34   0.702   0.479  -8.260
  232   2HD1  ILE  34          HD11      ILE  34   0.592   1.777  -7.072
  233   3HD1  ILE  34          HD13      ILE  34   0.732   2.162  -8.789
  234    H    CYS  35           HN       CYS  35   5.357  -1.760  -6.710
  235    HA   CYS  35           HA       CYS  35   4.819  -2.848  -4.092
  236   1HB   CYS  35           HB2      CYS  35   5.486  -4.282  -5.985
  237   2HB   CYS  35           HB1      CYS  35   7.039  -3.432  -6.109
  238    H    ASN  36           HN       ASN  36   8.025  -1.818  -5.392
  239    HA   ASN  36           HA       ASN  36   9.275  -1.438  -2.842
  240   1HB   ASN  36           HB2      ASN  36   9.614  -0.015  -5.527
  241   2HB   ASN  36           HB1      ASN  36  10.775   0.088  -4.196
  242   1HD2  ASN  36          HD22      ASN  36  12.365  -2.830  -5.370
  243   2HD2  ASN  36          HD21      ASN  36  12.521  -1.249  -4.772
  244    H    LYS  37           HN       LYS  37   7.735   1.038  -4.880
  245    HA   LYS  37           HA       LYS  37   7.999   3.253  -3.167
  246   1HB   LYS  37           HB2      LYS  37   7.515   3.066  -5.640
  247   2HB   LYS  37           HB1      LYS  37   5.841   2.739  -5.200
  248   1HG   LYS  37           HG2      LYS  37   7.298   5.186  -4.185
  249   2HG   LYS  37           HG1      LYS  37   6.456   5.190  -5.734
  250   1HD   LYS  37           HD2      LYS  37   4.503   4.148  -4.212
  251   2HD   LYS  37           HD1      LYS  37   5.343   5.075  -2.971
  252   1HE   LYS  37           HE2      LYS  37   4.502   6.268  -5.639
  253   2HE   LYS  37           HE1      LYS  37   3.519   6.376  -4.164
  254   1HZ   LYS  37           HZ2      LYS  37   6.376   7.177  -4.306
  255   2HZ   LYS  37           HZ1      LYS  37   5.085   8.270  -4.470
  256   3HZ   LYS  37           HZ3      LYS  37   5.302   7.427  -3.014
  257    H    ASN  38           HN       ASN  38   4.727   2.144  -4.015
  258    HA   ASN  38           HA       ASN  38   3.451   3.305  -1.853
  259   1HB   ASN  38           HB2      ASN  38   2.925   1.250  -3.878
  260   2HB   ASN  38           HB1      ASN  38   1.685   1.639  -2.682
  261   1HD2  ASN  38          HD22      ASN  38   2.433   4.151  -5.760
  262   2HD2  ASN  38          HD21      ASN  38   3.262   2.678  -5.568
  263    H    CYS  39           HN       CYS  39   4.862   0.158  -2.167
  264    HA   CYS  39           HA       CYS  39   3.520  -1.305  -0.182
  265   1HB   CYS  39           HB2      CYS  39   6.447  -1.114  -0.851
  266   2HB   CYS  39           HB1      CYS  39   5.823  -2.312   0.286
  267    H    THR  40           HN       THR  40   5.830   1.311   0.326
  268    HA   THR  40           HA       THR  40   6.046   0.872   3.211
  269    HB   THR  40           HB       THR  40   7.103   3.236   2.997
  270    HG1  THR  40           HG1      THR  40   7.307   4.026   1.012
  271   1HG2  THR  40          HG21      THR  40   8.207   0.920   1.344
  272   2HG2  THR  40          HG23      THR  40   9.142   2.308   1.907
  273   3HG2  THR  40          HG22      THR  40   8.464   1.171   3.072
   
  No H/Q in entry =         273
  Start of MODEL    4
    1   1H    ASP   1           HT3      ASP   1  11.353   4.462   6.210
    2   2H    ASP   1           HT2      ASP   1   9.926   5.212   5.675
    3   3H    ASP   1           HT1      ASP   1  10.113   4.805   7.314
    4    HA   ASP   1           HA       ASP   1  10.047   2.463   6.812
    5   1HB   ASP   1           HB2      ASP   1   8.016   4.173   6.920
    6   2HB   ASP   1           HB1      ASP   1   7.808   3.690   5.237
    7    H    ASP   2           HN       ASP   2  10.977   1.073   5.369
    8    HA   ASP   2           HA       ASP   2  10.387   1.325   2.472
    9   1HB   ASP   2           HB2      ASP   2  13.087   1.754   3.824
   10   2HB   ASP   2           HB1      ASP   2  12.999   1.209   2.141
   11    H    GLY   3           HN       GLY   3  12.289  -0.503   1.545
   12   1HA   GLY   3           HA2      GLY   3  12.918  -2.751   3.035
   13   2HA   GLY   3           HA1      GLY   3  11.244  -3.014   2.568
   14    H    LEU   4           HN       LEU   4  11.711  -4.746   1.174
   15    HA   LEU   4           HA       LEU   4  13.139  -4.010  -1.353
   16   1HB   LEU   4           HB2      LEU   4  13.195  -6.736  -0.033
   17   2HB   LEU   4           HB1      LEU   4  14.231  -6.131  -1.320
   18    HG   LEU   4           HG       LEU   4  14.209  -4.815   1.399
   19   1HD1  LEU   4          HD12      LEU   4  15.333  -7.426   0.608
   20   2HD1  LEU   4          HD11      LEU   4  16.482  -6.336   1.384
   21   3HD1  LEU   4          HD13      LEU   4  14.992  -6.783   2.215
   22   1HD2  LEU   4          HD23      LEU   4  15.846  -4.735  -1.093
   23   2HD2  LEU   4          HD22      LEU   4  15.448  -3.434   0.030
   24   3HD2  LEU   4          HD21      LEU   4  16.715  -4.591   0.435
   25    H    CYS   5           HN       CYS   5  12.537  -5.956  -3.068
   26    HA   CYS   5           HA       CYS   5   9.683  -6.792  -2.647
   27   1HB   CYS   5           HB2      CYS   5   9.845  -4.539  -3.835
   28   2HB   CYS   5           HB1      CYS   5  10.619  -5.389  -5.171
   29    H    TYR   6           HN       TYR   6   9.040  -8.546  -3.954
   30    HA   TYR   6           HA       TYR   6  11.189  -9.870  -5.568
   31   1HB   TYR   6           HB2      TYR   6  10.885 -11.942  -4.369
   32   2HB   TYR   6           HB1      TYR   6  11.113 -10.682  -3.171
   33    HD1  TYR   6           HD1      TYR   6   8.691 -12.929  -4.773
   34    HD2  TYR   6           HD2      TYR   6   9.340 -10.054  -1.674
   35    HE1  TYR   6           HE1      TYR   6   6.559 -13.608  -3.711
   36    HE2  TYR   6           HE2      TYR   6   7.194 -10.711  -0.603
   37    HH   TYR   6           HH       TYR   6   5.063 -11.779  -1.266
   38    H    GLU   7           HN       GLU   7  10.173 -11.623  -7.009
   39    HA   GLU   7           HA       GLU   7   7.346 -10.826  -7.663
   40   1HB   GLU   7           HB2      GLU   7   7.998 -10.888  -9.941
   41   2HB   GLU   7           HB1      GLU   7   9.353 -10.120  -9.129
   42   1HG   GLU   7           HG2      GLU   7  10.342 -12.525  -9.029
   43   2HG   GLU   7           HG1      GLU   7   9.075 -12.881 -10.219
   44    H    GLY   8           HN       GLY   8   5.945 -12.442  -8.376
   45   1HA   GLY   8           HA2      GLY   8   6.291 -14.982  -9.177
   46   2HA   GLY   8           HA1      GLY   8   6.626 -15.169  -7.459
   47    H    THR   9           HN       THR   9   4.849 -15.827  -6.326
   48    HA   THR   9           HA       THR   9   2.172 -14.727  -6.962
   49    HB   THR   9           HB       THR   9   3.031 -17.604  -7.043
   50    HG1  THR   9           HG1      THR   9   3.337 -17.183  -9.057
   51   1HG2  THR   9          HG22      THR   9   0.410 -16.425  -6.658
   52   2HG2  THR   9          HG21      THR   9   0.463 -17.326  -8.173
   53   3HG2  THR   9          HG23      THR   9   0.871 -18.126  -6.655
   54    H    ASN  10           HN       ASN  10   4.256 -15.059  -4.509
   55    HA   ASN  10           HA       ASN  10   2.911 -16.846  -2.668
   56   1HB   ASN  10           HB2      ASN  10   5.317 -16.186  -2.742
   57   2HB   ASN  10           HB1      ASN  10   4.852 -14.622  -2.073
   58   1HD2  ASN  10          HD22      ASN  10   4.513 -15.923   1.252
   59   2HD2  ASN  10          HD21      ASN  10   4.459 -14.515   0.242
   60    H    CYS  11           HN       CYS  11   2.182 -13.682  -3.559
   61    HA   CYS  11           HA       CYS  11   0.431 -13.416  -1.140
   62   1HB   CYS  11           HB2      CYS  11   2.108 -11.417  -2.646
   63   2HB   CYS  11           HB1      CYS  11   0.743 -10.874  -1.659
   64    H    GLY  12           HN       GLY  12   0.056 -14.575  -3.839
   65   1HA   GLY  12           HA2      GLY  12  -1.868 -14.685  -5.209
   66   2HA   GLY  12           HA1      GLY  12  -2.547 -13.393  -4.211
   67    H    LYS  13           HN       LYS  13   0.562 -12.718  -5.412
   68    HA   LYS  13           HA       LYS  13  -0.484 -10.588  -7.090
   69   1HB   LYS  13           HB2      LYS  13   1.718  -9.760  -6.934
   70   2HB   LYS  13           HB1      LYS  13   1.351 -10.535  -5.406
   71   1HG   LYS  13           HG2      LYS  13   2.438 -12.643  -6.399
   72   2HG   LYS  13           HG1      LYS  13   3.081 -11.570  -7.632
   73   1HD   LYS  13           HD2      LYS  13   4.436 -10.449  -6.137
   74   2HD   LYS  13           HD1      LYS  13   3.391 -10.822  -4.774
   75   1HE   LYS  13           HE2      LYS  13   4.650 -12.623  -4.260
   76   2HE   LYS  13           HE1      LYS  13   4.412 -13.277  -5.892
   77   1HZ   LYS  13           HZ1      LYS  13   6.068 -11.573  -6.641
   78   2HZ   LYS  13           HZ3      LYS  13   6.436 -11.299  -5.011
   79   3HZ   LYS  13           HZ2      LYS  13   6.709 -12.830  -5.697
   80    H    VAL  14           HN       VAL  14  -1.238 -12.819  -8.251
   81    HA   VAL  14           HA       VAL  14   0.592 -13.982 -10.173
   82    HB   VAL  14           HB       VAL  14  -2.417 -13.732  -9.918
   83   1HG1  VAL  14          HG13      VAL  14  -0.867 -15.338 -11.980
   84   2HG1  VAL  14          HG12      VAL  14  -2.611 -15.410 -11.727
   85   3HG1  VAL  14          HG11      VAL  14  -1.867 -13.924 -12.319
   86   1HG2  VAL  14          HG21      VAL  14  -0.793 -15.249  -8.444
   87   2HG2  VAL  14          HG23      VAL  14  -2.366 -15.845  -8.974
   88   3HG2  VAL  14          HG22      VAL  14  -0.908 -16.317  -9.844
   89    H    GLY  15           HN       GLY  15   1.638 -12.574 -11.602
   90   1HA   GLY  15           HA2      GLY  15   1.463 -11.359 -13.733
   91   2HA   GLY  15           HA1      GLY  15  -0.151 -10.822 -13.257
   92    H    LYS  16           HN       LYS  16   1.053 -10.218 -10.441
   93    HA   LYS  16           HA       LYS  16   2.365  -7.642 -11.241
   94   1HB   LYS  16           HB2      LYS  16   0.566  -8.182  -8.887
   95   2HB   LYS  16           HB1      LYS  16   1.215  -6.628  -9.394
   96   1HG   LYS  16           HG2      LYS  16  -0.023  -6.736 -11.492
   97   2HG   LYS  16           HG1      LYS  16  -0.650  -8.328 -11.068
   98   1HD   LYS  16           HD2      LYS  16  -1.087  -5.966  -9.242
   99   2HD   LYS  16           HD1      LYS  16  -2.160  -6.261 -10.611
  100   1HE   LYS  16           HE2      LYS  16  -3.116  -8.097  -9.627
  101   2HE   LYS  16           HE1      LYS  16  -1.582  -8.631  -8.910
  102   1HZ   LYS  16           HZ2      LYS  16  -1.716  -6.750  -7.369
  103   2HZ   LYS  16           HZ1      LYS  16  -3.230  -6.325  -8.012
  104   3HZ   LYS  16           HZ3      LYS  16  -3.043  -7.795  -7.188
  105    H    TYR  17           HN       TYR  17   2.830  -7.200  -8.146
  106    HA   TYR  17           HA       TYR  17   4.798  -9.399  -7.691
  107   1HB   TYR  17           HB2      TYR  17   5.611  -6.487  -7.612
  108   2HB   TYR  17           HB1      TYR  17   6.622  -7.940  -7.591
  109    HD1  TYR  17           HD1      TYR  17   4.426  -5.872  -9.800
  110    HD2  TYR  17           HD2      TYR  17   7.205  -9.103  -9.503
  111    HE1  TYR  17           HE1      TYR  17   4.626  -5.941 -12.275
  112    HE2  TYR  17           HE2      TYR  17   7.425  -9.180 -11.944
  113    HH   TYR  17           HH       TYR  17   7.069  -7.425 -13.878
  114    H    CYS  18           HN       CYS  18   5.957  -8.870  -5.330
  115    HA   CYS  18           HA       CYS  18   3.912  -7.571  -3.557
  116   1HB   CYS  18           HB2      CYS  18   5.186 -10.326  -3.374
  117   2HB   CYS  18           HB1      CYS  18   4.316  -9.582  -2.031
  118    H    CYS  19           HN       CYS  19   4.827  -7.065  -1.397
  119    HA   CYS  19           HA       CYS  19   7.783  -6.832  -1.395
  120   1HB   CYS  19           HB2      CYS  19   7.252  -4.519  -0.299
  121   2HB   CYS  19           HB1      CYS  19   7.049  -4.698  -2.044
  122    H    SER  20           HN       SER  20   8.653  -7.694   0.432
  123    HA   SER  20           HA       SER  20   7.510  -7.289   3.084
  124   1HB   SER  20           HB2      SER  20   7.112  -9.768   3.469
  125   2HB   SER  20           HB1      SER  20   6.043  -9.085   2.241
  126    HG   SER  20           HG       SER  20   7.002 -11.029   1.539
  127    HA   PRO  21           HA       PRO  21  11.905  -7.989   3.342
  128   1HB   PRO  21           HB2      PRO  21  12.287  -7.080   5.899
  129   2HB   PRO  21           HB1      PRO  21  12.085  -6.004   4.500
  130   1HG   PRO  21           HG2      PRO  21  10.121  -6.690   6.630
  131   2HG   PRO  21           HG1      PRO  21  10.296  -5.207   5.668
  132   1HD   PRO  21           HD2      PRO  21   8.426  -7.277   5.273
  133   2HD   PRO  21           HD1      PRO  21   8.795  -5.961   4.132
  134    H    ILE  22           HN       ILE  22   9.468  -9.618   4.852
  135    HA   ILE  22           HA       ILE  22  11.187 -11.870   5.543
  136    HB   ILE  22           HB       ILE  22  11.223 -10.087   7.438
  137   1HG1  ILE  22          HG12      ILE  22  10.413 -12.969   8.026
  138   2HG1  ILE  22          HG11      ILE  22  12.060 -12.345   7.913
  139   1HG2  ILE  22          HG22      ILE  22   8.712  -9.812   7.173
  140   2HG2  ILE  22          HG21      ILE  22   8.547 -11.348   8.017
  141   3HG2  ILE  22          HG23      ILE  22   9.292  -9.976   8.834
  142   1HD1  ILE  22          HD11      ILE  22  11.155 -10.687   9.813
  143   2HD1  ILE  22          HD13      ILE  22  10.063 -12.040  10.114
  144   3HD1  ILE  22          HD12      ILE  22  11.809 -12.278  10.204
  145    H    GLY  23           HN       GLY  23   8.574 -10.863   4.258
  146   1HA   GLY  23           HA2      GLY  23   6.640 -12.019   3.465
  147   2HA   GLY  23           HA1      GLY  23   7.165 -13.386   4.436
  148    H    LYS  24           HN       LYS  24   7.086 -10.497   6.200
  149    HA   LYS  24           HA       LYS  24   4.780 -11.461   7.723
  150   1HB   LYS  24           HB2      LYS  24   5.436  -9.840   9.349
  151   2HB   LYS  24           HB1      LYS  24   6.904 -10.577   8.722
  152   1HG   LYS  24           HG2      LYS  24   7.073  -8.640   7.094
  153   2HG   LYS  24           HG1      LYS  24   5.735  -7.889   7.957
  154   1HD   LYS  24           HD2      LYS  24   8.562  -8.293   8.827
  155   2HD   LYS  24           HD1      LYS  24   7.498  -6.918   9.085
  156   1HE   LYS  24           HE2      LYS  24   6.165  -8.398  10.689
  157   2HE   LYS  24           HE1      LYS  24   7.512  -9.548  10.590
  158   1HZ   LYS  24           HZ2      LYS  24   9.025  -7.701  11.138
  159   2HZ   LYS  24           HZ1      LYS  24   7.682  -6.685  11.373
  160   3HZ   LYS  24           HZ3      LYS  24   7.920  -8.023  12.389
  161    H    TYR  25           HN       TYR  25   5.568  -8.732   5.620
  162    HA   TYR  25           HA       TYR  25   2.994  -7.408   6.096
  163   1HB   TYR  25           HB2      TYR  25   5.427  -6.930   4.395
  164   2HB   TYR  25           HB1      TYR  25   3.971  -5.957   4.187
  165    HD1  TYR  25           HD1      TYR  25   3.063  -4.650   6.125
  166    HD2  TYR  25           HD2      TYR  25   6.889  -6.588   6.254
  167    HE1  TYR  25           HE1      TYR  25   3.705  -3.239   8.070
  168    HE2  TYR  25           HE2      TYR  25   7.542  -5.172   8.203
  169    HH   TYR  25           HH       TYR  25   6.899  -2.984   9.170
  170    H    CYS  26           HN       CYS  26   4.539  -9.132   3.357
  171    HA   CYS  26           HA       CYS  26   3.583  -9.890   1.302
  172   1HB   CYS  26           HB2      CYS  26   2.725 -11.493   3.011
  173   2HB   CYS  26           HB1      CYS  26   1.340 -10.437   3.313
  174    H    VAL  27           HN       VAL  27   3.456  -7.300   0.994
  175    HA   VAL  27           HA       VAL  27   0.572  -6.563   0.511
  176    HB   VAL  27           HB       VAL  27   3.061  -4.865   0.921
  177   1HG1  VAL  27          HG11      VAL  27   0.758  -4.199  -0.436
  178   2HG1  VAL  27          HG13      VAL  27   0.397  -3.652   1.200
  179   3HG1  VAL  27          HG12      VAL  27   1.827  -3.045   0.364
  180   1HG2  VAL  27          HG23      VAL  27   1.773  -6.248   2.847
  181   2HG2  VAL  27          HG22      VAL  27   2.466  -4.652   3.132
  182   3HG2  VAL  27          HG21      VAL  27   0.744  -4.817   2.792
  183    H    CYS  28           HN       CYS  28   0.098  -6.765  -1.667
  184    HA   CYS  28           HA       CYS  28   2.371  -6.409  -3.588
  185   1HB   CYS  28           HB2      CYS  28  -0.213  -7.937  -3.923
  186   2HB   CYS  28           HB1      CYS  28   1.250  -8.102  -4.891
  187    H    TYR  29           HN       TYR  29   1.877  -5.610  -5.702
  188    HA   TYR  29           HA       TYR  29  -0.578  -3.979  -6.029
  189   1HB   TYR  29           HB2      TYR  29   2.263  -3.011  -6.176
  190   2HB   TYR  29           HB1      TYR  29   0.852  -2.090  -6.650
  191    HD1  TYR  29           HD1      TYR  29   2.521  -3.752  -3.838
  192    HD2  TYR  29           HD2      TYR  29  -0.438  -0.938  -5.081
  193    HE1  TYR  29           HE1      TYR  29   2.326  -2.946  -1.513
  194    HE2  TYR  29           HE2      TYR  29  -0.660  -0.116  -2.762
  195    HH   TYR  29           HH       TYR  29   0.098  -1.618  -0.203
  196    H    ASP  30           HN       ASP  30  -0.366  -2.947  -8.388
  197    HA   ASP  30           HA       ASP  30   0.390  -5.098 -10.201
  198   1HB   ASP  30           HB2      ASP  30  -0.811  -3.881 -11.792
  199   2HB   ASP  30           HB1      ASP  30  -1.665  -3.612 -10.275
  200    H    SER  31           HN       SER  31   1.524  -1.781  -9.582
  201    HA   SER  31           HA       SER  31   3.636  -2.011 -11.640
  202   1HB   SER  31           HB2      SER  31   3.461   0.044  -9.493
  203   2HB   SER  31           HB1      SER  31   4.085   0.219 -11.126
  204    HG   SER  31           HG       SER  31   2.087   1.091 -11.198
  205    H    LYS  32           HN       LYS  32   5.491  -3.338 -11.140
  206    HA   LYS  32           HA       LYS  32   6.080  -4.325  -8.555
  207   1HB   LYS  32           HB2      LYS  32   8.197  -4.981  -9.528
  208   2HB   LYS  32           HB1      LYS  32   7.102  -4.871 -10.910
  209   1HG   LYS  32           HG2      LYS  32   8.027  -2.818 -11.635
  210   2HG   LYS  32           HG1      LYS  32   8.815  -2.527 -10.084
  211   1HD   LYS  32           HD2      LYS  32  10.596  -3.287 -11.475
  212   2HD   LYS  32           HD1      LYS  32  10.118  -4.743 -10.586
  213   1HE   LYS  32           HE2      LYS  32   8.752  -5.515 -12.485
  214   2HE   LYS  32           HE1      LYS  32   9.077  -4.007 -13.366
  215   1HZ   LYS  32           HZ2      LYS  32  11.143  -5.922 -12.412
  216   2HZ   LYS  32           HZ1      LYS  32  10.624  -5.759 -14.021
  217   3HZ   LYS  32           HZ3      LYS  32  11.441  -4.481 -13.260
  218    H    ALA  33           HN       ALA  33   6.867  -1.227 -10.085
  219    HA   ALA  33           HA       ALA  33   8.571  -0.120  -8.117
  220   1HB   ALA  33           HB3      ALA  33   7.964   0.738 -10.450
  221   2HB   ALA  33           HB2      ALA  33   6.413   1.242  -9.773
  222   3HB   ALA  33           HB1      ALA  33   7.909   1.973  -9.188
  223    H    ILE  34           HN       ILE  34   4.926  -0.087  -8.423
  224    HA   ILE  34           HA       ILE  34   4.471   1.464  -6.131
  225    HB   ILE  34           HB       ILE  34   3.060  -0.621  -7.670
  226   1HG1  ILE  34          HG12      ILE  34   2.922   2.370  -7.316
  227   2HG1  ILE  34          HG11      ILE  34   3.135   1.449  -8.800
  228   1HG2  ILE  34          HG22      ILE  34   2.369  -0.647  -5.187
  229   2HG2  ILE  34          HG21      ILE  34   1.794   0.998  -5.437
  230   3HG2  ILE  34          HG23      ILE  34   1.070  -0.331  -6.334
  231   1HD1  ILE  34          HD11      ILE  34   0.820   0.486  -8.363
  232   2HD1  ILE  34          HD13      ILE  34   0.649   1.728  -7.126
  233   3HD1  ILE  34          HD12      ILE  34   0.871   2.191  -8.814
  234    H    CYS  35           HN       CYS  35   5.406  -1.770  -6.543
  235    HA   CYS  35           HA       CYS  35   4.744  -2.857  -3.953
  236   1HB   CYS  35           HB2      CYS  35   5.516  -4.313  -5.776
  237   2HB   CYS  35           HB1      CYS  35   7.053  -3.432  -5.867
  238    H    ASN  36           HN       ASN  36   8.001  -1.818  -5.092
  239    HA   ASN  36           HA       ASN  36   9.120  -1.422  -2.483
  240   1HB   ASN  36           HB2      ASN  36   9.589  -0.060  -5.178
  241   2HB   ASN  36           HB1      ASN  36  10.657   0.146  -3.782
  242   1HD2  ASN  36          HD22      ASN  36  12.298  -2.929  -4.308
  243   2HD2  ASN  36          HD21      ASN  36  12.258  -1.448  -3.481
  244    H    LYS  37           HN       LYS  37   7.688   1.042  -4.612
  245    HA   LYS  37           HA       LYS  37   7.866   3.265  -2.902
  246   1HB   LYS  37           HB2      LYS  37   7.491   3.062  -5.394
  247   2HB   LYS  37           HB1      LYS  37   5.798   2.741  -5.024
  248   1HG   LYS  37           HG2      LYS  37   7.214   5.190  -3.958
  249   2HG   LYS  37           HG1      LYS  37   6.442   5.188  -5.542
  250   1HD   LYS  37           HD2      LYS  37   4.412   4.170  -4.127
  251   2HD   LYS  37           HD1      LYS  37   5.203   5.059  -2.829
  252   1HE   LYS  37           HE2      LYS  37   4.508   6.318  -5.509
  253   2HE   LYS  37           HE1      LYS  37   3.457   6.412  -4.080
  254   1HZ   LYS  37           HZ3      LYS  37   6.331   7.146  -4.016
  255   2HZ   LYS  37           HZ2      LYS  37   5.102   8.279  -4.318
  256   3HZ   LYS  37           HZ1      LYS  37   5.154   7.453  -2.834
  257    H    ASN  38           HN       ASN  38   4.634   2.137  -3.885
  258    HA   ASN  38           HA       ASN  38   3.263   3.322  -1.797
  259   1HB   ASN  38           HB2      ASN  38   2.834   1.226  -3.807
  260   2HB   ASN  38           HB1      ASN  38   1.544   1.630  -2.670
  261   1HD2  ASN  38          HD22      ASN  38   2.406   4.088  -5.761
  262   2HD2  ASN  38          HD21      ASN  38   3.233   2.623  -5.506
  263    H    CYS  39           HN       CYS  39   4.702   0.180  -2.007
  264    HA   CYS  39           HA       CYS  39   3.286  -1.251  -0.043
  265   1HB   CYS  39           HB2      CYS  39   6.226  -1.095  -0.647
  266   2HB   CYS  39           HB1      CYS  39   5.572  -2.263   0.505
  267    H    THR  40           HN       THR  40   5.534   1.404   0.493
  268    HA   THR  40           HA       THR  40   5.751   0.975   3.377
  269    HB   THR  40           HB       THR  40   6.721   3.375   3.163
  270    HG1  THR  40           HG1      THR  40   7.066   4.050   1.077
  271   1HG2  THR  40          HG23      THR  40   7.798   0.914   1.759
  272   2HG2  THR  40          HG22      THR  40   8.709   2.426   1.749
  273   3HG2  THR  40          HG21      THR  40   8.327   1.640   3.280
   
  No H/Q in entry =         273
  Start of MODEL    5
    1   1H    ASP   1           HT2      ASP   1  10.979   3.896   7.340
    2   2H    ASP   1           HT1      ASP   1   9.379   4.244   7.794
    3   3H    ASP   1           HT3      ASP   1  10.583   4.090   8.981
    4    HA   ASP   1           HA       ASP   1  10.750   1.772   8.699
    5   1HB   ASP   1           HB2      ASP   1   7.918   2.834   8.513
    6   2HB   ASP   1           HB1      ASP   1   8.298   1.166   8.937
    7    H    ASP   2           HN       ASP   2  11.510   2.409   6.157
    8    HA   ASP   2           HA       ASP   2   9.584   1.370   4.175
    9   1HB   ASP   2           HB2      ASP   2  12.572   2.081   3.955
   10   2HB   ASP   2           HB1      ASP   2  11.447   1.905   2.603
   11    H    GLY   3           HN       GLY   3  11.169  -0.182   2.526
   12   1HA   GLY   3           HA2      GLY   3  12.657  -2.202   3.939
   13   2HA   GLY   3           HA1      GLY   3  11.031  -2.766   3.592
   14    H    LEU   4           HN       LEU   4  11.318  -4.207   1.943
   15    HA   LEU   4           HA       LEU   4  12.692  -3.228  -0.533
   16   1HB   LEU   4           HB2      LEU   4  12.779  -6.070   0.516
   17   2HB   LEU   4           HB1      LEU   4  13.811  -5.327  -0.703
   18    HG   LEU   4           HG       LEU   4  13.783  -4.294   2.138
   19   1HD1  LEU   4          HD13      LEU   4  14.921  -6.808   1.098
   20   2HD1  LEU   4          HD12      LEU   4  16.061  -5.792   1.981
   21   3HD1  LEU   4          HD11      LEU   4  14.570  -6.328   2.759
   22   1HD2  LEU   4          HD21      LEU   4  15.393  -3.935  -0.338
   23   2HD2  LEU   4          HD23      LEU   4  15.032  -2.779   0.946
   24   3HD2  LEU   4          HD22      LEU   4  16.295  -3.987   1.176
   25    H    CYS   5           HN       CYS   5  12.044  -4.979  -2.427
   26    HA   CYS   5           HA       CYS   5   9.264  -6.011  -2.001
   27   1HB   CYS   5           HB2      CYS   5   9.375  -3.521  -2.810
   28   2HB   CYS   5           HB1      CYS   5   9.860  -4.206  -4.354
   29    H    TYR   6           HN       TYR   6   8.780  -7.706  -3.553
   30    HA   TYR   6           HA       TYR   6  10.991  -8.399  -5.453
   31   1HB   TYR   6           HB2      TYR   6  11.110 -10.645  -4.540
   32   2HB   TYR   6           HB1      TYR   6  11.299  -9.500  -3.227
   33    HD1  TYR   6           HD1      TYR   6   8.866 -11.724  -4.935
   34    HD2  TYR   6           HD2      TYR   6   9.819  -9.517  -1.397
   35    HE1  TYR   6           HE1      TYR   6   7.011 -12.858  -3.743
   36    HE2  TYR   6           HE2      TYR   6   7.962 -10.653  -0.185
   37    HH   TYR   6           HH       TYR   6   5.649 -11.803  -1.051
   38    H    GLU   7           HN       GLU   7  10.252 -10.278  -6.941
   39    HA   GLU   7           HA       GLU   7   7.314  -9.958  -7.510
   40   1HB   GLU   7           HB2      GLU   7   7.923  -9.852  -9.804
   41   2HB   GLU   7           HB1      GLU   7   9.140  -8.875  -8.996
   42   1HG   GLU   7           HG2      GLU   7  10.532 -11.076  -8.977
   43   2HG   GLU   7           HG1      GLU   7   9.321 -11.616 -10.155
   44    H    GLY   8           HN       GLY   8   6.231 -11.772  -8.319
   45   1HA   GLY   8           HA2      GLY   8   7.014 -14.189  -9.170
   46   2HA   GLY   8           HA1      GLY   8   7.332 -14.363  -7.447
   47    H    THR   9           HN       THR   9   5.659 -15.385  -6.428
   48    HA   THR   9           HA       THR   9   2.856 -14.656  -7.040
   49    HB   THR   9           HB       THR   9   4.107 -17.380  -7.287
   50    HG1  THR   9           HG1      THR   9   3.096 -15.574  -9.220
   51   1HG2  THR   9          HG21      THR   9   1.391 -16.650  -6.837
   52   2HG2  THR   9          HG23      THR   9   1.516 -17.180  -8.515
   53   3HG2  THR   9          HG22      THR   9   2.031 -18.250  -7.212
   54    H    ASN  10           HN       ASN  10   4.865 -14.707  -4.598
   55    HA   ASN  10           HA       ASN  10   4.023 -16.875  -2.883
   56   1HB   ASN  10           HB2      ASN  10   6.164 -15.628  -2.846
   57   2HB   ASN  10           HB1      ASN  10   5.311 -14.237  -2.174
   58   1HD2  ASN  10          HD22      ASN  10   5.226 -15.637   1.128
   59   2HD2  ASN  10          HD21      ASN  10   4.848 -14.271   0.131
   60    H    CYS  11           HN       CYS  11   2.401 -14.063  -3.670
   61    HA   CYS  11           HA       CYS  11   0.671 -14.348  -1.237
   62   1HB   CYS  11           HB2      CYS  11   1.639 -11.936  -2.760
   63   2HB   CYS  11           HB1      CYS  11   0.164 -11.838  -1.790
   64    H    GLY  12           HN       GLY  12   0.652 -15.527  -4.009
   65   1HA   GLY  12           HA2      GLY  12  -1.153 -16.145  -5.423
   66   2HA   GLY  12           HA1      GLY  12  -2.200 -15.233  -4.323
   67    H    LYS  13           HN       LYS  13   0.514 -13.541  -5.406
   68    HA   LYS  13           HA       LYS  13  -1.100 -11.601  -6.821
   69   1HB   LYS  13           HB2      LYS  13   0.927 -10.304  -6.650
   70   2HB   LYS  13           HB1      LYS  13   0.596 -11.147  -5.148
   71   1HG   LYS  13           HG2      LYS  13   2.255 -12.819  -5.585
   72   2HG   LYS  13           HG1      LYS  13   2.430 -12.278  -7.248
   73   1HD   LYS  13           HD2      LYS  13   2.967  -9.998  -5.885
   74   2HD   LYS  13           HD1      LYS  13   3.574 -11.215  -4.772
   75   1HE   LYS  13           HE2      LYS  13   5.285 -10.400  -6.478
   76   2HE   LYS  13           HE1      LYS  13   5.026 -12.153  -6.475
   77   1HZ   LYS  13           HZ3      LYS  13   3.179 -10.636  -8.121
   78   2HZ   LYS  13           HZ2      LYS  13   4.788 -10.619  -8.664
   79   3HZ   LYS  13           HZ1      LYS  13   3.978 -12.096  -8.453
   80    H    VAL  14           HN       VAL  14  -1.171 -13.822  -8.286
   81    HA   VAL  14           HA       VAL  14   0.876 -14.055 -10.323
   82    HB   VAL  14           HB       VAL  14  -2.052 -14.799 -10.071
   83   1HG1  VAL  14          HG11      VAL  14  -0.209 -15.161 -12.438
   84   2HG1  VAL  14          HG13      VAL  14  -1.546 -16.273 -12.142
   85   3HG1  VAL  14          HG12      VAL  14  -1.867 -14.562 -12.419
   86   1HG2  VAL  14          HG21      VAL  14  -0.059 -15.976  -8.834
   87   2HG2  VAL  14          HG23      VAL  14  -1.294 -16.964  -9.614
   88   3HG2  VAL  14          HG22      VAL  14   0.255 -16.701 -10.412
   89    H    GLY  15           HN       GLY  15   1.370 -12.316 -11.694
   90   1HA   GLY  15           HA2      GLY  15   0.556 -10.976 -13.622
   91   2HA   GLY  15           HA1      GLY  15  -0.994 -10.808 -12.793
   92    H    LYS  16           HN       LYS  16   0.559 -10.229 -10.149
   93    HA   LYS  16           HA       LYS  16   1.436  -7.458 -10.908
   94   1HB   LYS  16           HB2      LYS  16  -0.035  -8.293  -8.418
   95   2HB   LYS  16           HB1      LYS  16   0.368  -6.653  -8.922
   96   1HG   LYS  16           HG2      LYS  16  -1.049  -6.905 -10.922
   97   2HG   LYS  16           HG1      LYS  16  -1.497  -8.529 -10.396
   98   1HD   LYS  16           HD2      LYS  16  -1.890  -6.174  -8.555
   99   2HD   LYS  16           HD1      LYS  16  -3.084  -6.543  -9.800
  100   1HE   LYS  16           HE2      LYS  16  -3.907  -8.280  -8.594
  101   2HE   LYS  16           HE1      LYS  16  -2.281  -8.948  -8.343
  102   1HZ   LYS  16           HZ1      LYS  16  -3.352  -6.582  -6.901
  103   2HZ   LYS  16           HZ3      LYS  16  -3.351  -8.154  -6.265
  104   3HZ   LYS  16           HZ2      LYS  16  -1.880  -7.377  -6.607
  105    H    TYR  17           HN       TYR  17   2.167  -7.056  -7.900
  106    HA   TYR  17           HA       TYR  17   4.415  -9.006  -7.682
  107   1HB   TYR  17           HB2      TYR  17   4.773  -5.988  -7.705
  108   2HB   TYR  17           HB1      TYR  17   6.017  -7.248  -7.588
  109    HD1  TYR  17           HD1      TYR  17   3.490  -5.761  -9.919
  110    HD2  TYR  17           HD2      TYR  17   6.743  -8.481  -9.417
  111    HE1  TYR  17           HE1      TYR  17   3.639  -6.056 -12.379
  112    HE2  TYR  17           HE2      TYR  17   6.918  -8.776 -11.848
  113    HH   TYR  17           HH       TYR  17   4.495  -7.755 -13.985
  114    H    CYS  18           HN       CYS  18   5.586  -8.638  -5.335
  115    HA   CYS  18           HA       CYS  18   3.615  -7.482  -3.390
  116   1HB   CYS  18           HB2      CYS  18   4.769 -10.294  -3.521
  117   2HB   CYS  18           HB1      CYS  18   3.980  -9.646  -2.081
  118    H    CYS  19           HN       CYS  19   4.640  -7.041  -1.290
  119    HA   CYS  19           HA       CYS  19   7.569  -7.339  -1.241
  120   1HB   CYS  19           HB2      CYS  19   7.545  -4.835  -0.471
  121   2HB   CYS  19           HB1      CYS  19   7.362  -5.221  -2.183
  122    H    SER  20           HN       SER  20   8.414  -7.770   0.740
  123    HA   SER  20           HA       SER  20   7.203  -6.935   3.254
  124   1HB   SER  20           HB2      SER  20   6.835  -9.403   3.969
  125   2HB   SER  20           HB1      SER  20   5.680  -8.768   2.793
  126    HG   SER  20           HG       SER  20   6.496 -10.033   1.298
  127    HA   PRO  21           HA       PRO  21  11.520  -7.632   3.892
  128   1HB   PRO  21           HB2      PRO  21  11.713  -6.940   6.537
  129   2HB   PRO  21           HB1      PRO  21  11.544  -5.757   5.222
  130   1HG   PRO  21           HG2      PRO  21   9.486  -6.714   7.156
  131   2HG   PRO  21           HG1      PRO  21   9.657  -5.140   6.354
  132   1HD   PRO  21           HD2      PRO  21   7.894  -7.208   5.643
  133   2HD   PRO  21           HD1      PRO  21   8.307  -5.794   4.641
  134    H    ILE  22           HN       ILE  22   9.117  -9.556   5.037
  135    HA   ILE  22           HA       ILE  22  10.953 -11.722   5.662
  136    HB   ILE  22           HB       ILE  22  10.807 -10.217   7.715
  137   1HG1  ILE  22          HG12      ILE  22   9.859 -13.103   7.983
  138   2HG1  ILE  22          HG11      ILE  22  11.531 -12.541   8.046
  139   1HG2  ILE  22          HG22      ILE  22   8.128 -10.300   7.097
  140   2HG2  ILE  22          HG21      ILE  22   8.238 -11.362   8.499
  141   3HG2  ILE  22          HG23      ILE  22   8.814  -9.699   8.606
  142   1HD1  ILE  22          HD11      ILE  22  10.131 -11.020   9.978
  143   2HD1  ILE  22          HD13      ILE  22   9.593 -12.687  10.183
  144   3HD1  ILE  22          HD12      ILE  22  11.310 -12.297  10.272
  145    H    GLY  23           HN       GLY  23   8.314 -10.770   4.325
  146   1HA   GLY  23           HA2      GLY  23   6.563 -11.985   3.245
  147   2HA   GLY  23           HA1      GLY  23   7.192 -13.422   4.040
  148    H    LYS  24           HN       LYS  24   6.695 -10.929   6.243
  149    HA   LYS  24           HA       LYS  24   4.404 -12.358   7.372
  150   1HB   LYS  24           HB2      LYS  24   4.806 -11.047   9.325
  151   2HB   LYS  24           HB1      LYS  24   6.371 -11.531   8.681
  152   1HG   LYS  24           HG2      LYS  24   6.500  -9.309   7.501
  153   2HG   LYS  24           HG1      LYS  24   5.015  -8.844   8.329
  154   1HD   LYS  24           HD2      LYS  24   7.352  -9.872   9.912
  155   2HD   LYS  24           HD1      LYS  24   7.311  -8.187   9.393
  156   1HE   LYS  24           HE2      LYS  24   4.901  -8.175  10.404
  157   2HE   LYS  24           HE1      LYS  24   5.448  -9.621  11.277
  158   1HZ   LYS  24           HZ1      LYS  24   6.888  -7.022  11.190
  159   2HZ   LYS  24           HZ3      LYS  24   5.971  -7.583  12.503
  160   3HZ   LYS  24           HZ2      LYS  24   7.381  -8.409  12.039
  161    H    TYR  25           HN       TYR  25   5.034  -9.172   5.939
  162    HA   TYR  25           HA       TYR  25   2.307  -8.244   6.491
  163   1HB   TYR  25           HB2      TYR  25   4.758  -7.157   5.128
  164   2HB   TYR  25           HB1      TYR  25   3.215  -6.305   5.034
  165    HD1  TYR  25           HD2      TYR  25   2.031  -5.685   7.215
  166    HD2  TYR  25           HD1      TYR  25   6.110  -7.009   7.053
  167    HE1  TYR  25           HE2      TYR  25   2.423  -4.736   9.478
  168    HE2  TYR  25           HE1      TYR  25   6.512  -6.052   9.323
  169    HH   TYR  25           HH       TYR  25   5.291  -5.403  11.275
  170    H    CYS  26           HN       CYS  26   4.122  -9.403   3.655
  171    HA   CYS  26           HA       CYS  26   3.382  -9.826   1.428
  172   1HB   CYS  26           HB2      CYS  26   2.364 -11.699   2.640
  173   2HB   CYS  26           HB1      CYS  26   1.028 -10.677   3.187
  174    H    VAL  27           HN       VAL  27   3.299  -7.345   1.119
  175    HA   VAL  27           HA       VAL  27   0.466  -6.371   0.778
  176    HB   VAL  27           HB       VAL  27   3.124  -4.957   1.207
  177   1HG1  VAL  27          HG12      VAL  27   0.741  -4.043  -0.103
  178   2HG1  VAL  27          HG11      VAL  27   0.919  -3.177   1.424
  179   3HG1  VAL  27          HG13      VAL  27   2.223  -3.144   0.235
  180   1HG2  VAL  27          HG22      VAL  27   1.905  -6.045   3.171
  181   2HG2  VAL  27          HG21      VAL  27   2.220  -4.318   3.330
  182   3HG2  VAL  27          HG23      VAL  27   0.609  -4.882   2.889
  183    H    CYS  28           HN       CYS  28  -0.094  -6.573  -1.375
  184    HA   CYS  28           HA       CYS  28   2.100  -6.268  -3.397
  185   1HB   CYS  28           HB2      CYS  28  -0.561  -7.695  -3.612
  186   2HB   CYS  28           HB1      CYS  28   0.818  -7.863  -4.697
  187    H    TYR  29           HN       TYR  29   1.475  -5.460  -5.490
  188    HA   TYR  29           HA       TYR  29  -0.912  -3.719  -5.619
  189   1HB   TYR  29           HB2      TYR  29   1.925  -2.881  -6.123
  190   2HB   TYR  29           HB1      TYR  29   0.495  -1.891  -6.331
  191    HD1  TYR  29           HD1      TYR  29   2.621  -3.620  -3.908
  192    HD2  TYR  29           HD2      TYR  29  -0.563  -0.843  -4.511
  193    HE1  TYR  29           HE1      TYR  29   2.846  -2.875  -1.565
  194    HE2  TYR  29           HE2      TYR  29  -0.370  -0.085  -2.164
  195    HH   TYR  29           HH       TYR  29   1.324  -0.058  -0.372
  196    H    ASP  30           HN       ASP  30  -1.033  -2.862  -7.996
  197    HA   ASP  30           HA       ASP  30  -0.390  -5.069  -9.793
  198   1HB   ASP  30           HB2      ASP  30  -1.860  -4.005 -11.257
  199   2HB   ASP  30           HB1      ASP  30  -2.515  -3.684  -9.655
  200    H    SER  31           HN       SER  31   0.778  -1.750  -9.333
  201    HA   SER  31           HA       SER  31   2.397  -1.823 -11.800
  202   1HB   SER  31           HB2      SER  31   2.695   0.084  -9.537
  203   2HB   SER  31           HB1      SER  31   2.942   0.374 -11.252
  204    HG   SER  31           HG       SER  31   0.976   1.198 -10.874
  205    H    LYS  32           HN       LYS  32   4.304  -3.172 -11.824
  206    HA   LYS  32           HA       LYS  32   5.534  -4.279  -9.525
  207   1HB   LYS  32           HB2      LYS  32   7.364  -4.795 -11.026
  208   2HB   LYS  32           HB1      LYS  32   5.976  -4.619 -12.108
  209   1HG   LYS  32           HG2      LYS  32   6.684  -2.499 -12.879
  210   2HG   LYS  32           HG1      LYS  32   7.771  -2.262 -11.510
  211   1HD   LYS  32           HD2      LYS  32   9.170  -2.832 -13.397
  212   2HD   LYS  32           HD1      LYS  32   9.100  -4.277 -12.374
  213   1HE   LYS  32           HE2      LYS  32   8.495  -5.331 -14.361
  214   2HE   LYS  32           HE1      LYS  32   6.891  -4.641 -14.016
  215   1HZ   LYS  32           HZ2      LYS  32   7.615  -2.594 -15.148
  216   2HZ   LYS  32           HZ1      LYS  32   9.068  -3.360 -15.583
  217   3HZ   LYS  32           HZ3      LYS  32   7.593  -3.936 -16.190
  218    H    ALA  33           HN       ALA  33   5.868  -1.070 -11.018
  219    HA   ALA  33           HA       ALA  33   8.000  -0.043  -9.470
  220   1HB   ALA  33           HB1      ALA  33   6.818   0.932 -11.527
  221   2HB   ALA  33           HB3      ALA  33   5.495   1.381 -10.447
  222   3HB   ALA  33           HB2      ALA  33   7.095   2.093 -10.225
  223    H    ILE  34           HN       ILE  34   4.396  -0.074  -8.858
  224    HA   ILE  34           HA       ILE  34   4.540   1.335  -6.433
  225    HB   ILE  34           HB       ILE  34   2.769  -0.673  -7.695
  226   1HG1  ILE  34          HG12      ILE  34   2.751   2.302  -7.165
  227   2HG1  ILE  34          HG11      ILE  34   2.619   1.468  -8.706
  228   1HG2  ILE  34          HG23      ILE  34   2.636  -0.919  -5.192
  229   2HG2  ILE  34          HG22      ILE  34   2.277   0.801  -5.073
  230   3HG2  ILE  34          HG21      ILE  34   1.143  -0.278  -5.873
  231   1HD1  ILE  34          HD12      ILE  34   0.444   0.498  -7.877
  232   2HD1  ILE  34          HD11      ILE  34   0.571   1.594  -6.500
  233   3HD1  ILE  34          HD13      ILE  34   0.425   2.244  -8.132
  234    H    CYS  35           HN       CYS  35   5.309  -1.834  -7.295
  235    HA   CYS  35           HA       CYS  35   5.367  -3.218  -4.771
  236   1HB   CYS  35           HB2      CYS  35   5.600  -4.387  -6.918
  237   2HB   CYS  35           HB1      CYS  35   7.025  -3.425  -7.326
  238    H    ASN  36           HN       ASN  36   8.264  -2.063  -6.558
  239    HA   ASN  36           HA       ASN  36   9.940  -1.811  -4.223
  240   1HB   ASN  36           HB2      ASN  36  10.765  -1.862  -6.553
  241   2HB   ASN  36           HB1      ASN  36   9.928  -0.342  -6.909
  242   1HD2  ASN  36          HD22      ASN  36  13.545  -0.270  -5.058
  243   2HD2  ASN  36          HD21      ASN  36  12.814  -1.737  -5.499
  244    H    LYS  37           HN       LYS  37   8.153   0.709  -5.969
  245    HA   LYS  37           HA       LYS  37   8.819   2.955  -4.454
  246   1HB   LYS  37           HB2      LYS  37   7.749   2.657  -6.731
  247   2HB   LYS  37           HB1      LYS  37   6.225   2.449  -5.876
  248   1HG   LYS  37           HG2      LYS  37   7.981   4.858  -5.394
  249   2HG   LYS  37           HG1      LYS  37   6.804   4.830  -6.703
  250   1HD   LYS  37           HD2      LYS  37   5.333   3.912  -4.543
  251   2HD   LYS  37           HD1      LYS  37   6.375   5.132  -3.814
  252   1HE   LYS  37           HE2      LYS  37   4.211   6.093  -4.663
  253   2HE   LYS  37           HE1      LYS  37   5.619   6.796  -5.484
  254   1HZ   LYS  37           HZ3      LYS  37   4.549   4.325  -6.609
  255   2HZ   LYS  37           HZ2      LYS  37   3.590   5.711  -6.804
  256   3HZ   LYS  37           HZ1      LYS  37   5.182   5.689  -7.395
  257    H    ASN  38           HN       ASN  38   5.403   1.898  -4.425
  258    HA   ASN  38           HA       ASN  38   4.777   3.237  -2.076
  259   1HB   ASN  38           HB2      ASN  38   3.656   1.135  -3.788
  260   2HB   ASN  38           HB1      ASN  38   2.787   1.629  -2.327
  261   1HD2  ASN  38          HD22      ASN  38   2.839   4.014  -5.592
  262   2HD2  ASN  38          HD21      ASN  38   3.628   2.509  -5.557
  263    H    CYS  39           HN       CYS  39   5.805  -0.031  -2.600
  264    HA   CYS  39           HA       CYS  39   5.071  -1.215  -0.149
  265   1HB   CYS  39           HB2      CYS  39   7.569  -1.470  -1.804
  266   2HB   CYS  39           HB1      CYS  39   7.184  -2.569  -0.476
  267    H    THR  40           HN       THR  40   7.722   1.057  -0.728
  268    HA   THR  40           HA       THR  40   8.902   0.691   1.926
  269    HB   THR  40           HB       THR  40  10.106   2.859   1.154
  270    HG1  THR  40           HG1      THR  40   9.614   3.606  -0.767
  271   1HG2  THR  40          HG23      THR  40  10.235   0.122  -0.032
  272   2HG2  THR  40          HG22      THR  40  11.086   1.389  -0.917
  273   3HG2  THR  40          HG21      THR  40  11.498   1.063   0.767
   
  No H/Q in entry =         273
  Start of MODEL    6
    1   1H    ASP   1           HT2      ASP   1  11.179   1.495   6.912
    2   2H    ASP   1           HT1      ASP   1  10.824   3.093   6.457
    3   3H    ASP   1           HT3      ASP   1  10.396   2.537   8.001
    4    HA   ASP   1           HA       ASP   1   8.700   1.143   7.165
    5   1HB   ASP   1           HB2      ASP   1   8.814   3.787   5.672
    6   2HB   ASP   1           HB1      ASP   1   7.346   2.860   5.997
    7    H    ASP   2           HN       ASP   2  11.139   1.966   4.844
    8    HA   ASP   2           HA       ASP   2   9.735   0.768   2.540
    9   1HB   ASP   2           HB2      ASP   2  12.661   1.629   2.957
   10   2HB   ASP   2           HB1      ASP   2  11.896   1.309   1.396
   11    H    GLY   3           HN       GLY   3  12.004  -0.647   1.448
   12   1HA   GLY   3           HA2      GLY   3  13.262  -2.539   3.029
   13   2HA   GLY   3           HA1      GLY   3  11.659  -3.213   2.764
   14    H    LEU   4           HN       LEU   4  11.851  -4.754   1.213
   15    HA   LEU   4           HA       LEU   4  13.342  -4.066  -1.291
   16   1HB   LEU   4           HB2      LEU   4  13.227  -6.791   0.034
   17   2HB   LEU   4           HB1      LEU   4  14.284  -6.271  -1.275
   18    HG   LEU   4           HG       LEU   4  14.382  -4.916   1.423
   19   1HD1  LEU   4          HD13      LEU   4  14.905  -7.625   1.054
   20   2HD1  LEU   4          HD12      LEU   4  16.493  -6.870   0.925
   21   3HD1  LEU   4          HD11      LEU   4  15.512  -6.621   2.369
   22   1HD2  LEU   4          HD23      LEU   4  15.965  -4.958  -1.095
   23   2HD2  LEU   4          HD22      LEU   4  15.718  -3.642   0.054
   24   3HD2  LEU   4          HD21      LEU   4  16.893  -4.908   0.403
   25    H    CYS   5           HN       CYS   5  12.670  -5.942  -3.036
   26    HA   CYS   5           HA       CYS   5   9.779  -6.671  -2.687
   27   1HB   CYS   5           HB2      CYS   5  10.030  -4.394  -3.806
   28   2HB   CYS   5           HB1      CYS   5  10.812  -5.224  -5.149
   29    H    TYR   6           HN       TYR   6   9.138  -8.422  -3.976
   30    HA   TYR   6           HA       TYR   6  11.249  -9.711  -5.665
   31   1HB   TYR   6           HB2      TYR   6  11.011 -11.798  -4.475
   32   2HB   TYR   6           HB1      TYR   6  11.266 -10.545  -3.274
   33    HD1  TYR   6           HD1      TYR   6   8.818 -12.807  -4.815
   34    HD2  TYR   6           HD2      TYR   6   9.534  -9.943  -1.720
   35    HE1  TYR   6           HE1      TYR   6   6.725 -13.508  -3.695
   36    HE2  TYR   6           HE2      TYR   6   7.428 -10.621  -0.591
   37    HH   TYR   6           HH       TYR   6   5.985 -13.184  -0.812
   38    H    GLU   7           HN       GLU   7  10.210 -11.473  -7.075
   39    HA   GLU   7           HA       GLU   7   7.348 -10.727  -7.630
   40   1HB   GLU   7           HB2      GLU   7   7.926 -10.769  -9.930
   41   2HB   GLU   7           HB1      GLU   7   9.286  -9.967  -9.159
   42   1HG   GLU   7           HG2      GLU   7  10.340 -12.346  -9.104
   43   2HG   GLU   7           HG1      GLU   7   9.046 -12.731 -10.254
   44    H    GLY   8           HN       GLY   8   5.977 -12.365  -8.384
   45   1HA   GLY   8           HA2      GLY   8   6.368 -14.900  -9.174
   46   2HA   GLY   8           HA1      GLY   8   6.699 -15.074  -7.454
   47    H    THR   9           HN       THR   9   4.937 -15.786  -6.346
   48    HA   THR   9           HA       THR   9   2.244 -14.710  -6.952
   49    HB   THR   9           HB       THR   9   3.137 -17.575  -7.090
   50    HG1  THR   9           HG1      THR   9   3.365 -17.165  -9.117
   51   1HG2  THR   9          HG23      THR   9   0.505 -16.436  -6.662
   52   2HG2  THR   9          HG22      THR   9   0.556 -17.320  -8.187
   53   3HG2  THR   9          HG21      THR   9   0.989 -18.131  -6.683
   54    H    ASN  10           HN       ASN  10   4.326 -14.995  -4.527
   55    HA   ASN  10           HA       ASN  10   3.098 -16.863  -2.691
   56   1HB   ASN  10           HB2      ASN  10   5.458 -16.076  -2.767
   57   2HB   ASN  10           HB1      ASN  10   4.918 -14.531  -2.109
   58   1HD2  ASN  10          HD22      ASN  10   4.667 -15.819   1.228
   59   2HD2  ASN  10          HD21      ASN  10   4.536 -14.425   0.208
   60    H    CYS  11           HN       CYS  11   2.162 -13.755  -3.565
   61    HA   CYS  11           HA       CYS  11   0.418 -13.595  -1.131
   62   1HB   CYS  11           HB2      CYS  11   1.925 -11.494  -2.679
   63   2HB   CYS  11           HB1      CYS  11   0.527 -11.042  -1.694
   64    H    GLY  12           HN       GLY  12   0.102 -14.804  -3.829
   65   1HA   GLY  12           HA2      GLY  12  -1.816 -15.055  -5.191
   66   2HA   GLY  12           HA1      GLY  12  -2.588 -13.827  -4.178
   67    H    LYS  13           HN       LYS  13   0.443 -12.888  -5.355
   68    HA   LYS  13           HA       LYS  13  -0.759 -10.839  -7.032
   69   1HB   LYS  13           HB2      LYS  13   1.351  -9.810  -6.815
   70   2HB   LYS  13           HB1      LYS  13   1.023 -10.630  -5.302
   71   1HG   LYS  13           HG2      LYS  13   2.326 -12.618  -6.280
   72   2HG   LYS  13           HG1      LYS  13   2.891 -11.483  -7.494
   73   1HD   LYS  13           HD2      LYS  13   3.434 -10.013  -5.368
   74   2HD   LYS  13           HD1      LYS  13   3.468 -11.583  -4.574
   75   1HE   LYS  13           HE2      LYS  13   4.916 -11.464  -7.154
   76   2HE   LYS  13           HE1      LYS  13   5.635 -10.525  -5.833
   77   1HZ   LYS  13           HZ3      LYS  13   5.205 -12.533  -4.404
   78   2HZ   LYS  13           HZ2      LYS  13   4.908 -13.395  -5.834
   79   3HZ   LYS  13           HZ1      LYS  13   6.436 -12.708  -5.558
   80    H    VAL  14           HN       VAL  14  -1.303 -13.073  -8.246
   81    HA   VAL  14           HA       VAL  14   0.662 -14.089 -10.116
   82    HB   VAL  14           HB       VAL  14  -2.365 -14.030  -9.959
   83   1HG1  VAL  14          HG12      VAL  14  -0.772 -14.589 -12.294
   84   2HG1  VAL  14          HG11      VAL  14  -1.525 -16.086 -11.743
   85   3HG1  VAL  14          HG13      VAL  14  -2.524 -14.680 -12.113
   86   1HG2  VAL  14          HG22      VAL  14  -0.792 -15.448  -8.411
   87   2HG2  VAL  14          HG21      VAL  14  -2.207 -16.213  -9.131
   88   3HG2  VAL  14          HG23      VAL  14  -0.611 -16.473  -9.835
   89    H    GLY  15           HN       GLY  15   1.670 -12.609 -11.502
   90   1HA   GLY  15           HA2      GLY  15   1.454 -11.394 -13.637
   91   2HA   GLY  15           HA1      GLY  15  -0.176 -10.912 -13.158
   92    H    LYS  16           HN       LYS  16   1.009 -10.283 -10.332
   93    HA   LYS  16           HA       LYS  16   2.239  -7.665 -11.136
   94   1HB   LYS  16           HB2      LYS  16   0.525  -8.272  -8.735
   95   2HB   LYS  16           HB1      LYS  16   1.106  -6.697  -9.257
   96   1HG   LYS  16           HG2      LYS  16  -0.160  -6.955 -11.385
   97   2HG   LYS  16           HG1      LYS  16  -0.841  -8.459 -10.765
   98   1HD   LYS  16           HD2      LYS  16  -1.076  -6.130  -8.947
   99   2HD   LYS  16           HD1      LYS  16  -2.013  -6.019 -10.437
  100   1HE   LYS  16           HE2      LYS  16  -3.417  -7.107  -8.786
  101   2HE   LYS  16           HE1      LYS  16  -2.890  -8.364  -9.922
  102   1HZ   LYS  16           HZ3      LYS  16  -1.306  -7.696  -7.515
  103   2HZ   LYS  16           HZ2      LYS  16  -2.573  -8.824  -7.445
  104   3HZ   LYS  16           HZ1      LYS  16  -1.243  -9.099  -8.464
  105    H    TYR  17           HN       TYR  17   2.787  -7.197  -8.079
  106    HA   TYR  17           HA       TYR  17   4.812  -9.345  -7.639
  107   1HB   TYR  17           HB2      TYR  17   5.566  -6.415  -7.609
  108   2HB   TYR  17           HB1      TYR  17   6.605  -7.849  -7.609
  109    HD1  TYR  17           HD1      TYR  17   4.310  -5.835  -9.762
  110    HD2  TYR  17           HD2      TYR  17   7.148  -9.017  -9.526
  111    HE1  TYR  17           HE1      TYR  17   4.427  -5.927 -12.242
  112    HE2  TYR  17           HE2      TYR  17   7.291  -9.116 -11.972
  113    HH   TYR  17           HH       TYR  17   5.239  -8.158 -13.963
  114    H    CYS  18           HN       CYS  18   6.008  -8.757  -5.311
  115    HA   CYS  18           HA       CYS  18   3.970  -7.475  -3.517
  116   1HB   CYS  18           HB2      CYS  18   5.269 -10.221  -3.349
  117   2HB   CYS  18           HB1      CYS  18   4.437  -9.476  -1.983
  118    H    CYS  19           HN       CYS  19   4.905  -6.906  -1.394
  119    HA   CYS  19           HA       CYS  19   7.863  -6.689  -1.400
  120   1HB   CYS  19           HB2      CYS  19   7.351  -4.339  -0.371
  121   2HB   CYS  19           HB1      CYS  19   7.145  -4.567  -2.110
  122    H    SER  20           HN       SER  20   8.703  -7.547   0.448
  123    HA   SER  20           HA       SER  20   7.599  -7.022   3.091
  124   1HB   SER  20           HB2      SER  20   7.169  -9.529   3.521
  125   2HB   SER  20           HB1      SER  20   6.024  -8.748   2.431
  126    HG   SER  20           HG       SER  20   6.656 -10.554   1.381
  127    HA   PRO  21           HA       PRO  21  11.953  -7.913   3.368
  128   1HB   PRO  21           HB2      PRO  21  12.372  -7.022   5.926
  129   2HB   PRO  21           HB1      PRO  21  12.211  -5.938   4.527
  130   1HG   PRO  21           HG2      PRO  21  10.226  -6.547   6.661
  131   2HG   PRO  21           HG1      PRO  21  10.453  -5.074   5.696
  132   1HD   PRO  21           HD2      PRO  21   8.506  -7.074   5.308
  133   2HD   PRO  21           HD1      PRO  21   8.921  -5.772   4.167
  134    H    ILE  22           HN       ILE  22   9.480  -9.509   4.832
  135    HA   ILE  22           HA       ILE  22  11.169 -11.764   5.562
  136    HB   ILE  22           HB       ILE  22  11.322 -10.092   7.456
  137   1HG1  ILE  22          HG12      ILE  22  10.019 -12.774   8.088
  138   2HG1  ILE  22          HG11      ILE  22  11.751 -12.444   8.009
  139   1HG2  ILE  22          HG23      ILE  22   8.560  -9.989   6.993
  140   2HG2  ILE  22          HG22      ILE  22   8.745 -10.715   8.588
  141   3HG2  ILE  22          HG21      ILE  22   9.463  -9.142   8.247
  142   1HD1  ILE  22          HD13      ILE  22  11.403 -10.754   9.877
  143   2HD1  ILE  22          HD12      ILE  22   9.767 -11.392  10.043
  144   3HD1  ILE  22          HD11      ILE  22  11.155 -12.439  10.336
  145    H    GLY  23           HN       GLY  23   8.568 -10.754   4.241
  146   1HA   GLY  23           HA2      GLY  23   6.647 -11.916   3.414
  147   2HA   GLY  23           HA1      GLY  23   7.184 -13.293   4.365
  148    H    LYS  24           HN       LYS  24   7.053 -10.464   6.192
  149    HA   LYS  24           HA       LYS  24   4.750 -11.489   7.673
  150   1HB   LYS  24           HB2      LYS  24   5.385  -9.898   9.343
  151   2HB   LYS  24           HB1      LYS  24   6.854 -10.634   8.715
  152   1HG   LYS  24           HG2      LYS  24   7.091  -8.670   7.153
  153   2HG   LYS  24           HG1      LYS  24   5.716  -7.927   7.969
  154   1HD   LYS  24           HD2      LYS  24   7.907  -8.913   9.716
  155   2HD   LYS  24           HD1      LYS  24   8.270  -7.497   8.730
  156   1HE   LYS  24           HE2      LYS  24   7.102  -6.196  10.169
  157   2HE   LYS  24           HE1      LYS  24   5.646  -7.165   9.870
  158   1HZ   LYS  24           HZ1      LYS  24   7.844  -8.057  11.651
  159   2HZ   LYS  24           HZ3      LYS  24   6.489  -7.212  12.222
  160   3HZ   LYS  24           HZ2      LYS  24   6.294  -8.735  11.494
  161    H    TYR  25           HN       TYR  25   5.534  -8.628   5.725
  162    HA   TYR  25           HA       TYR  25   2.908  -7.415   6.212
  163   1HB   TYR  25           HB2      TYR  25   5.367  -6.750   4.611
  164   2HB   TYR  25           HB1      TYR  25   3.884  -5.809   4.429
  165    HD1  TYR  25           HD1      TYR  25   2.850  -4.747   6.505
  166    HD2  TYR  25           HD2      TYR  25   6.809  -6.405   6.447
  167    HE1  TYR  25           HE1      TYR  25   3.409  -3.468   8.561
  168    HE2  TYR  25           HE2      TYR  25   7.378  -5.120   8.511
  169    HH   TYR  25           HH       TYR  25   6.609  -3.114   9.683
  170    H    CYS  26           HN       CYS  26   4.543  -9.059   3.494
  171    HA   CYS  26           HA       CYS  26   3.679  -9.698   1.355
  172   1HB   CYS  26           HB2      CYS  26   2.771 -11.441   2.818
  173   2HB   CYS  26           HB1      CYS  26   1.460 -10.379   3.348
  174    H    VAL  27           HN       VAL  27   3.556  -7.157   1.007
  175    HA   VAL  27           HA       VAL  27   0.679  -6.364   0.569
  176    HB   VAL  27           HB       VAL  27   3.208  -4.709   0.892
  177   1HG1  VAL  27          HG12      VAL  27   0.885  -4.019  -0.395
  178   2HG1  VAL  27          HG11      VAL  27   0.555  -3.478   1.251
  179   3HG1  VAL  27          HG13      VAL  27   1.971  -2.871   0.390
  180   1HG2  VAL  27          HG23      VAL  27   2.469  -5.883   2.965
  181   2HG2  VAL  27          HG22      VAL  27   2.295  -4.133   3.093
  182   3HG2  VAL  27          HG21      VAL  27   0.879  -5.140   2.791
  183    H    CYS  28           HN       CYS  28   0.185  -6.655  -1.594
  184    HA   CYS  28           HA       CYS  28   2.420  -6.308  -3.559
  185   1HB   CYS  28           HB2      CYS  28  -0.149  -7.875  -3.816
  186   2HB   CYS  28           HB1      CYS  28   1.301  -8.045  -4.803
  187    H    TYR  29           HN       TYR  29   1.888  -5.559  -5.676
  188    HA   TYR  29           HA       TYR  29  -0.601  -3.987  -6.017
  189   1HB   TYR  29           HB2      TYR  29   2.215  -2.957  -6.199
  190   2HB   TYR  29           HB1      TYR  29   0.780  -2.076  -6.678
  191    HD1  TYR  29           HD1      TYR  29   2.514  -3.644  -3.852
  192    HD2  TYR  29           HD2      TYR  29  -0.535  -0.936  -5.119
  193    HE1  TYR  29           HE1      TYR  29   2.319  -2.798  -1.540
  194    HE2  TYR  29           HE2      TYR  29  -0.759  -0.078  -2.812
  195    HH   TYR  29           HH       TYR  29  -0.046  -1.415  -0.277
  196    H    ASP  30           HN       ASP  30  -0.427  -3.000  -8.403
  197    HA   ASP  30           HA       ASP  30   0.367  -5.178 -10.169
  198   1HB   ASP  30           HB2      ASP  30  -0.862  -4.030 -11.782
  199   2HB   ASP  30           HB1      ASP  30  -1.710  -3.714 -10.272
  200    H    SER  31           HN       SER  31   1.457  -1.832  -9.621
  201    HA   SER  31           HA       SER  31   3.562  -2.073 -11.687
  202   1HB   SER  31           HB2      SER  31   3.366   0.022  -9.582
  203   2HB   SER  31           HB1      SER  31   3.978   0.175 -11.220
  204    HG   SER  31           HG       SER  31   1.962   1.021 -11.277
  205    H    LYS  32           HN       LYS  32   5.443  -3.367 -11.167
  206    HA   LYS  32           HA       LYS  32   6.038  -4.269  -8.549
  207   1HB   LYS  32           HB2      LYS  32   8.154  -4.955  -9.498
  208   2HB   LYS  32           HB1      LYS  32   7.059  -4.894 -10.884
  209   1HG   LYS  32           HG2      LYS  32   8.001  -2.900 -11.705
  210   2HG   LYS  32           HG1      LYS  32   8.742  -2.501 -10.154
  211   1HD   LYS  32           HD2      LYS  32  10.525  -3.319 -11.583
  212   2HD   LYS  32           HD1      LYS  32  10.164  -4.614 -10.431
  213   1HE   LYS  32           HE2      LYS  32   8.488  -5.484 -12.248
  214   2HE   LYS  32           HE1      LYS  32   9.417  -4.465 -13.369
  215   1HZ   LYS  32           HZ1      LYS  32  10.674  -6.371 -11.468
  216   2HZ   LYS  32           HZ3      LYS  32  10.306  -6.772 -13.074
  217   3HZ   LYS  32           HZ2      LYS  32  11.424  -5.536 -12.744
  218    H    ALA  33           HN       ALA  33   6.775  -1.216 -10.181
  219    HA   ALA  33           HA       ALA  33   8.494  -0.023  -8.280
  220   1HB   ALA  33           HB3      ALA  33   7.813   0.757 -10.624
  221   2HB   ALA  33           HB2      ALA  33   6.274   1.258  -9.918
  222   3HB   ALA  33           HB1      ALA  33   7.775   2.025  -9.396
  223    H    ILE  34           HN       ILE  34   4.844  -0.070  -8.516
  224    HA   ILE  34           HA       ILE  34   4.400   1.525  -6.253
  225    HB   ILE  34           HB       ILE  34   3.003  -0.624  -7.717
  226   1HG1  ILE  34          HG12      ILE  34   2.813   2.371  -7.428
  227   2HG1  ILE  34          HG11      ILE  34   3.019   1.420  -8.895
  228   1HG2  ILE  34          HG23      ILE  34   2.355  -0.615  -5.227
  229   2HG2  ILE  34          HG22      ILE  34   1.759   1.021  -5.487
  230   3HG2  ILE  34          HG21      ILE  34   1.029  -0.329  -6.351
  231   1HD1  ILE  34          HD12      ILE  34   0.732   0.424  -8.396
  232   2HD1  ILE  34          HD11      ILE  34   0.557   1.693  -7.186
  233   3HD1  ILE  34          HD13      ILE  34   0.742   2.119  -8.888
  234    H    CYS  35           HN       CYS  35   5.404  -1.694  -6.607
  235    HA   CYS  35           HA       CYS  35   4.820  -2.731  -3.976
  236   1HB   CYS  35           HB2      CYS  35   5.585  -4.232  -5.749
  237   2HB   CYS  35           HB1      CYS  35   7.079  -3.299  -5.952
  238    H    ASN  36           HN       ASN  36   8.029  -1.639  -5.207
  239    HA   ASN  36           HA       ASN  36   9.189  -1.142  -2.636
  240   1HB   ASN  36           HB2      ASN  36   9.562   0.177  -5.367
  241   2HB   ASN  36           HB1      ASN  36  10.660   0.422  -4.001
  242   1HD2  ASN  36          HD21      ASN  36   9.655  -1.866  -6.472
  243   2HD2  ASN  36          HD22      ASN  36  10.820  -3.049  -6.119
  244    H    LYS  37           HN       LYS  37   7.641   1.234  -4.791
  245    HA   LYS  37           HA       LYS  37   7.791   3.499  -3.133
  246   1HB   LYS  37           HB2      LYS  37   7.362   3.236  -5.612
  247   2HB   LYS  37           HB1      LYS  37   5.692   2.866  -5.193
  248   1HG   LYS  37           HG2      LYS  37   7.045   5.386  -4.213
  249   2HG   LYS  37           HG1      LYS  37   6.241   5.324  -5.780
  250   1HD   LYS  37           HD2      LYS  37   4.324   4.217  -4.181
  251   2HD   LYS  37           HD1      LYS  37   5.073   5.351  -3.060
  252   1HE   LYS  37           HE2      LYS  37   3.193   6.409  -4.319
  253   2HE   LYS  37           HE1      LYS  37   4.738   7.188  -4.710
  254   1HZ   LYS  37           HZ2      LYS  37   4.154   4.845  -6.301
  255   2HZ   LYS  37           HZ1      LYS  37   3.058   6.121  -6.535
  256   3HZ   LYS  37           HZ3      LYS  37   4.715   6.374  -6.785
  257    H    ASN  38           HN       ASN  38   4.581   2.243  -4.009
  258    HA   ASN  38           HA       ASN  38   3.216   3.429  -1.917
  259   1HB   ASN  38           HB2      ASN  38   2.817   1.277  -3.873
  260   2HB   ASN  38           HB1      ASN  38   1.538   1.661  -2.717
  261   1HD2  ASN  38          HD22      ASN  38   2.257   4.088  -5.870
  262   2HD2  ASN  38          HD21      ASN  38   3.137   2.656  -5.606
  263    H    CYS  39           HN       CYS  39   4.755   0.326  -2.095
  264    HA   CYS  39           HA       CYS  39   3.431  -1.086  -0.047
  265   1HB   CYS  39           HB2      CYS  39   6.354  -0.896  -0.738
  266   2HB   CYS  39           HB1      CYS  39   5.732  -2.073   0.422
  267    H    THR  40           HN       THR  40   5.531   1.697   0.332
  268    HA   THR  40           HA       THR  40   5.982   1.331   3.194
  269    HB   THR  40           HB       THR  40   6.725   3.792   2.913
  270    HG1  THR  40           HG1      THR  40   5.659   4.451   1.158
  271   1HG2  THR  40          HG21      THR  40   7.872   1.359   1.603
  272   2HG2  THR  40          HG23      THR  40   8.557   2.912   1.112
  273   3HG2  THR  40          HG22      THR  40   8.588   2.431   2.809
   
  No H/Q in entry =         273
  Start of MODEL    7
    1   1H    ASP   1           HT1      ASP   1  10.699   2.587   7.469
    2   2H    ASP   1           HT3      ASP   1   9.305   2.478   8.429
    3   3H    ASP   1           HT2      ASP   1   9.840   1.124   7.553
    4    HA   ASP   1           HA       ASP   1   7.964   2.085   6.406
    5   1HB   ASP   1           HB2      ASP   1   8.344   4.288   7.553
    6   2HB   ASP   1           HB1      ASP   1   9.675   4.591   6.435
    7    H    ASP   2           HN       ASP   2  10.228   0.497   5.715
    8    HA   ASP   2           HA       ASP   2  10.499   1.207   2.849
    9   1HB   ASP   2           HB2      ASP   2  12.722   1.202   4.937
   10   2HB   ASP   2           HB1      ASP   2  13.090   0.908   3.229
   11    H    GLY   3           HN       GLY   3  12.177  -0.633   1.932
   12   1HA   GLY   3           HA2      GLY   3  12.564  -3.091   3.148
   13   2HA   GLY   3           HA1      GLY   3  10.911  -3.175   2.557
   14    H    LEU   4           HN       LEU   4  11.616  -4.885   1.135
   15    HA   LEU   4           HA       LEU   4  12.999  -3.890  -1.327
   16   1HB   LEU   4           HB2      LEU   4  13.243  -6.686  -0.184
   17   2HB   LEU   4           HB1      LEU   4  14.240  -5.926  -1.420
   18    HG   LEU   4           HG       LEU   4  14.112  -4.797   1.379
   19   1HD1  LEU   4          HD13      LEU   4  14.866  -7.343   1.044
   20   2HD1  LEU   4          HD12      LEU   4  16.372  -6.560   0.567
   21   3HD1  LEU   4          HD11      LEU   4  15.691  -6.266   2.168
   22   1HD2  LEU   4          HD21      LEU   4  15.697  -4.389  -1.098
   23   2HD2  LEU   4          HD23      LEU   4  15.298  -3.242   0.182
   24   3HD2  LEU   4          HD22      LEU   4  16.621  -4.386   0.403
   25    H    CYS   5           HN       CYS   5  12.525  -5.783  -3.165
   26    HA   CYS   5           HA       CYS   5   9.689  -6.729  -2.797
   27   1HB   CYS   5           HB2      CYS   5   9.864  -4.470  -3.982
   28   2HB   CYS   5           HB1      CYS   5  10.652  -5.327  -5.306
   29    H    TYR   6           HN       TYR   6   9.110  -8.506  -4.050
   30    HA   TYR   6           HA       TYR   6  11.257  -9.807  -5.681
   31   1HB   TYR   6           HB2      TYR   6  10.991 -11.878  -4.458
   32   2HB   TYR   6           HB1      TYR   6  11.246 -10.602  -3.282
   33    HD1  TYR   6           HD1      TYR   6   8.790 -12.885  -4.787
   34    HD2  TYR   6           HD2      TYR   6   9.513  -9.965  -1.746
   35    HE1  TYR   6           HE1      TYR   6   6.693 -13.560  -3.653
   36    HE2  TYR   6           HE2      TYR   6   7.404 -10.619  -0.605
   37    HH   TYR   6           HH       TYR   6   5.972 -13.089  -0.696
   38    H    GLU   7           HN       GLU   7  10.222 -11.634  -7.051
   39    HA   GLU   7           HA       GLU   7   7.394 -10.834  -7.704
   40   1HB   GLU   7           HB2      GLU   7   8.024 -10.989  -9.985
   41   2HB   GLU   7           HB1      GLU   7   9.396 -10.207  -9.214
   42   1HG   GLU   7           HG2      GLU   7  10.359 -12.617  -9.033
   43   2HG   GLU   7           HG1      GLU   7   9.076 -13.004 -10.194
   44    H    GLY   8           HN       GLY   8   5.964 -12.453  -8.332
   45   1HA   GLY   8           HA2      GLY   8   6.259 -15.023  -9.055
   46   2HA   GLY   8           HA1      GLY   8   6.619 -15.159  -7.337
   47    H    THR   9           HN       THR   9   4.846 -15.785  -6.177
   48    HA   THR   9           HA       THR   9   2.180 -14.641  -6.781
   49    HB   THR   9           HB       THR   9   2.952 -17.543  -6.796
   50    HG1  THR   9           HG1      THR   9   2.697 -17.412  -8.968
   51   1HG2  THR   9          HG21      THR   9   0.396 -16.291  -6.399
   52   2HG2  THR   9          HG23      THR   9   0.390 -17.109  -7.960
   53   3HG2  THR   9          HG22      THR   9   0.768 -18.010  -6.493
   54    H    ASN  10           HN       ASN  10   4.305 -14.968  -4.367
   55    HA   ASN  10           HA       ASN  10   2.966 -16.701  -2.470
   56   1HB   ASN  10           HB2      ASN  10   5.385 -16.094  -2.617
   57   2HB   ASN  10           HB1      ASN  10   4.971 -14.516  -1.949
   58   1HD2  ASN  10          HD22      ASN  10   4.691 -15.786   1.392
   59   2HD2  ASN  10          HD21      ASN  10   4.639 -14.385   0.375
   60    H    CYS  11           HN       CYS  11   2.292 -13.527  -3.385
   61    HA   CYS  11           HA       CYS  11   0.605 -13.195  -0.927
   62   1HB   CYS  11           HB2      CYS  11   2.275 -11.245  -2.503
   63   2HB   CYS  11           HB1      CYS  11   0.948 -10.667  -1.486
   64    H    GLY  12           HN       GLY  12   0.140 -14.389  -3.593
   65   1HA   GLY  12           HA2      GLY  12  -1.825 -14.495  -4.901
   66   2HA   GLY  12           HA1      GLY  12  -2.449 -13.163  -3.921
   67    H    LYS  13           HN       LYS  13   0.642 -12.587  -5.234
   68    HA   LYS  13           HA       LYS  13  -0.422 -10.487  -6.939
   69   1HB   LYS  13           HB2      LYS  13   1.796  -9.694  -6.888
   70   2HB   LYS  13           HB1      LYS  13   1.469 -10.410  -5.323
   71   1HG   LYS  13           HG2      LYS  13   2.493 -12.567  -6.276
   72   2HG   LYS  13           HG1      LYS  13   3.105 -11.551  -7.570
   73   1HD   LYS  13           HD2      LYS  13   4.540 -10.413  -6.175
   74   2HD   LYS  13           HD1      LYS  13   3.525 -10.682  -4.768
   75   1HE   LYS  13           HE2      LYS  13   4.727 -12.504  -4.192
   76   2HE   LYS  13           HE1      LYS  13   4.474 -13.212  -5.800
   77   1HZ   LYS  13           HZ3      LYS  13   6.153 -11.546  -6.605
   78   2HZ   LYS  13           HZ2      LYS  13   6.540 -11.253  -4.980
   79   3HZ   LYS  13           HZ1      LYS  13   6.775 -12.798  -5.648
   80    H    VAL  14           HN       VAL  14  -1.259 -12.722  -8.019
   81    HA   VAL  14           HA       VAL  14   0.475 -13.979  -9.968
   82    HB   VAL  14           HB       VAL  14  -2.512 -13.644  -9.602
   83   1HG1  VAL  14          HG12      VAL  14  -1.042 -15.112 -11.810
   84   2HG1  VAL  14          HG11      VAL  14  -2.714 -15.463 -11.375
   85   3HG1  VAL  14          HG13      VAL  14  -2.279 -13.866 -11.983
   86   1HG2  VAL  14          HG22      VAL  14  -0.915 -15.192  -8.176
   87   2HG2  VAL  14          HG21      VAL  14  -2.481 -15.797  -8.714
   88   3HG2  VAL  14          HG23      VAL  14  -1.016 -16.250  -9.585
   89    H    GLY  15           HN       GLY  15   1.522 -12.621 -11.447
   90   1HA   GLY  15           HA2      GLY  15   1.336 -11.450 -13.599
   91   2HA   GLY  15           HA1      GLY  15  -0.265 -10.883 -13.115
   92    H    LYS  16           HN       LYS  16   0.991 -10.225 -10.334
   93    HA   LYS  16           HA       LYS  16   2.296  -7.671 -11.216
   94   1HB   LYS  16           HB2      LYS  16   0.573  -8.167  -8.794
   95   2HB   LYS  16           HB1      LYS  16   1.205  -6.623  -9.353
   96   1HG   LYS  16           HG2      LYS  16  -0.110  -6.765 -11.401
   97   2HG   LYS  16           HG1      LYS  16  -0.720  -8.351 -10.930
   98   1HD   LYS  16           HD2      LYS  16  -1.102  -5.914  -9.179
   99   2HD   LYS  16           HD1      LYS  16  -2.250  -6.340 -10.451
  100   1HE   LYS  16           HE2      LYS  16  -2.917  -8.311  -9.370
  101   2HE   LYS  16           HE1      LYS  16  -1.410  -8.424  -8.439
  102   1HZ   LYS  16           HZ3      LYS  16  -3.370  -6.211  -8.149
  103   2HZ   LYS  16           HZ2      LYS  16  -3.339  -7.574  -7.137
  104   3HZ   LYS  16           HZ1      LYS  16  -2.014  -6.512  -7.176
  105    H    TYR  17           HN       TYR  17   2.849  -7.187  -8.140
  106    HA   TYR  17           HA       TYR  17   4.837  -9.377  -7.712
  107   1HB   TYR  17           HB2      TYR  17   5.621  -6.453  -7.684
  108   2HB   TYR  17           HB1      TYR  17   6.649  -7.894  -7.643
  109    HD1  TYR  17           HD1      TYR  17   4.407  -5.900  -9.874
  110    HD2  TYR  17           HD2      TYR  17   7.226  -9.091  -9.533
  111    HE1  TYR  17           HE1      TYR  17   4.583  -6.023 -12.348
  112    HE2  TYR  17           HE2      TYR  17   7.420  -9.223 -11.974
  113    HH   TYR  17           HH       TYR  17   6.957  -7.316 -13.959
  114    H    CYS  18           HN       CYS  18   6.033  -8.833  -5.372
  115    HA   CYS  18           HA       CYS  18   4.012  -7.522  -3.578
  116   1HB   CYS  18           HB2      CYS  18   5.286 -10.276  -3.397
  117   2HB   CYS  18           HB1      CYS  18   4.445  -9.522  -2.041
  118    H    CYS  19           HN       CYS  19   4.943  -7.027  -1.425
  119    HA   CYS  19           HA       CYS  19   7.897  -6.773  -1.440
  120   1HB   CYS  19           HB2      CYS  19   7.351  -4.454  -0.351
  121   2HB   CYS  19           HB1      CYS  19   7.149  -4.647  -2.095
  122    H    SER  20           HN       SER  20   8.742  -7.715   0.353
  123    HA   SER  20           HA       SER  20   7.679  -7.273   3.029
  124   1HB   SER  20           HB2      SER  20   7.121  -9.695   3.437
  125   2HB   SER  20           HB1      SER  20   6.120  -9.006   2.155
  126    HG   SER  20           HG       SER  20   6.985 -10.994   1.510
  127    HA   PRO  21           HA       PRO  21  12.043  -8.188   3.207
  128   1HB   PRO  21           HB2      PRO  21  12.509  -7.331   5.768
  129   2HB   PRO  21           HB1      PRO  21  12.327  -6.226   4.389
  130   1HG   PRO  21           HG2      PRO  21  10.380  -6.856   6.549
  131   2HG   PRO  21           HG1      PRO  21  10.592  -5.374   5.596
  132   1HD   PRO  21           HD2      PRO  21   8.640  -7.376   5.223
  133   2HD   PRO  21           HD1      PRO  21   9.021  -6.050   4.097
  134    H    ILE  22           HN       ILE  22   9.564  -9.715   4.762
  135    HA   ILE  22           HA       ILE  22  11.176 -12.057   5.381
  136    HB   ILE  22           HB       ILE  22  11.494 -10.401   7.283
  137   1HG1  ILE  22          HG12      ILE  22  10.150 -13.058   7.932
  138   2HG1  ILE  22          HG11      ILE  22  11.885 -12.765   7.793
  139   1HG2  ILE  22          HG22      ILE  22   8.746 -10.151   6.953
  140   2HG2  ILE  22          HG21      ILE  22   8.923 -10.994   8.492
  141   3HG2  ILE  22          HG23      ILE  22   9.717  -9.439   8.242
  142   1HD1  ILE  22          HD13      ILE  22  11.169 -10.894   9.670
  143   2HD1  ILE  22          HD12      ILE  22  10.060 -12.213  10.046
  144   3HD1  ILE  22          HD11      ILE  22  11.801 -12.497  10.050
  145    H    GLY  23           HN       GLY  23   8.617 -10.952   4.139
  146   1HA   GLY  23           HA2      GLY  23   6.604 -12.012   3.400
  147   2HA   GLY  23           HA1      GLY  23   7.064 -13.384   4.396
  148    H    LYS  24           HN       LYS  24   7.184 -10.484   6.106
  149    HA   LYS  24           HA       LYS  24   4.837 -11.267   7.666
  150   1HB   LYS  24           HB2      LYS  24   5.638  -9.683   9.269
  151   2HB   LYS  24           HB1      LYS  24   7.031 -10.553   8.635
  152   1HG   LYS  24           HG2      LYS  24   7.376  -8.659   7.002
  153   2HG   LYS  24           HG1      LYS  24   6.093  -7.784   7.837
  154   1HD   LYS  24           HD2      LYS  24   8.298  -8.906   9.504
  155   2HD   LYS  24           HD1      LYS  24   8.660  -7.488   8.520
  156   1HE   LYS  24           HE2      LYS  24   6.481  -6.483   9.517
  157   2HE   LYS  24           HE1      LYS  24   6.635  -7.758  10.742
  158   1HZ   LYS  24           HZ3      LYS  24   8.961  -7.058  11.062
  159   2HZ   LYS  24           HZ2      LYS  24   8.704  -5.760   9.998
  160   3HZ   LYS  24           HZ1      LYS  24   7.858  -5.836  11.469
  161    H    TYR  25           HN       TYR  25   5.780  -8.649   5.492
  162    HA   TYR  25           HA       TYR  25   3.329  -7.117   5.998
  163   1HB   TYR  25           HB2      TYR  25   5.745  -6.867   4.225
  164   2HB   TYR  25           HB1      TYR  25   4.357  -5.795   4.025
  165    HD1  TYR  25           HD2      TYR  25   3.650  -4.298   5.855
  166    HD2  TYR  25           HD1      TYR  25   7.213  -6.665   6.134
  167    HE1  TYR  25           HE2      TYR  25   4.431  -2.887   7.749
  168    HE2  TYR  25           HE1      TYR  25   8.010  -5.251   8.030
  169    HH   TYR  25           HH       TYR  25   7.151  -3.767   9.689
  170    H    CYS  26           HN       CYS  26   4.644  -9.131   3.351
  171    HA   CYS  26           HA       CYS  26   3.597  -9.857   1.322
  172   1HB   CYS  26           HB2      CYS  26   2.688 -11.199   3.321
  173   2HB   CYS  26           HB1      CYS  26   1.254 -10.174   3.246
  174    H    VAL  27           HN       VAL  27   3.592  -7.231   0.985
  175    HA   VAL  27           HA       VAL  27   0.729  -6.402   0.515
  176    HB   VAL  27           HB       VAL  27   3.271  -4.770   0.850
  177   1HG1  VAL  27          HG11      VAL  27   0.998  -4.047  -0.468
  178   2HG1  VAL  27          HG13      VAL  27   0.592  -3.558   1.177
  179   3HG1  VAL  27          HG12      VAL  27   2.034  -2.909   0.396
  180   1HG2  VAL  27          HG21      VAL  27   0.949  -5.290   2.737
  181   2HG2  VAL  27          HG23      VAL  27   2.601  -5.873   2.941
  182   3HG2  VAL  27          HG22      VAL  27   2.258  -4.146   3.036
  183    H    CYS  28           HN       CYS  28   0.234  -6.664  -1.643
  184    HA   CYS  28           HA       CYS  28   2.476  -6.347  -3.607
  185   1HB   CYS  28           HB2      CYS  28  -0.116  -7.875  -3.871
  186   2HB   CYS  28           HB1      CYS  28   1.326  -8.056  -4.866
  187    H    TYR  29           HN       TYR  29   1.944  -5.573  -5.722
  188    HA   TYR  29           HA       TYR  29  -0.516  -3.944  -6.025
  189   1HB   TYR  29           HB2      TYR  29   2.324  -2.986  -6.227
  190   2HB   TYR  29           HB1      TYR  29   0.912  -2.072  -6.712
  191    HD1  TYR  29           HD1      TYR  29   2.587  -3.681  -3.870
  192    HD2  TYR  29           HD2      TYR  29  -0.361  -0.878  -5.166
  193    HE1  TYR  29           HE1      TYR  29   2.403  -2.821  -1.561
  194    HE2  TYR  29           HE2      TYR  29  -0.572  -0.004  -2.865
  195    HH   TYR  29           HH       TYR  29  -0.145  -0.712  -0.580
  196    H    ASP  30           HN       ASP  30  -0.354  -2.945  -8.402
  197    HA   ASP  30           HA       ASP  30   0.360  -5.124 -10.198
  198   1HB   ASP  30           HB2      ASP  30  -0.884  -3.940 -11.778
  199   2HB   ASP  30           HB1      ASP  30  -1.696  -3.630 -10.245
  200    H    SER  31           HN       SER  31   1.501  -1.795  -9.672
  201    HA   SER  31           HA       SER  31   3.572  -2.069 -11.768
  202   1HB   SER  31           HB2      SER  31   3.439   0.033  -9.663
  203   2HB   SER  31           HB1      SER  31   4.029   0.173 -11.312
  204    HG   SER  31           HG       SER  31   1.974   0.105 -12.058
  205    H    LYS  32           HN       LYS  32   5.446  -3.376 -11.278
  206    HA   LYS  32           HA       LYS  32   6.080  -4.316  -8.688
  207   1HB   LYS  32           HB2      LYS  32   8.186  -4.978  -9.681
  208   2HB   LYS  32           HB1      LYS  32   7.069  -4.894 -11.049
  209   1HG   LYS  32           HG2      LYS  32   7.981  -2.863 -11.830
  210   2HG   LYS  32           HG1      LYS  32   8.768  -2.520 -10.289
  211   1HD   LYS  32           HD2      LYS  32  10.547  -3.292 -11.691
  212   2HD   LYS  32           HD1      LYS  32  10.113  -4.711 -10.723
  213   1HE   LYS  32           HE2      LYS  32   8.673  -5.553 -12.572
  214   2HE   LYS  32           HE1      LYS  32   9.092  -4.128 -13.548
  215   1HZ   LYS  32           HZ2      LYS  32  11.116  -5.948 -12.357
  216   2HZ   LYS  32           HZ1      LYS  32  10.534  -6.117 -13.944
  217   3HZ   LYS  32           HZ3      LYS  32  11.378  -4.715 -13.497
  218    H    ALA  33           HN       ALA  33   6.830  -1.240 -10.279
  219    HA   ALA  33           HA       ALA  33   8.556  -0.091  -8.353
  220   1HB   ALA  33           HB2      ALA  33   7.910   0.727 -10.691
  221   2HB   ALA  33           HB1      ALA  33   6.365   1.232  -9.998
  222   3HB   ALA  33           HB3      ALA  33   7.866   1.981  -9.447
  223    H    ILE  34           HN       ILE  34   4.909  -0.076  -8.613
  224    HA   ILE  34           HA       ILE  34   4.474   1.498  -6.330
  225    HB   ILE  34           HB       ILE  34   3.051  -0.604  -7.834
  226   1HG1  ILE  34          HG12      ILE  34   2.917   2.392  -7.516
  227   2HG1  ILE  34          HG11      ILE  34   3.112   1.453  -8.991
  228   1HG2  ILE  34          HG21      ILE  34   2.396  -0.578  -5.332
  229   2HG2  ILE  34          HG23      ILE  34   1.787   1.046  -5.627
  230   3HG2  ILE  34          HG22      ILE  34   1.083  -0.323  -6.479
  231   1HD1  ILE  34          HD13      ILE  34   0.804   0.500  -8.530
  232   2HD1  ILE  34          HD12      ILE  34   0.645   1.743  -7.290
  233   3HD1  ILE  34          HD11      ILE  34   0.848   2.205  -8.981
  234    H    CYS  35           HN       CYS  35   5.414  -1.739  -6.722
  235    HA   CYS  35           HA       CYS  35   4.770  -2.809  -4.123
  236   1HB   CYS  35           HB2      CYS  35   5.550  -4.267  -5.946
  237   2HB   CYS  35           HB1      CYS  35   7.087  -3.382  -6.030
  238    H    ASN  36           HN       ASN  36   7.994  -1.703  -5.296
  239    HA   ASN  36           HA       ASN  36   9.142  -1.292  -2.702
  240   1HB   ASN  36           HB2      ASN  36   9.536   0.070  -5.406
  241   2HB   ASN  36           HB1      ASN  36  10.601   0.345  -4.023
  242   1HD2  ASN  36          HD22      ASN  36  11.647  -2.648  -6.246
  243   2HD2  ASN  36          HD21      ASN  36  11.006  -1.149  -6.719
  244    H    LYS  37           HN       LYS  37   7.642   1.162  -4.802
  245    HA   LYS  37           HA       LYS  37   7.768   3.366  -3.060
  246   1HB   LYS  37           HB2      LYS  37   7.403   3.205  -5.552
  247   2HB   LYS  37           HB1      LYS  37   5.722   2.816  -5.196
  248   1HG   LYS  37           HG2      LYS  37   7.040   5.296  -4.077
  249   2HG   LYS  37           HG1      LYS  37   6.279   5.295  -5.667
  250   1HD   LYS  37           HD2      LYS  37   4.259   4.206  -4.337
  251   2HD   LYS  37           HD1      LYS  37   5.019   5.004  -2.963
  252   1HE   LYS  37           HE2      LYS  37   4.433   6.498  -5.538
  253   2HE   LYS  37           HE1      LYS  37   3.250   6.387  -4.219
  254   1HZ   LYS  37           HZ2      LYS  37   5.016   7.150  -2.691
  255   2HZ   LYS  37           HZ1      LYS  37   6.034   7.410  -4.025
  256   3HZ   LYS  37           HZ3      LYS  37   4.610   8.315  -3.858
  257    H    ASN  38           HN       ASN  38   4.570   2.173  -4.063
  258    HA   ASN  38           HA       ASN  38   3.153   3.304  -1.982
  259   1HB   ASN  38           HB2      ASN  38   2.804   1.186  -3.985
  260   2HB   ASN  38           HB1      ASN  38   1.496   1.550  -2.855
  261   1HD2  ASN  38          HD22      ASN  38   2.281   4.018  -5.957
  262   2HD2  ASN  38          HD21      ASN  38   3.154   2.581  -5.693
  263    H    CYS  39           HN       CYS  39   4.712   0.218  -2.173
  264    HA   CYS  39           HA       CYS  39   3.333  -1.256  -0.209
  265   1HB   CYS  39           HB2      CYS  39   6.266  -1.014  -0.824
  266   2HB   CYS  39           HB1      CYS  39   5.662  -2.173   0.364
  267    H    THR  40           HN       THR  40   5.432   1.509   0.321
  268    HA   THR  40           HA       THR  40   5.702   1.090   3.201
  269    HB   THR  40           HB       THR  40   6.502   3.551   2.988
  270    HG1  THR  40           HG1      THR  40   5.467   4.089   1.107
  271   1HG2  THR  40          HG22      THR  40   7.758   1.220   1.494
  272   2HG2  THR  40          HG21      THR  40   8.566   2.781   1.637
  273   3HG2  THR  40          HG23      THR  40   8.184   1.851   3.086
   
  No H/Q in entry =         273
  Start of MODEL    8
    1   1H    ASP   1           HT1      ASP   1   9.634   4.471   6.543
    2   2H    ASP   1           HT3      ASP   1   9.563   3.951   8.155
    3   3H    ASP   1           HT2      ASP   1  10.943   3.626   7.219
    4    HA   ASP   1           HA       ASP   1   9.597   1.626   7.419
    5   1HB   ASP   1           HB2      ASP   1   7.565   3.247   7.715
    6   2HB   ASP   1           HB1      ASP   1   7.450   3.156   5.958
    7    H    ASP   2           HN       ASP   2  10.623   0.437   5.871
    8    HA   ASP   2           HA       ASP   2  10.122   0.990   3.000
    9   1HB   ASP   2           HB2      ASP   2  12.766   1.322   4.484
   10   2HB   ASP   2           HB1      ASP   2  12.747   0.960   2.750
   11    H    GLY   3           HN       GLY   3  12.083  -0.702   1.944
   12   1HA   GLY   3           HA2      GLY   3  12.711  -3.076   3.227
   13   2HA   GLY   3           HA1      GLY   3  11.055  -3.317   2.686
   14    H    LEU   4           HN       LEU   4  11.662  -4.934   1.199
   15    HA   LEU   4           HA       LEU   4  13.105  -3.955  -1.234
   16   1HB   LEU   4           HB2      LEU   4  13.222  -6.758  -0.082
   17   2HB   LEU   4           HB1      LEU   4  14.243  -6.063  -1.337
   18    HG   LEU   4           HG       LEU   4  14.185  -4.876   1.440
   19   1HD1  LEU   4          HD13      LEU   4  15.422  -7.403   0.508
   20   2HD1  LEU   4          HD12      LEU   4  16.480  -6.323   1.417
   21   3HD1  LEU   4          HD11      LEU   4  14.976  -6.899   2.138
   22   1HD2  LEU   4          HD23      LEU   4  15.867  -4.683  -1.028
   23   2HD2  LEU   4          HD22      LEU   4  15.372  -3.412   0.092
   24   3HD2  LEU   4          HD21      LEU   4  16.675  -4.518   0.530
   25    H    CYS   5           HN       CYS   5  12.595  -5.794  -3.104
   26    HA   CYS   5           HA       CYS   5   9.716  -6.637  -2.811
   27   1HB   CYS   5           HB2      CYS   5   9.995  -4.384  -3.975
   28   2HB   CYS   5           HB1      CYS   5  10.814  -5.247  -5.275
   29    H    TYR   6           HN       TYR   6   9.124  -8.407  -4.061
   30    HA   TYR   6           HA       TYR   6  11.285  -9.770  -5.630
   31   1HB   TYR   6           HB2      TYR   6  10.903 -11.826  -4.419
   32   2HB   TYR   6           HB1      TYR   6  11.132 -10.560  -3.225
   33    HD1  TYR   6           HD1      TYR   6   8.656 -12.706  -4.920
   34    HD2  TYR   6           HD2      TYR   6   9.368  -9.931  -1.742
   35    HE1  TYR   6           HE1      TYR   6   6.472 -13.314  -3.915
   36    HE2  TYR   6           HE2      TYR   6   7.174 -10.520  -0.726
   37    HH   TYR   6           HH       TYR   6   5.635 -12.752  -0.872
   38    H    GLU   7           HN       GLU   7  10.265 -11.537  -7.057
   39    HA   GLU   7           HA       GLU   7   7.459 -10.721  -7.772
   40   1HB   GLU   7           HB2      GLU   7   8.142 -10.857 -10.041
   41   2HB   GLU   7           HB1      GLU   7   9.496 -10.080  -9.236
   42   1HG   GLU   7           HG2      GLU   7  10.457 -12.491  -9.051
   43   2HG   GLU   7           HG1      GLU   7   9.200 -12.869 -10.245
   44    H    GLY   8           HN       GLY   8   6.065 -12.347  -8.449
   45   1HA   GLY   8           HA2      GLY   8   6.367 -14.914  -9.156
   46   2HA   GLY   8           HA1      GLY   8   6.706 -15.044  -7.433
   47    H    THR   9           HN       THR   9   4.928 -15.727  -6.332
   48    HA   THR   9           HA       THR   9   2.271 -14.549  -6.880
   49    HB   THR   9           HB       THR   9   3.059 -17.439  -7.109
   50    HG1  THR   9           HG1      THR   9   2.064 -15.612  -9.031
   51   1HG2  THR   9          HG23      THR   9   0.434 -16.151  -6.753
   52   2HG2  THR   9          HG22      THR   9   0.512 -17.237  -8.140
   53   3HG2  THR   9          HG21      THR   9   0.900 -17.837  -6.528
   54    H    ASN  10           HN       ASN  10   4.332 -14.886  -4.494
   55    HA   ASN  10           HA       ASN  10   3.145 -16.799  -2.677
   56   1HB   ASN  10           HB2      ASN  10   5.494 -15.967  -2.772
   57   2HB   ASN  10           HB1      ASN  10   4.936 -14.450  -2.068
   58   1HD2  ASN  10          HD22      ASN  10   4.747 -15.829   1.239
   59   2HD2  ASN  10          HD21      ASN  10   4.579 -14.411   0.256
   60    H    CYS  11           HN       CYS  11   2.079 -13.755  -3.525
   61    HA   CYS  11           HA       CYS  11   0.393 -13.627  -1.052
   62   1HB   CYS  11           HB2      CYS  11   1.856 -11.493  -2.591
   63   2HB   CYS  11           HB1      CYS  11   0.468 -11.067  -1.583
   64    H    GLY  12           HN       GLY  12   0.020 -14.827  -3.731
   65   1HA   GLY  12           HA2      GLY  12  -1.922 -15.057  -5.075
   66   2HA   GLY  12           HA1      GLY  12  -2.669 -13.821  -4.050
   67    H    LYS  13           HN       LYS  13   0.345 -12.906  -5.214
   68    HA   LYS  13           HA       LYS  13  -0.776 -10.821  -6.884
   69   1HB   LYS  13           HB2      LYS  13   1.488  -9.980  -6.748
   70   2HB   LYS  13           HB1      LYS  13   0.932 -10.549  -5.186
   71   1HG   LYS  13           HG2      LYS  13   2.214 -12.565  -5.328
   72   2HG   LYS  13           HG1      LYS  13   2.527 -12.304  -7.038
   73   1HD   LYS  13           HD2      LYS  13   3.465 -10.014  -5.755
   74   2HD   LYS  13           HD1      LYS  13   3.964 -11.351  -4.731
   75   1HE   LYS  13           HE2      LYS  13   5.609 -10.730  -6.595
   76   2HE   LYS  13           HE1      LYS  13   5.115 -12.432  -6.558
   77   1HZ   LYS  13           HZ2      LYS  13   3.358 -10.643  -8.034
   78   2HZ   LYS  13           HZ1      LYS  13   4.888 -10.886  -8.728
   79   3HZ   LYS  13           HZ3      LYS  13   3.882 -12.215  -8.418
   80    H    VAL  14           HN       VAL  14  -1.338 -13.080  -8.111
   81    HA   VAL  14           HA       VAL  14   0.634 -14.077  -9.983
   82    HB   VAL  14           HB       VAL  14  -2.394 -14.034  -9.849
   83   1HG1  VAL  14          HG12      VAL  14  -0.798 -14.593 -12.154
   84   2HG1  VAL  14          HG11      VAL  14  -1.443 -16.125 -11.569
   85   3HG1  VAL  14          HG13      VAL  14  -2.538 -14.799 -11.963
   86   1HG2  VAL  14          HG21      VAL  14  -0.647 -15.451  -8.336
   87   2HG2  VAL  14          HG23      VAL  14  -2.244 -16.054  -8.781
   88   3HG2  VAL  14          HG22      VAL  14  -0.826 -16.554  -9.701
   89    H    GLY  15           HN       GLY  15   1.618 -12.615 -11.408
   90   1HA   GLY  15           HA2      GLY  15   1.352 -11.421 -13.549
   91   2HA   GLY  15           HA1      GLY  15  -0.264 -10.933 -13.036
   92    H    LYS  16           HN       LYS  16   1.048 -10.266 -10.243
   93    HA   LYS  16           HA       LYS  16   2.208  -7.647 -11.154
   94   1HB   LYS  16           HB2      LYS  16   0.584  -8.228  -8.685
   95   2HB   LYS  16           HB1      LYS  16   1.135  -6.655  -9.249
   96   1HG   LYS  16           HG2      LYS  16  -0.215  -6.881 -11.287
   97   2HG   LYS  16           HG1      LYS  16  -0.794  -8.453 -10.736
   98   1HD   LYS  16           HD2      LYS  16  -1.126  -5.977  -9.038
   99   2HD   LYS  16           HD1      LYS  16  -2.307  -6.407 -10.277
  100   1HE   LYS  16           HE2      LYS  16  -2.988  -8.338  -9.151
  101   2HE   LYS  16           HE1      LYS  16  -1.450  -8.496  -8.283
  102   1HZ   LYS  16           HZ3      LYS  16  -2.929  -6.023  -7.847
  103   2HZ   LYS  16           HZ2      LYS  16  -3.618  -7.425  -7.180
  104   3HZ   LYS  16           HZ1      LYS  16  -2.041  -6.965  -6.750
  105    H    TYR  17           HN       TYR  17   2.816  -7.156  -8.088
  106    HA   TYR  17           HA       TYR  17   4.923  -9.231  -7.715
  107   1HB   TYR  17           HB2      TYR  17   5.551  -6.275  -7.696
  108   2HB   TYR  17           HB1      TYR  17   6.655  -7.659  -7.647
  109    HD1  TYR  17           HD1      TYR  17   4.296  -5.819  -9.889
  110    HD2  TYR  17           HD2      TYR  17   7.297  -8.837  -9.520
  111    HE1  TYR  17           HE1      TYR  17   4.458  -5.971 -12.362
  112    HE2  TYR  17           HE2      TYR  17   7.479  -8.998 -11.960
  113    HH   TYR  17           HH       TYR  17   7.005  -7.580 -13.937
  114    H    CYS  18           HN       CYS  18   6.087  -8.722  -5.387
  115    HA   CYS  18           HA       CYS  18   4.039  -7.486  -3.567
  116   1HB   CYS  18           HB2      CYS  18   5.362 -10.223  -3.472
  117   2HB   CYS  18           HB1      CYS  18   4.524  -9.523  -2.084
  118    H    CYS  19           HN       CYS  19   4.953  -6.974  -1.416
  119    HA   CYS  19           HA       CYS  19   7.907  -6.713  -1.394
  120   1HB   CYS  19           HB2      CYS  19   7.360  -4.390  -0.324
  121   2HB   CYS  19           HB1      CYS  19   7.180  -4.586  -2.068
  122    H    SER  20           HN       SER  20   8.725  -7.643   0.429
  123    HA   SER  20           HA       SER  20   7.599  -7.182   3.079
  124   1HB   SER  20           HB2      SER  20   7.160  -9.689   3.445
  125   2HB   SER  20           HB1      SER  20   6.041  -8.899   2.332
  126    HG   SER  20           HG       SER  20   8.141 -10.680   1.816
  127    HA   PRO  21           HA       PRO  21  11.955  -8.063   3.385
  128   1HB   PRO  21           HB2      PRO  21  12.339  -7.231   5.967
  129   2HB   PRO  21           HB1      PRO  21  12.184  -6.114   4.593
  130   1HG   PRO  21           HG2      PRO  21  10.179  -6.794   6.686
  131   2HG   PRO  21           HG1      PRO  21  10.410  -5.292   5.769
  132   1HD   PRO  21           HD2      PRO  21   8.479  -7.288   5.297
  133   2HD   PRO  21           HD1      PRO  21   8.904  -5.954   4.197
  134    H    ILE  22           HN       ILE  22   9.462  -9.668   4.845
  135    HA   ILE  22           HA       ILE  22  11.131 -11.963   5.495
  136    HB   ILE  22           HB       ILE  22  11.312 -10.295   7.420
  137   1HG1  ILE  22          HG12      ILE  22  10.135 -13.048   7.994
  138   2HG1  ILE  22          HG11      ILE  22  11.849 -12.637   7.897
  139   1HG2  ILE  22          HG21      ILE  22   8.588 -10.162   7.028
  140   2HG2  ILE  22          HG23      ILE  22   8.727 -11.110   8.509
  141   3HG2  ILE  22          HG22      ILE  22   9.460  -9.508   8.416
  142   1HD1  ILE  22          HD12      ILE  22  11.539 -11.091   9.846
  143   2HD1  ILE  22          HD11      ILE  22   9.873 -11.656   9.981
  144   3HD1  ILE  22          HD13      ILE  22  11.209 -12.778  10.241
  145    H    GLY  23           HN       GLY  23   8.540 -10.916   4.223
  146   1HA   GLY  23           HA2      GLY  23   6.593 -12.044   3.412
  147   2HA   GLY  23           HA1      GLY  23   7.106 -13.428   4.367
  148    H    LYS  24           HN       LYS  24   7.056 -10.607   6.204
  149    HA   LYS  24           HA       LYS  24   4.707 -11.562   7.664
  150   1HB   LYS  24           HB2      LYS  24   5.403 -10.034   9.363
  151   2HB   LYS  24           HB1      LYS  24   6.848 -10.803   8.720
  152   1HG   LYS  24           HG2      LYS  24   7.158  -8.818   7.205
  153   2HG   LYS  24           HG1      LYS  24   5.795  -8.050   8.016
  154   1HD   LYS  24           HD2      LYS  24   7.993  -9.123   9.725
  155   2HD   LYS  24           HD1      LYS  24   8.304  -7.639   8.826
  156   1HE   LYS  24           HE2      LYS  24   5.981  -6.872   9.779
  157   2HE   LYS  24           HE1      LYS  24   6.269  -8.139  10.989
  158   1HZ   LYS  24           HZ1      LYS  24   8.273  -6.076  10.248
  159   2HZ   LYS  24           HZ3      LYS  24   7.240  -5.938  11.585
  160   3HZ   LYS  24           HZ2      LYS  24   8.377  -7.198  11.519
  161    H    TYR  25           HN       TYR  25   5.609  -8.778   5.686
  162    HA   TYR  25           HA       TYR  25   3.074  -7.393   6.192
  163   1HB   TYR  25           HB2      TYR  25   5.546  -6.918   4.545
  164   2HB   TYR  25           HB1      TYR  25   4.126  -5.888   4.366
  165    HD1  TYR  25           HD2      TYR  25   3.218  -4.668   6.380
  166    HD2  TYR  25           HD1      TYR  25   7.004  -6.685   6.410
  167    HE1  TYR  25           HE2      TYR  25   3.878  -3.387   8.404
  168    HE2  TYR  25           HE1      TYR  25   7.678  -5.395   8.438
  169    HH   TYR  25           HH       TYR  25   6.645  -4.196  10.266
  170    H    CYS  26           HN       CYS  26   4.575  -9.161   3.470
  171    HA   CYS  26           HA       CYS  26   3.639  -9.806   1.362
  172   1HB   CYS  26           HB2      CYS  26   2.716 -11.459   2.939
  173   2HB   CYS  26           HB1      CYS  26   1.420 -10.348   3.399
  174    H    VAL  27           HN       VAL  27   3.579  -7.230   1.019
  175    HA   VAL  27           HA       VAL  27   0.711  -6.416   0.556
  176    HB   VAL  27           HB       VAL  27   3.243  -4.773   0.920
  177   1HG1  VAL  27          HG12      VAL  27   0.922  -4.078  -0.397
  178   2HG1  VAL  27          HG11      VAL  27   0.614  -3.499   1.241
  179   3HG1  VAL  27          HG13      VAL  27   2.037  -2.938   0.361
  180   1HG2  VAL  27          HG21      VAL  27   1.092  -5.726   2.767
  181   2HG2  VAL  27          HG23      VAL  27   2.809  -5.481   3.078
  182   3HG2  VAL  27          HG22      VAL  27   1.720  -4.096   3.011
  183    H    CYS  28           HN       CYS  28   0.231  -6.694  -1.607
  184    HA   CYS  28           HA       CYS  28   2.477  -6.326  -3.559
  185   1HB   CYS  28           HB2      CYS  28  -0.085  -7.909  -3.829
  186   2HB   CYS  28           HB1      CYS  28   1.349  -8.039  -4.844
  187    H    TYR  29           HN       TYR  29   1.923  -5.556  -5.678
  188    HA   TYR  29           HA       TYR  29  -0.566  -3.972  -5.967
  189   1HB   TYR  29           HB2      TYR  29   2.255  -2.968  -6.208
  190   2HB   TYR  29           HB1      TYR  29   0.819  -2.077  -6.661
  191    HD1  TYR  29           HD1      TYR  29   2.587  -3.656  -3.863
  192    HD2  TYR  29           HD2      TYR  29  -0.453  -0.919  -5.083
  193    HE1  TYR  29           HE1      TYR  29   2.439  -2.807  -1.549
  194    HE2  TYR  29           HE2      TYR  29  -0.630  -0.055  -2.774
  195    HH   TYR  29           HH       TYR  29   0.225  -1.494  -0.206
  196    H    ASP  30           HN       ASP  30  -0.451  -2.995  -8.353
  197    HA   ASP  30           HA       ASP  30   0.300  -5.172 -10.138
  198   1HB   ASP  30           HB2      ASP  30  -0.976  -4.024 -11.718
  199   2HB   ASP  30           HB1      ASP  30  -1.785  -3.722 -10.183
  200    H    SER  31           HN       SER  31   1.392  -1.824  -9.629
  201    HA   SER  31           HA       SER  31   3.427  -2.051 -11.763
  202   1HB   SER  31           HB2      SER  31   3.291   0.041  -9.650
  203   2HB   SER  31           HB1      SER  31   3.846   0.198 -11.308
  204    HG   SER  31           HG       SER  31   1.560   0.890 -10.569
  205    H    LYS  32           HN       LYS  32   5.349  -3.302 -11.329
  206    HA   LYS  32           HA       LYS  32   6.069  -4.245  -8.762
  207   1HB   LYS  32           HB2      LYS  32   8.170  -4.839  -9.807
  208   2HB   LYS  32           HB1      LYS  32   7.024  -4.771 -11.151
  209   1HG   LYS  32           HG2      LYS  32   7.853  -2.685 -11.909
  210   2HG   LYS  32           HG1      LYS  32   8.692  -2.372 -10.390
  211   1HD   LYS  32           HD2      LYS  32  10.428  -3.073 -11.879
  212   2HD   LYS  32           HD1      LYS  32  10.058  -4.525 -10.935
  213   1HE   LYS  32           HE2      LYS  32   8.646  -5.409 -12.739
  214   2HE   LYS  32           HE1      LYS  32   8.816  -3.899 -13.659
  215   1HZ   LYS  32           HZ2      LYS  32  11.264  -4.245 -13.550
  216   2HZ   LYS  32           HZ1      LYS  32  10.979  -5.789 -12.899
  217   3HZ   LYS  32           HZ3      LYS  32  10.445  -5.420 -14.467
  218    H    ALA  33           HN       ALA  33   6.706  -1.143 -10.350
  219    HA   ALA  33           HA       ALA  33   8.444   0.040  -8.461
  220   1HB   ALA  33           HB2      ALA  33   7.694   0.840 -10.786
  221   2HB   ALA  33           HB1      ALA  33   6.181   1.337 -10.024
  222   3HB   ALA  33           HB3      ALA  33   7.701   2.091  -9.540
  223    H    ILE  34           HN       ILE  34   4.792  -0.042  -8.630
  224    HA   ILE  34           HA       ILE  34   4.382   1.520  -6.339
  225    HB   ILE  34           HB       ILE  34   2.967  -0.613  -7.804
  226   1HG1  ILE  34          HG12      ILE  34   2.780   2.379  -7.478
  227   2HG1  ILE  34          HG11      ILE  34   2.955   1.445  -8.959
  228   1HG2  ILE  34          HG22      ILE  34   2.362  -0.631  -5.304
  229   2HG2  ILE  34          HG21      ILE  34   1.762   1.006  -5.536
  230   3HG2  ILE  34          HG23      ILE  34   1.016  -0.333  -6.400
  231   1HD1  ILE  34          HD11      ILE  34   0.678   0.445  -8.429
  232   2HD1  ILE  34          HD13      ILE  34   0.527   1.696  -7.197
  233   3HD1  ILE  34          HD12      ILE  34   0.680   2.147  -8.898
  234    H    CYS  35           HN       CYS  35   5.399  -1.687  -6.751
  235    HA   CYS  35           HA       CYS  35   4.854  -2.761  -4.125
  236   1HB   CYS  35           HB2      CYS  35   5.615  -4.210  -5.966
  237   2HB   CYS  35           HB1      CYS  35   7.130  -3.294  -6.092
  238    H    ASN  36           HN       ASN  36   8.023  -1.611  -5.398
  239    HA   ASN  36           HA       ASN  36   9.220  -1.148  -2.823
  240   1HB   ASN  36           HB2      ASN  36  10.485  -1.173  -4.930
  241   2HB   ASN  36           HB1      ASN  36   9.583   0.224  -5.534
  242   1HD2  ASN  36          HD22      ASN  36  12.283   2.166  -4.296
  243   2HD2  ASN  36          HD21      ASN  36  11.458   1.617  -5.675
  244    H    LYS  37           HN       LYS  37   7.657   1.238  -4.951
  245    HA   LYS  37           HA       LYS  37   7.811   3.499  -3.296
  246   1HB   LYS  37           HB2      LYS  37   7.345   3.231  -5.766
  247   2HB   LYS  37           HB1      LYS  37   5.685   2.841  -5.322
  248   1HG   LYS  37           HG2      LYS  37   7.017   5.381  -4.370
  249   2HG   LYS  37           HG1      LYS  37   6.196   5.302  -5.927
  250   1HD   LYS  37           HD2      LYS  37   4.318   4.172  -4.299
  251   2HD   LYS  37           HD1      LYS  37   5.060   5.330  -3.197
  252   1HE   LYS  37           HE2      LYS  37   4.748   7.093  -5.026
  253   2HE   LYS  37           HE1      LYS  37   3.741   5.901  -5.873
  254   1HZ   LYS  37           HZ3      LYS  37   2.497   5.627  -3.752
  255   2HZ   LYS  37           HZ2      LYS  37   3.350   6.955  -3.124
  256   3HZ   LYS  37           HZ1      LYS  37   2.317   7.158  -4.459
  257    H    ASN  38           HN       ASN  38   4.593   2.204  -4.109
  258    HA   ASN  38           HA       ASN  38   3.267   3.387  -1.992
  259   1HB   ASN  38           HB2      ASN  38   2.839   1.222  -3.926
  260   2HB   ASN  38           HB1      ASN  38   1.586   1.595  -2.738
  261   1HD2  ASN  38          HD22      ASN  38   2.197   4.020  -5.915
  262   2HD2  ASN  38          HD21      ASN  38   3.103   2.602  -5.669
  263    H    CYS  39           HN       CYS  39   4.805   0.281  -2.199
  264    HA   CYS  39           HA       CYS  39   3.555  -1.087  -0.066
  265   1HB   CYS  39           HB2      CYS  39   6.436  -0.962  -0.921
  266   2HB   CYS  39           HB1      CYS  39   5.870  -2.093   0.311
  267    H    THR  40           HN       THR  40   5.743   1.649   0.157
  268    HA   THR  40           HA       THR  40   6.310   1.322   3.006
  269    HB   THR  40           HB       THR  40   7.164   3.711   2.668
  270    HG1  THR  40           HG1      THR  40   7.264   4.256   0.383
  271   1HG2  THR  40          HG22      THR  40   8.115   1.217   1.438
  272   2HG2  THR  40          HG21      THR  40   8.675   2.645   0.565
  273   3HG2  THR  40          HG23      THR  40   9.030   2.468   2.283
   
  No H/Q in entry =         273
  Start of MODEL    9
    1   1H    ASP   1           HT3      ASP   1  12.853   2.262   6.264
    2   2H    ASP   1           HT2      ASP   1  12.802   3.835   5.624
    3   3H    ASP   1           HT1      ASP   1  12.603   3.588   7.291
    4    HA   ASP   1           HA       ASP   1  10.489   2.578   7.002
    5   1HB   ASP   1           HB2      ASP   1   9.334   4.496   6.005
    6   2HB   ASP   1           HB1      ASP   1  10.724   5.064   6.928
    7    H    ASP   2           HN       ASP   2  12.459   2.576   4.158
    8    HA   ASP   2           HA       ASP   2  10.331   1.631   2.347
    9   1HB   ASP   2           HB2      ASP   2  13.398   1.717   2.068
   10   2HB   ASP   2           HB1      ASP   2  12.250   1.507   0.740
   11    H    GLY   3           HN       GLY   3  12.447  -0.356   1.205
   12   1HA   GLY   3           HA2      GLY   3  13.091  -2.408   2.952
   13   2HA   GLY   3           HA1      GLY   3  11.410  -2.718   2.540
   14    H    LEU   4           HN       LEU   4  11.659  -4.507   1.194
   15    HA   LEU   4           HA       LEU   4  13.254  -4.067  -1.302
   16   1HB   LEU   4           HB2      LEU   4  13.004  -6.700   0.174
   17   2HB   LEU   4           HB1      LEU   4  14.138  -6.275  -1.104
   18    HG   LEU   4           HG       LEU   4  14.143  -4.792   1.528
   19   1HD1  LEU   4          HD12      LEU   4  15.043  -7.540   0.949
   20   2HD1  LEU   4          HD11      LEU   4  16.262  -6.510   1.700
   21   3HD1  LEU   4          HD13      LEU   4  14.709  -6.764   2.497
   22   1HD2  LEU   4          HD22      LEU   4  15.825  -4.973  -0.912
   23   2HD2  LEU   4          HD21      LEU   4  15.584  -3.616   0.188
   24   3HD2  LEU   4          HD23      LEU   4  16.702  -4.910   0.616
   25    H    CYS   5           HN       CYS   5  12.569  -6.026  -2.930
   26    HA   CYS   5           HA       CYS   5   9.662  -6.688  -2.628
   27   1HB   CYS   5           HB2      CYS   5   9.936  -4.453  -3.811
   28   2HB   CYS   5           HB1      CYS   5  10.769  -5.312  -5.103
   29    H    TYR   6           HN       TYR   6   9.036  -8.479  -3.898
   30    HA   TYR   6           HA       TYR   6  11.188  -9.798  -5.500
   31   1HB   TYR   6           HB2      TYR   6  11.027 -11.835  -4.262
   32   2HB   TYR   6           HB1      TYR   6  11.140 -10.557  -3.068
   33    HD1  TYR   6           HD2      TYR   6   9.233  -9.978  -1.675
   34    HD2  TYR   6           HD1      TYR   6   8.997 -13.082  -4.610
   35    HE1  TYR   6           HE2      TYR   6   7.139 -10.800  -0.621
   36    HE2  TYR   6           HE1      TYR   6   6.918 -13.929  -3.559
   37    HH   TYR   6           HH       TYR   6   5.921 -13.081  -0.516
   38    H    GLU   7           HN       GLU   7  10.211 -11.549  -6.931
   39    HA   GLU   7           HA       GLU   7   7.347 -10.843  -7.551
   40   1HB   GLU   7           HB2      GLU   7   7.992 -10.849  -9.832
   41   2HB   GLU   7           HB1      GLU   7   9.323 -10.046  -9.012
   42   1HG   GLU   7           HG2      GLU   7  10.398 -12.415  -8.957
   43   2HG   GLU   7           HG1      GLU   7   9.141 -12.796 -10.149
   44    H    GLY   8           HN       GLY   8   6.036 -12.486  -8.400
   45   1HA   GLY   8           HA2      GLY   8   6.482 -15.014  -9.187
   46   2HA   GLY   8           HA1      GLY   8   6.750 -15.196  -7.456
   47    H    THR   9           HN       THR   9   4.955 -15.930  -6.418
   48    HA   THR   9           HA       THR   9   2.278 -14.874  -7.123
   49    HB   THR   9           HB       THR   9   3.210 -17.730  -7.240
   50    HG1  THR   9           HG1      THR   9   2.343 -15.888  -9.204
   51   1HG2  THR   9          HG23      THR   9   0.541 -16.618  -6.910
   52   2HG2  THR   9          HG22      THR   9   0.666 -17.535  -8.411
   53   3HG2  THR   9          HG21      THR   9   1.056 -18.304  -6.873
   54    H    ASN  10           HN       ASN  10   4.303 -15.221  -4.620
   55    HA   ASN  10           HA       ASN  10   2.936 -17.056  -2.844
   56   1HB   ASN  10           HB2      ASN  10   5.332 -16.385  -2.835
   57   2HB   ASN  10           HB1      ASN  10   4.849 -14.817  -2.190
   58   1HD2  ASN  10          HD22      ASN  10   4.427 -16.095   1.134
   59   2HD2  ASN  10          HD21      ASN  10   4.397 -14.694   0.114
   60    H    CYS  11           HN       CYS  11   2.119 -13.945  -3.757
   61    HA   CYS  11           HA       CYS  11   0.344 -13.691  -1.356
   62   1HB   CYS  11           HB2      CYS  11   1.986 -11.672  -2.872
   63   2HB   CYS  11           HB1      CYS  11   0.592 -11.149  -1.916
   64    H    GLY  12           HN       GLY  12   0.049 -14.864  -4.094
   65   1HA   GLY  12           HA2      GLY  12  -1.841 -15.009  -5.514
   66   2HA   GLY  12           HA1      GLY  12  -2.596 -13.790  -4.476
   67    H    LYS  13           HN       LYS  13   0.501 -12.949  -5.597
   68    HA   LYS  13           HA       LYS  13  -0.598 -10.768  -7.174
   69   1HB   LYS  13           HB2      LYS  13   1.566  -9.864  -6.929
   70   2HB   LYS  13           HB1      LYS  13   1.205 -10.736  -5.452
   71   1HG   LYS  13           HG2      LYS  13   2.378 -12.745  -6.540
   72   2HG   LYS  13           HG1      LYS  13   2.996 -11.587  -7.705
   73   1HD   LYS  13           HD2      LYS  13   3.701 -10.254  -5.559
   74   2HD   LYS  13           HD1      LYS  13   3.579 -11.831  -4.784
   75   1HE   LYS  13           HE2      LYS  13   5.030 -12.716  -6.708
   76   2HE   LYS  13           HE1      LYS  13   5.387 -11.018  -7.067
   77   1HZ   LYS  13           HZ3      LYS  13   5.576 -12.057  -4.315
   78   2HZ   LYS  13           HZ2      LYS  13   6.873 -12.238  -5.397
   79   3HZ   LYS  13           HZ1      LYS  13   6.317 -10.688  -4.986
   80    H    VAL  14           HN       VAL  14  -1.207 -13.008  -8.450
   81    HA   VAL  14           HA       VAL  14   0.712 -13.932 -10.413
   82    HB   VAL  14           HB       VAL  14  -2.305 -13.917 -10.151
   83   1HG1  VAL  14          HG13      VAL  14  -0.610 -14.796 -12.465
   84   2HG1  VAL  14          HG12      VAL  14  -2.025 -15.760 -12.043
   85   3HG1  VAL  14          HG11      VAL  14  -2.213 -14.058 -12.469
   86   1HG2  VAL  14          HG22      VAL  14  -0.637 -15.404  -8.760
   87   2HG2  VAL  14          HG21      VAL  14  -2.094 -16.130  -9.437
   88   3HG2  VAL  14          HG23      VAL  14  -0.542 -16.351 -10.246
   89    H    GLY  15           HN       GLY  15   1.653 -12.413 -11.805
   90   1HA   GLY  15           HA2      GLY  15   1.341 -11.106 -13.873
   91   2HA   GLY  15           HA1      GLY  15  -0.264 -10.648 -13.299
   92    H    LYS  16           HN       LYS  16   1.055 -10.143 -10.505
   93    HA   LYS  16           HA       LYS  16   2.302  -7.515 -11.241
   94   1HB   LYS  16           HB2      LYS  16   0.548  -8.139  -8.875
   95   2HB   LYS  16           HB1      LYS  16   1.154  -6.563  -9.368
   96   1HG   LYS  16           HG2      LYS  16  -0.133  -6.655 -11.436
   97   2HG   LYS  16           HG1      LYS  16  -0.713  -8.271 -11.032
   98   1HD   LYS  16           HD2      LYS  16  -1.176  -5.891  -9.221
   99   2HD   LYS  16           HD1      LYS  16  -2.309  -6.343 -10.495
  100   1HE   LYS  16           HE2      LYS  16  -1.436  -8.564  -8.722
  101   2HE   LYS  16           HE1      LYS  16  -2.479  -7.336  -7.976
  102   1HZ   LYS  16           HZ3      LYS  16  -3.030  -8.584 -10.613
  103   2HZ   LYS  16           HZ2      LYS  16  -3.713  -9.135  -9.158
  104   3HZ   LYS  16           HZ1      LYS  16  -4.057  -7.570  -9.724
  105    H    TYR  17           HN       TYR  17   2.804  -7.139  -8.161
  106    HA   TYR  17           HA       TYR  17   4.770  -9.351  -7.747
  107   1HB   TYR  17           HB2      TYR  17   5.568  -6.431  -7.638
  108   2HB   TYR  17           HB1      TYR  17   6.589  -7.877  -7.576
  109    HD1  TYR  17           HD1      TYR  17   4.411  -5.877  -9.867
  110    HD2  TYR  17           HD2      TYR  17   7.265  -9.028  -9.451
  111    HE1  TYR  17           HE1      TYR  17   4.689  -5.960 -12.333
  112    HE2  TYR  17           HE2      TYR  17   7.564  -9.118 -11.885
  113    HH   TYR  17           HH       TYR  17   5.486  -7.922 -14.027
  114    H    CYS  18           HN       CYS  18   5.930  -8.840  -5.370
  115    HA   CYS  18           HA       CYS  18   3.857  -7.608  -3.591
  116   1HB   CYS  18           HB2      CYS  18   5.156 -10.353  -3.450
  117   2HB   CYS  18           HB1      CYS  18   4.248  -9.648  -2.112
  118    H    CYS  19           HN       CYS  19   4.749  -7.073  -1.444
  119    HA   CYS  19           HA       CYS  19   7.704  -6.906  -1.361
  120   1HB   CYS  19           HB2      CYS  19   7.217  -4.507  -0.443
  121   2HB   CYS  19           HB1      CYS  19   7.072  -4.796  -2.179
  122    H    SER  20           HN       SER  20   8.470  -7.638   0.563
  123    HA   SER  20           HA       SER  20   7.267  -6.971   3.120
  124   1HB   SER  20           HB2      SER  20   6.824  -9.469   3.662
  125   2HB   SER  20           HB1      SER  20   5.694  -8.712   2.538
  126    HG   SER  20           HG       SER  20   6.348 -10.623   1.627
  127    HA   PRO  21           HA       PRO  21  11.595  -7.792   3.581
  128   1HB   PRO  21           HB2      PRO  21  11.902  -6.930   6.161
  129   2HB   PRO  21           HB1      PRO  21  11.771  -5.831   4.773
  130   1HG   PRO  21           HG2      PRO  21   9.697  -6.546   6.797
  131   2HG   PRO  21           HG1      PRO  21   9.967  -5.024   5.924
  132   1HD   PRO  21           HD2      PRO  21   8.035  -6.951   5.326
  133   2HD   PRO  21           HD1      PRO  21   8.584  -5.665   4.224
  134    H    ILE  22           HN       ILE  22   9.741  -8.504   6.517
  135    HA   ILE  22           HA       ILE  22  11.238 -11.037   6.820
  136    HB   ILE  22           HB       ILE  22  10.688  -9.597   8.815
  137   1HG1  ILE  22          HG12      ILE  22   9.322 -12.322   8.839
  138   2HG1  ILE  22          HG11      ILE  22  11.025 -12.030   9.190
  139   1HG2  ILE  22          HG23      ILE  22   8.085  -9.770   7.565
  140   2HG2  ILE  22          HG22      ILE  22   7.998 -10.273   9.252
  141   3HG2  ILE  22          HG21      ILE  22   8.641  -8.685   8.837
  142   1HD1  ILE  22          HD11      ILE  22   8.768 -10.751  10.757
  143   2HD1  ILE  22          HD13      ILE  22   9.552 -12.256  11.237
  144   3HD1  ILE  22          HD12      ILE  22  10.483 -10.761  11.165
  145    H    GLY  23           HN       GLY  23   8.785 -10.113   5.039
  146   1HA   GLY  23           HA2      GLY  23   7.332 -11.373   3.619
  147   2HA   GLY  23           HA1      GLY  23   7.934 -12.813   4.425
  148    H    LYS  24           HN       LYS  24   6.891 -10.448   6.612
  149    HA   LYS  24           HA       LYS  24   4.567 -12.096   7.300
  150   1HB   LYS  24           HB2      LYS  24   4.610 -10.953   9.371
  151   2HB   LYS  24           HB1      LYS  24   6.291 -11.211   8.919
  152   1HG   LYS  24           HG2      LYS  24   6.340  -8.903   7.950
  153   2HG   LYS  24           HG1      LYS  24   4.698  -8.660   8.528
  154   1HD   LYS  24           HD2      LYS  24   7.192  -8.385   9.970
  155   2HD   LYS  24           HD1      LYS  24   5.575  -7.906  10.456
  156   1HE   LYS  24           HE2      LYS  24   6.582 -10.764  10.708
  157   2HE   LYS  24           HE1      LYS  24   6.686  -9.573  12.013
  158   1HZ   LYS  24           HZ2      LYS  24   4.111  -9.633  10.723
  159   2HZ   LYS  24           HZ1      LYS  24   4.509 -11.099  11.484
  160   3HZ   LYS  24           HZ3      LYS  24   4.498  -9.659  12.377
  161    H    TYR  25           HN       TYR  25   5.226  -8.991   5.823
  162    HA   TYR  25           HA       TYR  25   2.500  -7.989   6.223
  163   1HB   TYR  25           HB2      TYR  25   4.972  -7.068   4.776
  164   2HB   TYR  25           HB1      TYR  25   3.439  -6.217   4.584
  165    HD1  TYR  25           HD1      TYR  25   2.224  -5.449   6.752
  166    HD2  TYR  25           HD2      TYR  25   6.345  -6.631   6.609
  167    HE1  TYR  25           HE1      TYR  25   2.631  -4.268   8.900
  168    HE2  TYR  25           HE2      TYR  25   6.763  -5.444   8.766
  169    HH   TYR  25           HH       TYR  25   5.447  -4.711  10.733
  170    H    CYS  26           HN       CYS  26   4.323  -9.431   3.517
  171    HA   CYS  26           HA       CYS  26   3.575 -10.004   1.308
  172   1HB   CYS  26           HB2      CYS  26   2.653 -11.821   2.661
  173   2HB   CYS  26           HB1      CYS  26   1.302 -10.811   3.191
  174    H    VAL  27           HN       VAL  27   3.378  -7.462   0.983
  175    HA   VAL  27           HA       VAL  27   0.490  -6.736   0.499
  176    HB   VAL  27           HB       VAL  27   2.970  -5.038   0.955
  177   1HG1  VAL  27          HG13      VAL  27   0.665  -4.358  -0.412
  178   2HG1  VAL  27          HG12      VAL  27   0.319  -3.807   1.226
  179   3HG1  VAL  27          HG11      VAL  27   1.751  -3.217   0.381
  180   1HG2  VAL  27          HG23      VAL  27   1.693  -6.443   2.851
  181   2HG2  VAL  27          HG22      VAL  27   2.322  -4.826   3.159
  182   3HG2  VAL  27          HG21      VAL  27   0.613  -5.051   2.787
  183    H    CYS  28           HN       CYS  28   0.018  -6.884  -1.693
  184    HA   CYS  28           HA       CYS  28   2.301  -6.478  -3.593
  185   1HB   CYS  28           HB2      CYS  28  -0.275  -8.008  -3.980
  186   2HB   CYS  28           HB1      CYS  28   1.186  -8.131  -4.958
  187    H    TYR  29           HN       TYR  29   1.814  -5.630  -5.693
  188    HA   TYR  29           HA       TYR  29  -0.632  -3.979  -5.976
  189   1HB   TYR  29           HB2      TYR  29   2.214  -3.030  -6.134
  190   2HB   TYR  29           HB1      TYR  29   0.804  -2.089  -6.569
  191    HD1  TYR  29           HD1      TYR  29   2.501  -3.812  -3.812
  192    HD2  TYR  29           HD2      TYR  29  -0.463  -0.966  -4.963
  193    HE1  TYR  29           HE1      TYR  29   2.340  -3.051  -1.468
  194    HE2  TYR  29           HE2      TYR  29  -0.650  -0.186  -2.626
  195    HH   TYR  29           HH       TYR  29   0.850  -0.190  -0.556
  196    H    ASP  30           HN       ASP  30  -0.462  -2.928  -8.317
  197    HA   ASP  30           HA       ASP  30   0.298  -5.045 -10.169
  198   1HB   ASP  30           HB2      ASP  30  -0.947  -3.834 -11.725
  199   2HB   ASP  30           HB1      ASP  30  -1.775  -3.571 -10.192
  200    H    SER  31           HN       SER  31   1.409  -1.728  -9.515
  201    HA   SER  31           HA       SER  31   3.488  -1.905 -11.613
  202   1HB   SER  31           HB2      SER  31   3.331   0.111  -9.430
  203   2HB   SER  31           HB1      SER  31   3.927   0.320 -11.070
  204    HG   SER  31           HG       SER  31   1.896   0.334 -11.823
  205    H    LYS  32           HN       LYS  32   5.336  -3.261 -11.155
  206    HA   LYS  32           HA       LYS  32   5.986  -4.259  -8.593
  207   1HB   LYS  32           HB2      LYS  32   8.077  -4.905  -9.605
  208   2HB   LYS  32           HB1      LYS  32   6.978  -4.770 -10.979
  209   1HG   LYS  32           HG2      LYS  32   7.868  -2.625 -11.602
  210   2HG   LYS  32           HG1      LYS  32   8.768  -2.495 -10.097
  211   1HD   LYS  32           HD2      LYS  32   9.339  -4.240 -12.510
  212   2HD   LYS  32           HD1      LYS  32  10.430  -3.140 -11.664
  213   1HE   LYS  32           HE2      LYS  32   9.376  -5.783 -10.524
  214   2HE   LYS  32           HE1      LYS  32  11.026  -5.494 -11.120
  215   1HZ   LYS  32           HZ3      LYS  32  11.192  -3.635  -9.534
  216   2HZ   LYS  32           HZ2      LYS  32   9.673  -4.052  -8.897
  217   3HZ   LYS  32           HZ1      LYS  32  10.980  -5.128  -8.759
  218    H    ALA  33           HN       ALA  33   6.730  -1.148 -10.121
  219    HA   ALA  33           HA       ALA  33   8.475  -0.037  -8.193
  220   1HB   ALA  33           HB2      ALA  33   7.808   0.838 -10.496
  221   2HB   ALA  33           HB1      ALA  33   6.258   1.305  -9.789
  222   3HB   ALA  33           HB3      ALA  33   7.750   2.061  -9.224
  223    H    ILE  34           HN       ILE  34   4.822  -0.030  -8.400
  224    HA   ILE  34           HA       ILE  34   4.406   1.499  -6.085
  225    HB   ILE  34           HB       ILE  34   2.984  -0.595  -7.604
  226   1HG1  ILE  34          HG12      ILE  34   2.814   2.390  -7.218
  227   2HG1  ILE  34          HG11      ILE  34   3.000   1.485  -8.715
  228   1HG2  ILE  34          HG23      ILE  34   2.354  -0.661  -5.107
  229   2HG2  ILE  34          HG22      ILE  34   1.753   0.980  -5.320
  230   3HG2  ILE  34          HG21      ILE  34   1.023  -0.347  -6.218
  231   1HD1  ILE  34          HD12      ILE  34   0.710   0.490  -8.231
  232   2HD1  ILE  34          HD11      ILE  34   0.555   1.718  -6.975
  233   3HD1  ILE  34          HD13      ILE  34   0.728   2.201  -8.663
  234    H    CYS  35           HN       CYS  35   5.372  -1.722  -6.540
  235    HA   CYS  35           HA       CYS  35   4.803  -2.829  -3.933
  236   1HB   CYS  35           HB2      CYS  35   5.545  -4.263  -5.789
  237   2HB   CYS  35           HB1      CYS  35   7.069  -3.362  -5.913
  238    H    ASN  36           HN       ASN  36   7.993  -1.691  -5.177
  239    HA   ASN  36           HA       ASN  36   9.187  -1.309  -2.590
  240   1HB   ASN  36           HB2      ASN  36  10.441  -1.280  -4.713
  241   2HB   ASN  36           HB1      ASN  36   9.568   0.164  -5.245
  242   1HD2  ASN  36          HD22      ASN  36  12.718   0.524  -2.691
  243   2HD2  ASN  36          HD21      ASN  36  12.176  -1.004  -3.194
  244    H    LYS  37           HN       LYS  37   7.642   1.154  -4.643
  245    HA   LYS  37           HA       LYS  37   7.799   3.346  -2.890
  246   1HB   LYS  37           HB2      LYS  37   7.387   3.186  -5.379
  247   2HB   LYS  37           HB1      LYS  37   5.709   2.820  -4.988
  248   1HG   LYS  37           HG2      LYS  37   7.090   5.277  -3.893
  249   2HG   LYS  37           HG1      LYS  37   6.292   5.293  -5.463
  250   1HD   LYS  37           HD2      LYS  37   4.305   4.206  -4.048
  251   2HD   LYS  37           HD1      LYS  37   5.100   5.064  -2.732
  252   1HE   LYS  37           HE2      LYS  37   4.250   6.355  -5.357
  253   2HE   LYS  37           HE1      LYS  37   3.354   6.478  -3.829
  254   1HZ   LYS  37           HZ3      LYS  37   5.501   7.241  -2.812
  255   2HZ   LYS  37           HZ2      LYS  37   6.122   7.392  -4.388
  256   3HZ   LYS  37           HZ1      LYS  37   4.796   8.335  -3.898
  257    H    ASN  38           HN       ASN  38   4.577   2.176  -3.844
  258    HA   ASN  38           HA       ASN  38   3.210   3.295  -1.717
  259   1HB   ASN  38           HB2      ASN  38   2.797   1.231  -3.762
  260   2HB   ASN  38           HB1      ASN  38   1.512   1.590  -2.606
  261   1HD2  ASN  38          HD22      ASN  38   2.296   4.124  -5.655
  262   2HD2  ASN  38          HD21      ASN  38   3.151   2.668  -5.439
  263    H    CYS  39           HN       CYS  39   4.697   0.181  -2.006
  264    HA   CYS  39           HA       CYS  39   3.330  -1.331  -0.079
  265   1HB   CYS  39           HB2      CYS  39   6.273  -1.064  -0.642
  266   2HB   CYS  39           HB1      CYS  39   5.620  -2.322   0.415
  267    H    THR  40           HN       THR  40   5.446   1.404   0.524
  268    HA   THR  40           HA       THR  40   5.727   0.905   3.388
  269    HB   THR  40           HB       THR  40   6.547   3.366   3.235
  270    HG1  THR  40           HG1      THR  40   5.344   3.709   1.265
  271   1HG2  THR  40          HG21      THR  40   8.032   1.322   3.163
  272   2HG2  THR  40          HG23      THR  40   7.891   1.333   1.404
  273   3HG2  THR  40          HG22      THR  40   8.663   2.683   2.236
   
  No H/Q in entry =         273
  Start of MODEL   10
    1   1H    ASP   1           HT3      ASP   1   8.319  -0.140   7.993
    2   2H    ASP   1           HT2      ASP   1   7.337   1.203   7.654
    3   3H    ASP   1           HT1      ASP   1   6.786  -0.010   8.707
    4    HA   ASP   1           HA       ASP   1   6.616  -1.593   6.932
    5   1HB   ASP   1           HB2      ASP   1   4.896   0.260   7.434
    6   2HB   ASP   1           HB1      ASP   1   5.513   1.055   5.986
    7    H    ASP   2           HN       ASP   2   8.961  -1.664   6.136
    8    HA   ASP   2           HA       ASP   2   9.043  -0.773   3.309
    9   1HB   ASP   2           HB2      ASP   2  10.818   0.222   5.581
   10   2HB   ASP   2           HB1      ASP   2  11.403   0.235   3.909
   11    H    GLY   3           HN       GLY   3  11.203  -1.617   2.322
   12   1HA   GLY   3           HA2      GLY   3  12.911  -3.471   3.466
   13   2HA   GLY   3           HA1      GLY   3  11.499  -4.423   3.024
   14    H    LEU   4           HN       LEU   4  11.768  -5.402   1.084
   15    HA   LEU   4           HA       LEU   4  13.168  -3.899  -1.097
   16   1HB   LEU   4           HB2      LEU   4  13.410  -6.876  -0.600
   17   2HB   LEU   4           HB1      LEU   4  14.425  -5.855  -1.612
   18    HG   LEU   4           HG       LEU   4  14.245  -5.393   1.368
   19   1HD1  LEU   4          HD13      LEU   4  15.651  -7.539  -0.125
   20   2HD1  LEU   4          HD12      LEU   4  16.596  -6.692   1.099
   21   3HD1  LEU   4          HD11      LEU   4  15.097  -7.506   1.549
   22   1HD2  LEU   4          HD23      LEU   4  15.819  -4.390  -0.922
   23   2HD2  LEU   4          HD22      LEU   4  15.481  -3.622   0.630
   24   3HD2  LEU   4          HD21      LEU   4  16.784  -4.803   0.495
   25    H    CYS   5           HN       CYS   5  12.746  -5.306  -3.298
   26    HA   CYS   5           HA       CYS   5   9.838  -6.150  -3.248
   27   1HB   CYS   5           HB2      CYS   5  10.416  -3.900  -4.337
   28   2HB   CYS   5           HB1      CYS   5  11.235  -4.827  -5.592
   29    H    TYR   6           HN       TYR   6   9.367  -8.040  -4.251
   30    HA   TYR   6           HA       TYR   6  11.458  -9.344  -5.945
   31   1HB   TYR   6           HB2      TYR   6  11.343 -11.370  -4.633
   32   2HB   TYR   6           HB1      TYR   6  11.613 -10.042  -3.519
   33    HD1  TYR   6           HD1      TYR   6   9.168 -12.458  -4.809
   34    HD2  TYR   6           HD2      TYR   6   9.947  -9.409  -1.911
   35    HE1  TYR   6           HE1      TYR   6   7.162 -13.166  -3.541
   36    HE2  TYR   6           HE2      TYR   6   7.927 -10.097  -0.632
   37    HH   TYR   6           HH       TYR   6   6.545 -12.787  -0.716
   38    H    GLU   7           HN       GLU   7  10.413 -11.206  -7.224
   39    HA   GLU   7           HA       GLU   7   7.503 -10.565  -7.665
   40   1HB   GLU   7           HB2      GLU   7   7.970 -10.688  -9.988
   41   2HB   GLU   7           HB1      GLU   7   9.345  -9.822  -9.319
   42   1HG   GLU   7           HG2      GLU   7  10.463 -12.168  -9.219
   43   2HG   GLU   7           HG1      GLU   7   9.124 -12.635 -10.285
   44    H    GLY   8           HN       GLY   8   6.147 -12.267  -8.276
   45   1HA   GLY   8           HA2      GLY   8   6.575 -14.822  -8.981
   46   2HA   GLY   8           HA1      GLY   8   6.988 -14.916  -7.273
   47    H    THR   9           HN       THR   9   5.291 -15.606  -6.043
   48    HA   THR   9           HA       THR   9   2.550 -14.634  -6.593
   49    HB   THR   9           HB       THR   9   3.508 -17.481  -6.619
   50    HG1  THR   9           HG1      THR   9   3.947 -16.719  -8.569
   51   1HG2  THR   9          HG21      THR   9   0.872 -16.385  -6.147
   52   2HG2  THR   9          HG23      THR   9   0.882 -17.308  -7.650
   53   3HG2  THR   9          HG22      THR   9   1.385 -18.072  -6.143
   54    H    ASN  10           HN       ASN  10   4.724 -14.741  -4.238
   55    HA   ASN  10           HA       ASN  10   3.624 -16.556  -2.271
   56   1HB   ASN  10           HB2      ASN  10   5.950 -15.700  -2.466
   57   2HB   ASN  10           HB1      ASN  10   5.384 -14.138  -1.872
   58   1HD2  ASN  10          HD22      ASN  10   5.287 -15.252   1.536
   59   2HD2  ASN  10          HD21      ASN  10   5.072 -13.919   0.447
   60    H    CYS  11           HN       CYS  11   2.556 -13.525  -3.254
   61    HA   CYS  11           HA       CYS  11   0.878 -13.309  -0.780
   62   1HB   CYS  11           HB2      CYS  11   2.296 -11.235  -2.442
   63   2HB   CYS  11           HB1      CYS  11   0.912 -10.778  -1.439
   64    H    GLY  12           HN       GLY  12   0.523 -14.626  -3.419
   65   1HA   GLY  12           HA2      GLY  12  -1.420 -14.968  -4.727
   66   2HA   GLY  12           HA1      GLY  12  -2.195 -13.721  -3.741
   67    H    LYS  13           HN       LYS  13   0.791 -12.770  -5.032
   68    HA   LYS  13           HA       LYS  13  -0.495 -10.805  -6.744
   69   1HB   LYS  13           HB2      LYS  13   1.602  -9.732  -6.628
   70   2HB   LYS  13           HB1      LYS  13   1.331 -10.501  -5.077
   71   1HG   LYS  13           HG2      LYS  13   2.645 -12.500  -6.020
   72   2HG   LYS  13           HG1      LYS  13   3.152 -11.399  -7.289
   73   1HD   LYS  13           HD2      LYS  13   3.716  -9.847  -5.215
   74   2HD   LYS  13           HD1      LYS  13   3.830 -11.399  -4.392
   75   1HE   LYS  13           HE2      LYS  13   5.180 -11.282  -7.027
   76   2HE   LYS  13           HE1      LYS  13   5.917 -10.303  -5.747
   77   1HZ   LYS  13           HZ1      LYS  13   5.591 -12.305  -4.276
   78   2HZ   LYS  13           HZ3      LYS  13   5.284 -13.193  -5.685
   79   3HZ   LYS  13           HZ2      LYS  13   6.796 -12.451  -5.465
   80    H    VAL  14           HN       VAL  14  -1.024 -13.108  -7.854
   81    HA   VAL  14           HA       VAL  14   0.905 -14.142  -9.752
   82    HB   VAL  14           HB       VAL  14  -2.114 -14.159  -9.498
   83   1HG1  VAL  14          HG12      VAL  14  -1.537 -14.350 -11.899
   84   2HG1  VAL  14          HG11      VAL  14  -0.434 -15.675 -11.524
   85   3HG1  VAL  14          HG13      VAL  14  -2.168 -15.874 -11.273
   86   1HG2  VAL  14          HG22      VAL  14  -0.339 -15.497  -8.009
   87   2HG2  VAL  14          HG21      VAL  14  -1.874 -16.221  -8.489
   88   3HG2  VAL  14          HG23      VAL  14  -0.402 -16.606  -9.381
   89    H    GLY  15           HN       GLY  15   1.819 -12.689 -11.224
   90   1HA   GLY  15           HA2      GLY  15   1.528 -11.547 -13.384
   91   2HA   GLY  15           HA1      GLY  15  -0.120 -11.131 -12.904
   92    H    LYS  16           HN       LYS  16   1.027 -10.354 -10.119
   93    HA   LYS  16           HA       LYS  16   2.076  -7.683 -10.993
   94   1HB   LYS  16           HB2      LYS  16   0.529  -8.389  -8.507
   95   2HB   LYS  16           HB1      LYS  16   0.978  -6.782  -9.059
   96   1HG   LYS  16           HG2      LYS  16  -0.398  -7.045 -11.070
   97   2HG   LYS  16           HG1      LYS  16  -0.864  -8.666 -10.557
   98   1HD   LYS  16           HD2      LYS  16  -1.319  -6.660  -8.467
   99   2HD   LYS  16           HD1      LYS  16  -2.220  -6.317  -9.944
  100   1HE   LYS  16           HE2      LYS  16  -3.606  -7.756  -8.564
  101   2HE   LYS  16           HE1      LYS  16  -2.996  -8.747  -9.905
  102   1HZ   LYS  16           HZ1      LYS  16  -1.136  -9.420  -8.491
  103   2HZ   LYS  16           HZ3      LYS  16  -1.784  -8.531  -7.200
  104   3HZ   LYS  16           HZ2      LYS  16  -2.624  -9.875  -7.811
  105    H    TYR  17           HN       TYR  17   2.782  -7.128  -8.001
  106    HA   TYR  17           HA       TYR  17   4.911  -9.187  -7.635
  107   1HB   TYR  17           HB2      TYR  17   5.544  -6.227  -7.783
  108   2HB   TYR  17           HB1      TYR  17   6.648  -7.613  -7.734
  109    HD1  TYR  17           HD1      TYR  17   4.191  -5.841  -9.917
  110    HD2  TYR  17           HD2      TYR  17   7.159  -8.897  -9.596
  111    HE1  TYR  17           HE1      TYR  17   4.225  -6.080 -12.388
  112    HE2  TYR  17           HE2      TYR  17   7.211  -9.144 -12.038
  113    HH   TYR  17           HH       TYR  17   5.692  -8.698 -13.960
  114    H    CYS  18           HN       CYS  18   6.235  -8.482  -5.413
  115    HA   CYS  18           HA       CYS  18   4.260  -7.265  -3.509
  116   1HB   CYS  18           HB2      CYS  18   5.674  -9.952  -3.433
  117   2HB   CYS  18           HB1      CYS  18   5.001  -9.216  -1.979
  118    H    CYS  19           HN       CYS  19   5.290  -6.617  -1.462
  119    HA   CYS  19           HA       CYS  19   8.229  -6.288  -1.600
  120   1HB   CYS  19           HB2      CYS  19   7.702  -3.907  -0.675
  121   2HB   CYS  19           HB1      CYS  19   7.448  -4.219  -2.393
  122    H    SER  20           HN       SER  20   8.874  -7.494   0.144
  123    HA   SER  20           HA       SER  20   8.267  -6.638   2.833
  124   1HB   SER  20           HB2      SER  20   7.190  -8.989   3.375
  125   2HB   SER  20           HB1      SER  20   6.184  -7.739   2.635
  126    HG   SER  20           HG       SER  20   6.436  -8.719   0.664
  127    HA   PRO  21           HA       PRO  21  12.095  -8.851   2.977
  128   1HB   PRO  21           HB2      PRO  21  12.660  -8.578   5.648
  129   2HB   PRO  21           HB1      PRO  21  12.843  -7.255   4.475
  130   1HG   PRO  21           HG2      PRO  21  10.677  -7.696   6.477
  131   2HG   PRO  21           HG1      PRO  21  11.364  -6.184   5.846
  132   1HD   PRO  21           HD2      PRO  21   8.948  -7.367   5.070
  133   2HD   PRO  21           HD1      PRO  21   9.818  -6.097   4.174
  134    H    ILE  22           HN       ILE  22   9.232  -9.743   4.423
  135    HA   ILE  22           HA       ILE  22   9.898 -12.585   4.506
  136    HB   ILE  22           HB       ILE  22  10.837 -11.385   6.627
  137   1HG1  ILE  22          HG12      ILE  22   8.925 -13.727   7.007
  138   2HG1  ILE  22          HG11      ILE  22  10.618 -13.861   6.534
  139   1HG2  ILE  22          HG22      ILE  22   8.374 -10.319   6.743
  140   2HG2  ILE  22          HG21      ILE  22   8.162 -11.686   7.832
  141   3HG2  ILE  22          HG23      ILE  22   9.422 -10.493   8.148
  142   1HD1  ILE  22          HD13      ILE  22  10.434 -12.237   8.904
  143   2HD1  ILE  22          HD12      ILE  22   9.556 -13.743   9.166
  144   3HD1  ILE  22          HD11      ILE  22  11.254 -13.785   8.690
  145    H    GLY  23           HN       GLY  23   7.771 -13.534   5.902
  146   1HA   GLY  23           HA2      GLY  23   5.512 -12.682   4.212
  147   2HA   GLY  23           HA1      GLY  23   5.519 -14.063   5.302
  148    H    LYS  24           HN       LYS  24   6.626 -11.215   6.779
  149    HA   LYS  24           HA       LYS  24   4.228 -11.160   8.439
  150   1HB   LYS  24           HB2      LYS  24   5.479  -9.743   9.880
  151   2HB   LYS  24           HB1      LYS  24   6.600 -10.952   9.265
  152   1HG   LYS  24           HG2      LYS  24   7.183  -9.249   7.436
  153   2HG   LYS  24           HG1      LYS  24   6.317  -8.069   8.416
  154   1HD   LYS  24           HD2      LYS  24   8.385  -9.771   9.749
  155   2HD   LYS  24           HD1      LYS  24   8.928  -8.434   8.735
  156   1HE   LYS  24           HE2      LYS  24   8.644  -7.190  10.640
  157   2HE   LYS  24           HE1      LYS  24   6.923  -7.241  10.207
  158   1HZ   LYS  24           HZ1      LYS  24   8.300  -9.342  11.792
  159   2HZ   LYS  24           HZ3      LYS  24   7.399  -8.082  12.482
  160   3HZ   LYS  24           HZ2      LYS  24   6.634  -9.221  11.481
  161    H    TYR  25           HN       TYR  25   5.839  -8.885   6.205
  162    HA   TYR  25           HA       TYR  25   3.626  -6.958   6.465
  163   1HB   TYR  25           HB2      TYR  25   6.263  -7.069   5.014
  164   2HB   TYR  25           HB1      TYR  25   5.090  -5.795   4.672
  165    HD1  TYR  25           HD2      TYR  25   4.222  -4.395   6.665
  166    HD2  TYR  25           HD1      TYR  25   7.696  -6.905   6.858
  167    HE1  TYR  25           HE2      TYR  25   5.000  -3.156   8.672
  168    HE2  TYR  25           HE1      TYR  25   8.487  -5.660   8.869
  169    HH   TYR  25           HH       TYR  25   8.071  -3.237   9.798
  170    H    CYS  26           HN       CYS  26   5.114  -8.842   3.807
  171    HA   CYS  26           HA       CYS  26   4.252  -9.331   1.625
  172   1HB   CYS  26           HB2      CYS  26   3.267 -11.089   2.998
  173   2HB   CYS  26           HB1      CYS  26   2.011  -9.996   3.593
  174    H    VAL  27           HN       VAL  27   4.194  -6.832   1.127
  175    HA   VAL  27           HA       VAL  27   1.320  -5.932   0.887
  176    HB   VAL  27           HB       VAL  27   3.924  -4.369   0.955
  177   1HG1  VAL  27          HG11      VAL  27   1.473  -3.667  -0.159
  178   2HG1  VAL  27          HG13      VAL  27   1.416  -2.949   1.451
  179   3HG1  VAL  27          HG12      VAL  27   2.734  -2.542   0.352
  180   1HG2  VAL  27          HG21      VAL  27   2.834  -5.572   3.080
  181   2HG2  VAL  27          HG23      VAL  27   3.532  -3.958   3.200
  182   3HG2  VAL  27          HG22      VAL  27   1.787  -4.154   3.036
  183    H    CYS  28           HN       CYS  28   0.673  -6.422  -1.198
  184    HA   CYS  28           HA       CYS  28   2.707  -6.110  -3.379
  185   1HB   CYS  28           HB2      CYS  28   0.182  -7.770  -3.301
  186   2HB   CYS  28           HB1      CYS  28   1.514  -7.928  -4.445
  187    H    TYR  29           HN       TYR  29   1.939  -5.501  -5.483
  188    HA   TYR  29           HA       TYR  29  -0.626  -4.029  -5.634
  189   1HB   TYR  29           HB2      TYR  29   2.102  -2.897  -6.178
  190   2HB   TYR  29           HB1      TYR  29   0.577  -2.089  -6.474
  191    HD1  TYR  29           HD1      TYR  29   2.780  -3.472  -3.896
  192    HD2  TYR  29           HD2      TYR  29  -0.602  -1.014  -4.756
  193    HE1  TYR  29           HE1      TYR  29   2.856  -2.580  -1.593
  194    HE2  TYR  29           HE2      TYR  29  -0.557  -0.112  -2.456
  195    HH   TYR  29           HH       TYR  29   0.355  -1.024  -0.141
  196    H    ASP  30           HN       ASP  30  -0.765  -3.159  -8.043
  197    HA   ASP  30           HA       ASP  30  -0.037  -5.354  -9.813
  198   1HB   ASP  30           HB2      ASP  30  -1.514  -4.346 -11.310
  199   2HB   ASP  30           HB1      ASP  30  -2.205  -4.029  -9.721
  200    H    SER  31           HN       SER  31   0.903  -1.941  -9.476
  201    HA   SER  31           HA       SER  31   2.742  -2.115 -11.786
  202   1HB   SER  31           HB2      SER  31   2.675   0.026  -9.719
  203   2HB   SER  31           HB1      SER  31   3.069   0.165 -11.425
  204    HG   SER  31           HG       SER  31   1.024   0.852 -11.341
  205    H    LYS  32           HN       LYS  32   4.740  -3.283 -11.486
  206    HA   LYS  32           HA       LYS  32   5.769  -4.061  -8.961
  207   1HB   LYS  32           HB2      LYS  32   7.776  -4.613 -10.201
  208   2HB   LYS  32           HB1      LYS  32   6.492  -4.672 -11.414
  209   1HG   LYS  32           HG2      LYS  32   7.139  -2.623 -12.383
  210   2HG   LYS  32           HG1      LYS  32   8.072  -2.142 -10.967
  211   1HD   LYS  32           HD2      LYS  32   9.741  -2.835 -12.516
  212   2HD   LYS  32           HD1      LYS  32   9.523  -4.260 -11.486
  213   1HE   LYS  32           HE2      LYS  32   8.231  -5.403 -13.148
  214   2HE   LYS  32           HE1      LYS  32   7.901  -3.901 -14.039
  215   1HZ   LYS  32           HZ1      LYS  32  10.608  -5.061 -13.626
  216   2HZ   LYS  32           HZ3      LYS  32   9.702  -5.219 -15.050
  217   3HZ   LYS  32           HZ2      LYS  32  10.228  -3.685 -14.547
  218    H    ALA  33           HN       ALA  33   6.051  -1.018 -10.757
  219    HA   ALA  33           HA       ALA  33   7.923   0.356  -9.149
  220   1HB   ALA  33           HB3      ALA  33   6.836   0.983 -11.401
  221   2HB   ALA  33           HB2      ALA  33   5.414   1.456 -10.466
  222   3HB   ALA  33           HB1      ALA  33   6.948   2.299 -10.228
  223    H    ILE  34           HN       ILE  34   4.289   0.055  -8.863
  224    HA   ILE  34           HA       ILE  34   4.053   1.706  -6.611
  225    HB   ILE  34           HB       ILE  34   2.620  -0.587  -7.795
  226   1HG1  ILE  34          HG12      ILE  34   2.265   2.401  -7.563
  227   2HG1  ILE  34          HG11      ILE  34   2.331   1.413  -9.017
  228   1HG2  ILE  34          HG23      ILE  34   2.320  -0.554  -5.254
  229   2HG2  ILE  34          HG22      ILE  34   1.629   1.054  -5.434
  230   3HG2  ILE  34          HG21      ILE  34   0.831  -0.334  -6.168
  231   1HD1  ILE  34          HD12      ILE  34   0.207   0.293  -8.183
  232   2HD1  ILE  34          HD11      ILE  34   0.117   1.585  -6.986
  233   3HD1  ILE  34          HD13      ILE  34   0.036   1.970  -8.706
  234    H    CYS  35           HN       CYS  35   5.240  -1.447  -7.007
  235    HA   CYS  35           HA       CYS  35   5.115  -2.397  -4.277
  236   1HB   CYS  35           HB2      CYS  35   5.722  -3.909  -6.122
  237   2HB   CYS  35           HB1      CYS  35   7.139  -2.913  -6.506
  238    H    ASN  36           HN       ASN  36   8.031  -1.175  -6.009
  239    HA   ASN  36           HA       ASN  36   9.508  -0.479  -3.646
  240   1HB   ASN  36           HB2      ASN  36  10.425  -0.580  -5.953
  241   2HB   ASN  36           HB1      ASN  36   9.450   0.820  -6.417
  242   1HD2  ASN  36          HD22      ASN  36  13.026   1.690  -5.191
  243   2HD2  ASN  36          HD21      ASN  36  12.522   0.371  -6.133
  244    H    LYS  37           HN       LYS  37   7.514   1.671  -5.662
  245    HA   LYS  37           HA       LYS  37   7.745   4.037  -4.170
  246   1HB   LYS  37           HB2      LYS  37   6.950   3.577  -6.529
  247   2HB   LYS  37           HB1      LYS  37   5.400   3.132  -5.825
  248   1HG   LYS  37           HG2      LYS  37   6.701   5.795  -5.228
  249   2HG   LYS  37           HG1      LYS  37   5.665   5.570  -6.637
  250   1HD   LYS  37           HD2      LYS  37   4.129   4.454  -4.663
  251   2HD   LYS  37           HD1      LYS  37   4.941   5.744  -3.779
  252   1HE   LYS  37           HE2      LYS  37   4.257   7.228  -5.851
  253   2HE   LYS  37           HE1      LYS  37   3.053   5.951  -6.119
  254   1HZ   LYS  37           HZ1      LYS  37   3.506   7.343  -3.533
  255   2HZ   LYS  37           HZ3      LYS  37   2.238   7.688  -4.605
  256   3HZ   LYS  37           HZ2      LYS  37   2.320   6.168  -3.851
  257    H    ASN  38           HN       ASN  38   4.536   2.519  -4.447
  258    HA   ASN  38           HA       ASN  38   3.464   3.734  -2.203
  259   1HB   ASN  38           HB2      ASN  38   2.879   1.474  -3.985
  260   2HB   ASN  38           HB1      ASN  38   1.786   1.842  -2.645
  261   1HD2  ASN  38          HD22      ASN  38   1.822   4.150  -5.962
  262   2HD2  ASN  38          HD21      ASN  38   2.821   2.782  -5.796
  263    H    CYS  39           HN       CYS  39   5.042   0.646  -2.542
  264    HA   CYS  39           HA       CYS  39   4.169  -0.622  -0.167
  265   1HB   CYS  39           HB2      CYS  39   6.867  -0.562  -1.495
  266   2HB   CYS  39           HB1      CYS  39   6.489  -1.661  -0.166
  267    H    THR  40           HN       THR  40   6.448   2.048  -0.461
  268    HA   THR  40           HA       THR  40   7.420   1.843   2.292
  269    HB   THR  40           HB       THR  40   8.339   4.155   1.693
  270    HG1  THR  40           HG1      THR  40   7.546   3.572  -0.930
  271   1HG2  THR  40          HG23      THR  40   8.977   1.546   0.493
  272   2HG2  THR  40          HG22      THR  40   9.500   2.897  -0.517
  273   3HG2  THR  40          HG21      THR  40  10.064   2.773   1.150
   
  No H/Q in entry =         273
  Start of MODEL   11
    1   1H    ASP   1           HT3      ASP   1  11.122   5.294   2.731
    2   2H    ASP   1           HT2      ASP   1   9.685   5.771   3.502
    3   3H    ASP   1           HT1      ASP   1  10.907   4.989   4.386
    4    HA   ASP   1           HA       ASP   1   9.243   3.359   3.980
    5   1HB   ASP   1           HB2      ASP   1   8.454   3.057   1.626
    6   2HB   ASP   1           HB1      ASP   1   8.113   4.664   2.260
    7    H    ASP   2           HN       ASP   2  11.383   2.446   4.662
    8    HA   ASP   2           HA       ASP   2  13.201   1.485   2.548
    9   1HB   ASP   2           HB2      ASP   2  13.064   0.945   5.577
   10   2HB   ASP   2           HB1      ASP   2  14.436   0.560   4.531
   11    H    GLY   3           HN       GLY   3  13.303  -0.629   1.800
   12   1HA   GLY   3           HA2      GLY   3  12.394  -2.977   2.949
   13   2HA   GLY   3           HA1      GLY   3  10.968  -2.323   2.151
   14    H    LEU   4           HN       LEU   4  11.615  -4.622   1.121
   15    HA   LEU   4           HA       LEU   4  13.079  -3.999  -1.416
   16   1HB   LEU   4           HB2      LEU   4  13.125  -6.667   0.017
   17   2HB   LEU   4           HB1      LEU   4  14.178  -6.112  -1.279
   18    HG   LEU   4           HG       LEU   4  14.118  -4.693   1.387
   19   1HD1  LEU   4          HD13      LEU   4  15.388  -7.284   0.641
   20   2HD1  LEU   4          HD12      LEU   4  16.345  -6.154   1.601
   21   3HD1  LEU   4          HD11      LEU   4  14.792  -6.731   2.207
   22   1HD2  LEU   4          HD22      LEU   4  15.786  -4.704  -1.084
   23   2HD2  LEU   4          HD21      LEU   4  15.377  -3.363  -0.013
   24   3HD2  LEU   4          HD23      LEU   4  16.636  -4.508   0.447
   25    H    CYS   5           HN       CYS   5  12.483  -6.008  -3.055
   26    HA   CYS   5           HA       CYS   5   9.667  -6.908  -2.582
   27   1HB   CYS   5           HB2      CYS   5   9.731  -4.625  -3.743
   28   2HB   CYS   5           HB1      CYS   5  10.444  -5.454  -5.125
   29    H    TYR   6           HN       TYR   6   9.014  -8.611  -3.981
   30    HA   TYR   6           HA       TYR   6  11.181  -9.855  -5.633
   31   1HB   TYR   6           HB2      TYR   6  10.890 -11.975  -4.510
   32   2HB   TYR   6           HB1      TYR   6  11.126 -10.755  -3.273
   33    HD1  TYR   6           HD1      TYR   6   8.698 -12.958  -4.925
   34    HD2  TYR   6           HD2      TYR   6   9.363 -10.177  -1.744
   35    HE1  TYR   6           HE1      TYR   6   6.575 -13.672  -3.870
   36    HE2  TYR   6           HE2      TYR   6   7.226 -10.869  -0.679
   37    HH   TYR   6           HH       TYR   6   4.913 -12.041  -1.801
   38    H    GLU   7           HN       GLU   7  10.184 -11.574  -7.130
   39    HA   GLU   7           HA       GLU   7   7.352 -10.782  -7.765
   40   1HB   GLU   7           HB2      GLU   7   8.006 -10.774 -10.045
   41   2HB   GLU   7           HB1      GLU   7   9.354 -10.016  -9.210
   42   1HG   GLU   7           HG2      GLU   7  10.364 -12.413  -9.178
   43   2HG   GLU   7           HG1      GLU   7   9.100 -12.746 -10.379
   44    H    GLY   8           HN       GLY   8   5.961 -12.390  -8.503
   45   1HA   GLY   8           HA2      GLY   8   6.313 -14.903  -9.379
   46   2HA   GLY   8           HA1      GLY   8   6.676 -15.135  -7.672
   47    H    THR   9           HN       THR   9   4.917 -15.820  -6.513
   48    HA   THR   9           HA       THR   9   2.226 -14.726  -7.097
   49    HB   THR   9           HB       THR   9   3.096 -17.596  -7.246
   50    HG1  THR   9           HG1      THR   9   3.283 -17.219  -9.287
   51   1HG2  THR   9          HG22      THR   9   0.474 -16.434  -6.818
   52   2HG2  THR   9          HG21      THR   9   0.520 -17.302  -8.353
   53   3HG2  THR   9          HG23      THR   9   0.940 -18.134  -6.857
   54    H    ASN  10           HN       ASN  10   4.338 -15.117  -4.663
   55    HA   ASN  10           HA       ASN  10   2.986 -16.944  -2.863
   56   1HB   ASN  10           HB2      ASN  10   5.403 -16.295  -2.947
   57   2HB   ASN  10           HB1      ASN  10   4.953 -14.764  -2.198
   58   1HD2  ASN  10          HD22      ASN  10   4.644 -16.228   1.062
   59   2HD2  ASN  10          HD21      ASN  10   4.588 -14.771   0.125
   60    H    CYS  11           HN       CYS  11   2.271 -13.756  -3.669
   61    HA   CYS  11           HA       CYS  11   0.546 -13.535  -1.225
   62   1HB   CYS  11           HB2      CYS  11   2.214 -11.507  -2.703
   63   2HB   CYS  11           HB1      CYS  11   0.855 -10.983  -1.697
   64    H    GLY  12           HN       GLY  12   0.143 -14.635  -3.948
   65   1HA   GLY  12           HA2      GLY  12  -1.794 -14.713  -5.301
   66   2HA   GLY  12           HA1      GLY  12  -2.463 -13.446  -4.266
   67    H    LYS  13           HN       LYS  13   0.634 -12.744  -5.484
   68    HA   LYS  13           HA       LYS  13  -0.428 -10.569  -7.095
   69   1HB   LYS  13           HB2      LYS  13   1.777  -9.750  -6.942
   70   2HB   LYS  13           HB1      LYS  13   1.424 -10.563  -5.431
   71   1HG   LYS  13           HG2      LYS  13   2.493 -12.648  -6.492
   72   2HG   LYS  13           HG1      LYS  13   3.127 -11.544  -7.701
   73   1HD   LYS  13           HD2      LYS  13   4.491 -10.457  -6.185
   74   2HD   LYS  13           HD1      LYS  13   3.468 -10.890  -4.824
   75   1HE   LYS  13           HE2      LYS  13   4.749 -12.695  -4.394
   76   2HE   LYS  13           HE1      LYS  13   4.490 -13.291  -6.047
   77   1HZ   LYS  13           HZ2      LYS  13   6.117 -11.553  -6.761
   78   2HZ   LYS  13           HZ1      LYS  13   6.506 -11.322  -5.128
   79   3HZ   LYS  13           HZ3      LYS  13   6.788 -12.826  -5.860
   80    H    VAL  14           HN       VAL  14  -1.172 -12.802  -8.296
   81    HA   VAL  14           HA       VAL  14   0.651 -13.856 -10.290
   82    HB   VAL  14           HB       VAL  14  -2.363 -13.699  -9.984
   83   1HG1  VAL  14          HG13      VAL  14  -1.780 -13.848 -12.397
   84   2HG1  VAL  14          HG12      VAL  14  -0.809 -15.281 -12.059
   85   3HG1  VAL  14          HG11      VAL  14  -2.554 -15.322 -11.818
   86   1HG2  VAL  14          HG23      VAL  14  -0.255 -15.769  -9.406
   87   2HG2  VAL  14          HG22      VAL  14  -1.585 -15.219  -8.386
   88   3HG2  VAL  14          HG21      VAL  14  -1.907 -16.276  -9.759
   89    H    GLY  15           HN       GLY  15   1.604 -12.405 -11.740
   90   1HA   GLY  15           HA2      GLY  15   1.290 -11.132 -13.826
   91   2HA   GLY  15           HA1      GLY  15  -0.287 -10.607 -13.227
   92    H    LYS  16           HN       LYS  16   1.086 -10.080 -10.476
   93    HA   LYS  16           HA       LYS  16   2.444  -7.531 -11.291
   94   1HB   LYS  16           HB2      LYS  16   0.621  -7.996  -8.939
   95   2HB   LYS  16           HB1      LYS  16   1.327  -6.466  -9.451
   96   1HG   LYS  16           HG2      LYS  16   0.109  -6.607 -11.591
   97   2HG   LYS  16           HG1      LYS  16  -0.638  -8.115 -11.062
   98   1HD   LYS  16           HD2      LYS  16  -0.873  -5.722  -9.275
   99   2HD   LYS  16           HD1      LYS  16  -1.878  -5.785 -10.725
  100   1HE   LYS  16           HE2      LYS  16  -2.555  -8.150  -9.975
  101   2HE   LYS  16           HE1      LYS  16  -1.831  -7.735  -8.408
  102   1HZ   LYS  16           HZ3      LYS  16  -3.782  -5.989  -9.802
  103   2HZ   LYS  16           HZ2      LYS  16  -4.247  -7.148  -8.649
  104   3HZ   LYS  16           HZ1      LYS  16  -3.234  -5.859  -8.203
  105    H    TYR  17           HN       TYR  17   2.881  -7.129  -8.164
  106    HA   TYR  17           HA       TYR  17   4.814  -9.365  -7.732
  107   1HB   TYR  17           HB2      TYR  17   5.668  -6.475  -7.532
  108   2HB   TYR  17           HB1      TYR  17   6.653  -7.944  -7.591
  109    HD1  TYR  17           HD1      TYR  17   4.498  -5.716  -9.677
  110    HD2  TYR  17           HD2      TYR  17   7.208  -9.014  -9.562
  111    HE1  TYR  17           HE1      TYR  17   4.693  -5.652 -12.152
  112    HE2  TYR  17           HE2      TYR  17   7.428  -8.961 -12.001
  113    HH   TYR  17           HH       TYR  17   5.797  -8.072 -13.971
  114    H    CYS  18           HN       CYS  18   5.945  -8.900  -5.343
  115    HA   CYS  18           HA       CYS  18   3.881  -7.614  -3.582
  116   1HB   CYS  18           HB2      CYS  18   5.130 -10.381  -3.399
  117   2HB   CYS  18           HB1      CYS  18   4.195  -9.653  -2.092
  118    H    CYS  19           HN       CYS  19   4.747  -7.168  -1.396
  119    HA   CYS  19           HA       CYS  19   7.707  -6.908  -1.335
  120   1HB   CYS  19           HB2      CYS  19   7.099  -4.667  -0.129
  121   2HB   CYS  19           HB1      CYS  19   6.916  -4.761  -1.883
  122    H    SER  20           HN       SER  20   8.588  -7.786   0.501
  123    HA   SER  20           HA       SER  20   7.324  -7.561   3.124
  124   1HB   SER  20           HB2      SER  20   7.070 -10.077   3.387
  125   2HB   SER  20           HB1      SER  20   6.001  -9.400   2.157
  126    HG   SER  20           HG       SER  20   7.075 -11.231   1.371
  127    HA   PRO  21           HA       PRO  21  11.766  -8.068   3.461
  128   1HB   PRO  21           HB2      PRO  21  12.068  -6.840   5.894
  129   2HB   PRO  21           HB1      PRO  21  11.888  -5.948   4.368
  130   1HG   PRO  21           HG2      PRO  21   9.892  -6.370   6.529
  131   2HG   PRO  21           HG1      PRO  21  10.050  -5.044   5.360
  132   1HD   PRO  21           HD2      PRO  21   8.255  -7.231   5.256
  133   2HD   PRO  21           HD1      PRO  21   8.554  -6.039   3.969
  134    H    ILE  22           HN       ILE  22   9.311  -9.561   5.033
  135    HA   ILE  22           HA       ILE  22  11.023 -11.657   6.108
  136    HB   ILE  22           HB       ILE  22  11.008  -9.742   7.787
  137   1HG1  ILE  22          HG12      ILE  22   9.777 -12.380   8.696
  138   2HG1  ILE  22          HG11      ILE  22  11.500 -12.014   8.622
  139   1HG2  ILE  22          HG23      ILE  22   8.103 -10.552   7.893
  140   2HG2  ILE  22          HG22      ILE  22   8.877  -9.503   9.079
  141   3HG2  ILE  22          HG21      ILE  22   8.752  -8.995   7.396
  142   1HD1  ILE  22          HD12      ILE  22   9.492 -10.552  10.367
  143   2HD1  ILE  22          HD11      ILE  22  10.605 -11.799  10.930
  144   3HD1  ILE  22          HD13      ILE  22  11.232 -10.265  10.322
  145    H    GLY  23           HN       GLY  23   8.468 -10.862   4.561
  146   1HA   GLY  23           HA2      GLY  23   6.604 -12.143   3.787
  147   2HA   GLY  23           HA1      GLY  23   7.105 -13.392   4.918
  148    H    LYS  24           HN       LYS  24   6.875 -10.361   6.385
  149    HA   LYS  24           HA       LYS  24   4.497 -11.220   7.860
  150   1HB   LYS  24           HB2      LYS  24   5.057  -9.451   9.373
  151   2HB   LYS  24           HB1      LYS  24   6.551 -10.258   8.910
  152   1HG   LYS  24           HG2      LYS  24   6.906  -8.485   7.165
  153   2HG   LYS  24           HG1      LYS  24   5.477  -7.657   7.782
  154   1HD   LYS  24           HD2      LYS  24   7.467  -8.401   9.838
  155   2HD   LYS  24           HD1      LYS  24   8.010  -7.187   8.682
  156   1HE   LYS  24           HE2      LYS  24   6.929  -5.728  10.086
  157   2HE   LYS  24           HE1      LYS  24   5.469  -6.298   9.254
  158   1HZ   LYS  24           HZ3      LYS  24   5.431  -8.172  10.875
  159   2HZ   LYS  24           HZ2      LYS  24   6.661  -7.387  11.745
  160   3HZ   LYS  24           HZ1      LYS  24   5.139  -6.652  11.570
  161    H    TYR  25           HN       TYR  25   5.382  -8.663   5.580
  162    HA   TYR  25           HA       TYR  25   2.790  -7.323   5.848
  163   1HB   TYR  25           HB2      TYR  25   5.288  -6.948   4.217
  164   2HB   TYR  25           HB1      TYR  25   3.836  -6.005   3.880
  165    HD1  TYR  25           HD2      TYR  25   2.811  -4.618   5.748
  166    HD2  TYR  25           HD1      TYR  25   6.697  -6.410   6.037
  167    HE1  TYR  25           HE2      TYR  25   3.372  -3.083   7.621
  168    HE2  TYR  25           HE1      TYR  25   7.272  -4.867   7.913
  169    HH   TYR  25           HH       TYR  25   5.647  -2.127   8.583
  170    H    CYS  26           HN       CYS  26   4.442  -9.197   3.256
  171    HA   CYS  26           HA       CYS  26   3.530 -10.041   1.203
  172   1HB   CYS  26           HB2      CYS  26   2.720 -11.585   3.025
  173   2HB   CYS  26           HB1      CYS  26   1.258 -10.607   3.174
  174    H    VAL  27           HN       VAL  27   3.307  -7.423   0.951
  175    HA   VAL  27           HA       VAL  27   0.413  -6.815   0.357
  176    HB   VAL  27           HB       VAL  27   2.801  -5.011   0.886
  177   1HG1  VAL  27          HG12      VAL  27   0.568  -4.392  -0.542
  178   2HG1  VAL  27          HG11      VAL  27   0.028  -4.001   1.089
  179   3HG1  VAL  27          HG13      VAL  27   1.465  -3.222   0.427
  180   1HG2  VAL  27          HG23      VAL  27   0.425  -5.781   2.612
  181   2HG2  VAL  27          HG22      VAL  27   2.109  -6.218   2.900
  182   3HG2  VAL  27          HG21      VAL  27   1.602  -4.533   3.023
  183    H    CYS  28           HN       CYS  28  -0.002  -6.885  -1.834
  184    HA   CYS  28           HA       CYS  28   2.332  -6.467  -3.664
  185   1HB   CYS  28           HB2      CYS  28  -0.240  -7.970  -4.149
  186   2HB   CYS  28           HB1      CYS  28   1.264  -8.116  -5.054
  187    H    TYR  29           HN       TYR  29   1.922  -5.574  -5.749
  188    HA   TYR  29           HA       TYR  29  -0.518  -3.927  -6.114
  189   1HB   TYR  29           HB2      TYR  29   2.330  -2.972  -6.087
  190   2HB   TYR  29           HB1      TYR  29   0.959  -2.030  -6.630
  191    HD1  TYR  29           HD1      TYR  29   2.405  -3.790  -3.752
  192    HD2  TYR  29           HD2      TYR  29  -0.391  -0.871  -5.127
  193    HE1  TYR  29           HE1      TYR  29   2.071  -3.028  -1.427
  194    HE2  TYR  29           HE2      TYR  29  -0.752  -0.093  -2.809
  195    HH   TYR  29           HH       TYR  29   0.518  -0.131  -0.635
  196    H    ASP  30           HN       ASP  30  -0.173  -2.788  -8.427
  197    HA   ASP  30           HA       ASP  30   0.618  -4.890 -10.284
  198   1HB   ASP  30           HB2      ASP  30  -0.486  -3.596 -11.880
  199   2HB   ASP  30           HB1      ASP  30  -1.395  -3.341 -10.394
  200    H    SER  31           HN       SER  31   1.791  -1.614  -9.511
  201    HA   SER  31           HA       SER  31   4.013  -1.849 -11.453
  202   1HB   SER  31           HB2      SER  31   3.763   0.162  -9.271
  203   2HB   SER  31           HB1      SER  31   4.483   0.358 -10.861
  204    HG   SER  31           HG       SER  31   2.486   0.364 -11.767
  205    H    LYS  32           HN       LYS  32   5.810  -3.230 -10.873
  206    HA   LYS  32           HA       LYS  32   6.194  -4.285  -8.279
  207   1HB   LYS  32           HB2      LYS  32   8.347  -4.995  -9.120
  208   2HB   LYS  32           HB1      LYS  32   7.346  -4.830 -10.566
  209   1HG   LYS  32           HG2      LYS  32   8.399  -2.830 -11.222
  210   2HG   LYS  32           HG1      LYS  32   9.057  -2.538  -9.611
  211   1HD   LYS  32           HD2      LYS  32  10.912  -3.346 -10.909
  212   2HD   LYS  32           HD1      LYS  32  10.384  -4.736  -9.943
  213   1HE   LYS  32           HE2      LYS  32  10.421  -5.765 -12.053
  214   2HE   LYS  32           HE1      LYS  32   8.785  -5.072 -12.131
  215   1HZ   LYS  32           HZ3      LYS  32   9.795  -3.020 -13.025
  216   2HZ   LYS  32           HZ2      LYS  32  11.298  -3.810 -13.091
  217   3HZ   LYS  32           HZ1      LYS  32  10.006  -4.356 -14.048
  218    H    ALA  33           HN       ALA  33   7.155  -1.174  -9.672
  219    HA   ALA  33           HA       ALA  33   8.764  -0.174  -7.566
  220   1HB   ALA  33           HB1      ALA  33   8.322   0.765  -9.912
  221   2HB   ALA  33           HB3      ALA  33   6.755   1.307  -9.306
  222   3HB   ALA  33           HB2      ALA  33   8.243   1.964  -8.617
  223    H    ILE  34           HN       ILE  34   5.149  -0.028  -8.111
  224    HA   ILE  34           HA       ILE  34   4.576   1.461  -5.800
  225    HB   ILE  34           HB       ILE  34   3.226  -0.539  -7.499
  226   1HG1  ILE  34          HG12      ILE  34   3.126   2.440  -7.058
  227   2HG1  ILE  34          HG11      ILE  34   3.417   1.560  -8.554
  228   1HG2  ILE  34          HG22      ILE  34   2.381  -0.602  -5.051
  229   2HG2  ILE  34          HG21      ILE  34   1.819   1.042  -5.328
  230   3HG2  ILE  34          HG23      ILE  34   1.168  -0.283  -6.287
  231   1HD1  ILE  34          HD13      ILE  34   1.058   0.632  -8.289
  232   2HD1  ILE  34          HD12      ILE  34   0.834   1.853  -7.037
  233   3HD1  ILE  34          HD11      ILE  34   1.174   2.346  -8.698
  234    H    CYS  35           HN       CYS  35   5.454  -1.779  -6.266
  235    HA   CYS  35           HA       CYS  35   4.594  -2.948  -3.776
  236   1HB   CYS  35           HB2      CYS  35   5.430  -4.372  -5.564
  237   2HB   CYS  35           HB1      CYS  35   6.966  -3.490  -5.614
  238    H    ASN  36           HN       ASN  36   7.949  -1.945  -4.639
  239    HA   ASN  36           HA       ASN  36   8.882  -1.684  -1.941
  240   1HB   ASN  36           HB2      ASN  36   9.577  -0.247  -4.545
  241   2HB   ASN  36           HB1      ASN  36  10.530  -0.079  -3.065
  242   1HD2  ASN  36          HD22      ASN  36  11.125  -3.308  -5.364
  243   2HD2  ASN  36          HD21      ASN  36  10.237  -1.958  -5.880
  244    H    LYS  37           HN       LYS  37   7.657   0.896  -4.062
  245    HA   LYS  37           HA       LYS  37   7.752   3.043  -2.249
  246   1HB   LYS  37           HB2      LYS  37   7.564   2.946  -4.770
  247   2HB   LYS  37           HB1      LYS  37   5.841   2.663  -4.539
  248   1HG   LYS  37           HG2      LYS  37   7.244   5.022  -3.271
  249   2HG   LYS  37           HG1      LYS  37   6.590   5.108  -4.906
  250   1HD   LYS  37           HD2      LYS  37   4.432   4.101  -3.688
  251   2HD   LYS  37           HD1      LYS  37   5.151   4.907  -2.295
  252   1HE   LYS  37           HE2      LYS  37   4.529   6.237  -4.967
  253   2HE   LYS  37           HE1      LYS  37   3.610   6.453  -3.463
  254   1HZ   LYS  37           HZ1      LYS  37   5.754   7.098  -2.397
  255   2HZ   LYS  37           HZ3      LYS  37   6.464   7.121  -3.938
  256   3HZ   LYS  37           HZ2      LYS  37   5.203   8.198  -3.569
  257    H    ASN  38           HN       ASN  38   4.582   2.052  -3.524
  258    HA   ASN  38           HA       ASN  38   3.079   3.177  -1.497
  259   1HB   ASN  38           HB2      ASN  38   2.761   1.187  -3.631
  260   2HB   ASN  38           HB1      ASN  38   1.394   1.576  -2.582
  261   1HD2  ASN  38          HD22      ASN  38   2.561   4.145  -5.476
  262   2HD2  ASN  38          HD21      ASN  38   3.328   2.648  -5.227
  263    H    CYS  39           HN       CYS  39   4.485   0.029  -1.718
  264    HA   CYS  39           HA       CYS  39   2.889  -1.485   0.027
  265   1HB   CYS  39           HB2      CYS  39   5.876  -1.282  -0.260
  266   2HB   CYS  39           HB1      CYS  39   5.126  -2.490   0.788
  267    H    THR  40           HN       THR  40   5.164   1.061   0.922
  268    HA   THR  40           HA       THR  40   4.949   0.576   3.797
  269    HB   THR  40           HB       THR  40   6.107   2.903   3.768
  270    HG1  THR  40           HG1      THR  40   5.396   3.563   1.755
  271   1HG2  THR  40          HG22      THR  40   7.078   0.305   3.338
  272   2HG2  THR  40          HG21      THR  40   7.819   1.250   2.047
  273   3HG2  THR  40          HG23      THR  40   8.054   1.720   3.731
   
  No H/Q in entry =         273
  Start of MODEL   12
    1   1H    ASP   1           HT1      ASP   1   8.430   2.075   7.953
    2   2H    ASP   1           HT3      ASP   1   9.581   2.620   9.073
    3   3H    ASP   1           HT2      ASP   1   9.698   3.084   7.443
    4    HA   ASP   1           HA       ASP   1  11.320   1.361   7.915
    5   1HB   ASP   1           HB2      ASP   1  10.470  -0.805   8.749
    6   2HB   ASP   1           HB1      ASP   1  10.034   0.499   9.853
    7    H    ASP   2           HN       ASP   2  11.804  -0.211   6.256
    8    HA   ASP   2           HA       ASP   2   9.707  -0.897   4.269
    9   1HB   ASP   2           HB2      ASP   2  12.034   1.039   3.881
   10   2HB   ASP   2           HB1      ASP   2  11.330   0.185   2.499
   11    H    GLY   3           HN       GLY   3  11.451  -1.742   2.217
   12   1HA   GLY   3           HA2      GLY   3  13.709  -3.195   3.262
   13   2HA   GLY   3           HA1      GLY   3  12.326  -4.259   3.073
   14    H    LEU   4           HN       LEU   4  12.143  -5.237   1.129
   15    HA   LEU   4           HA       LEU   4  13.415  -3.954  -1.261
   16   1HB   LEU   4           HB2      LEU   4  13.503  -6.919  -0.693
   17   2HB   LEU   4           HB1      LEU   4  14.540  -5.971  -1.751
   18    HG   LEU   4           HG       LEU   4  14.526  -5.499   1.236
   19   1HD1  LEU   4          HD11      LEU   4  15.828  -7.679  -0.346
   20   2HD1  LEU   4          HD13      LEU   4  16.717  -6.957   0.995
   21   3HD1  LEU   4          HD12      LEU   4  15.156  -7.724   1.286
   22   1HD2  LEU   4          HD22      LEU   4  16.210  -4.756  -1.125
   23   2HD2  LEU   4          HD21      LEU   4  15.740  -3.778   0.265
   24   3HD2  LEU   4          HD23      LEU   4  17.015  -4.985   0.427
   25    H    CYS   5           HN       CYS   5  12.721  -5.456  -3.314
   26    HA   CYS   5           HA       CYS   5   9.836  -6.278  -2.971
   27   1HB   CYS   5           HB2      CYS   5  10.083  -3.973  -3.988
   28   2HB   CYS   5           HB1      CYS   5  10.948  -4.712  -5.334
   29    H    TYR   6           HN       TYR   6   9.256  -8.083  -4.160
   30    HA   TYR   6           HA       TYR   6  11.320  -9.261  -5.984
   31   1HB   TYR   6           HB2      TYR   6  11.249 -11.359  -4.768
   32   2HB   TYR   6           HB1      TYR   6  11.564 -10.075  -3.614
   33    HD1  TYR   6           HD1      TYR   6   9.058 -12.426  -4.910
   34    HD2  TYR   6           HD2      TYR   6   9.967  -9.509  -1.917
   35    HE1  TYR   6           HE1      TYR   6   7.092 -13.167  -3.605
   36    HE2  TYR   6           HE2      TYR   6   7.983 -10.226  -0.601
   37    HH   TYR   6           HH       TYR   6   6.578 -12.880  -0.728
   38    H    GLU   7           HN       GLU   7  10.308 -11.127  -7.279
   39    HA   GLU   7           HA       GLU   7   7.380 -10.565  -7.692
   40   1HB   GLU   7           HB2      GLU   7   7.839 -10.645 -10.021
   41   2HB   GLU   7           HB1      GLU   7   9.191  -9.745  -9.349
   42   1HG   GLU   7           HG2      GLU   7  10.378 -12.061  -9.283
   43   2HG   GLU   7           HG1      GLU   7   9.048 -12.550 -10.348
   44    H    GLY   8           HN       GLY   8   6.078 -12.319  -8.302
   45   1HA   GLY   8           HA2      GLY   8   6.606 -14.850  -9.033
   46   2HA   GLY   8           HA1      GLY   8   7.041 -14.939  -7.329
   47    H    THR   9           HN       THR   9   5.384 -15.690  -6.070
   48    HA   THR   9           HA       THR   9   2.605 -14.838  -6.615
   49    HB   THR   9           HB       THR   9   3.674 -17.644  -6.621
   50    HG1  THR   9           HG1      THR   9   2.563 -16.025  -8.661
   51   1HG2  THR   9          HG22      THR   9   1.007 -16.659  -6.136
   52   2HG2  THR   9          HG21      THR   9   1.037 -17.551  -7.658
   53   3HG2  THR   9          HG23      THR   9   1.575 -18.328  -6.169
   54    H    ASN  10           HN       ASN  10   4.774 -14.823  -4.259
   55    HA   ASN  10           HA       ASN  10   3.767 -16.673  -2.278
   56   1HB   ASN  10           HB2      ASN  10   6.041 -15.701  -2.449
   57   2HB   ASN  10           HB1      ASN  10   5.384 -14.153  -1.915
   58   1HD2  ASN  10          HD22      ASN  10   5.295 -15.153   1.527
   59   2HD2  ASN  10          HD21      ASN  10   5.030 -13.872   0.390
   60    H    CYS  11           HN       CYS  11   2.574 -13.686  -3.284
   61    HA   CYS  11           HA       CYS  11   0.835 -13.560  -0.844
   62   1HB   CYS  11           HB2      CYS  11   2.170 -11.418  -2.492
   63   2HB   CYS  11           HB1      CYS  11   0.748 -11.032  -1.514
   64    H    GLY  12           HN       GLY  12   0.616 -14.887  -3.506
   65   1HA   GLY  12           HA2      GLY  12  -1.271 -15.331  -4.865
   66   2HA   GLY  12           HA1      GLY  12  -2.146 -14.153  -3.875
   67    H    LYS  13           HN       LYS  13   0.806 -13.013  -5.109
   68    HA   LYS  13           HA       LYS  13  -0.569 -11.076  -6.784
   69   1HB   LYS  13           HB2      LYS  13   1.465  -9.899  -6.619
   70   2HB   LYS  13           HB1      LYS  13   1.222 -10.725  -5.094
   71   1HG   LYS  13           HG2      LYS  13   2.650 -12.627  -6.081
   72   2HG   LYS  13           HG1      LYS  13   3.111 -11.459  -7.309
   73   1HD   LYS  13           HD2      LYS  13   3.633  -9.919  -5.272
   74   2HD   LYS  13           HD1      LYS  13   3.674 -11.429  -4.368
   75   1HE   LYS  13           HE2      LYS  13   5.198 -11.323  -6.940
   76   2HE   LYS  13           HE1      LYS  13   5.883 -10.493  -5.528
   77   1HZ   LYS  13           HZ1      LYS  13   5.441 -12.518  -4.227
   78   2HZ   LYS  13           HZ3      LYS  13   4.953 -13.308  -5.643
   79   3HZ   LYS  13           HZ2      LYS  13   6.560 -12.785  -5.479
   80    H    VAL  14           HN       VAL  14  -0.917 -13.427  -7.943
   81    HA   VAL  14           HA       VAL  14   1.092 -14.194  -9.893
   82    HB   VAL  14           HB       VAL  14  -1.904 -14.551  -9.603
   83   1HG1  VAL  14          HG11      VAL  14  -0.079 -15.708 -11.735
   84   2HG1  VAL  14          HG13      VAL  14  -1.719 -16.274 -11.416
   85   3HG1  VAL  14          HG12      VAL  14  -1.451 -14.630 -11.997
   86   1HG2  VAL  14          HG22      VAL  14   0.009 -15.734  -8.170
   87   2HG2  VAL  14          HG21      VAL  14  -1.424 -16.620  -8.687
   88   3HG2  VAL  14          HG23      VAL  14   0.084 -16.787  -9.583
   89    H    GLY  15           HN       GLY  15   1.798 -12.675 -11.412
   90   1HA   GLY  15           HA2      GLY  15   1.251 -11.508 -13.518
   91   2HA   GLY  15           HA1      GLY  15  -0.358 -11.172 -12.873
   92    H    LYS  16           HN       LYS  16   0.951 -10.407 -10.176
   93    HA   LYS  16           HA       LYS  16   1.975  -7.730 -11.066
   94   1HB   LYS  16           HB2      LYS  16   0.397  -8.409  -8.592
   95   2HB   LYS  16           HB1      LYS  16   0.876  -6.808  -9.140
   96   1HG   LYS  16           HG2      LYS  16  -0.495  -7.023 -11.143
   97   2HG   LYS  16           HG1      LYS  16  -0.954  -8.662 -10.684
   98   1HD   LYS  16           HD2      LYS  16  -1.461  -6.328  -8.836
   99   2HD   LYS  16           HD1      LYS  16  -2.605  -6.749 -10.112
  100   1HE   LYS  16           HE2      LYS  16  -3.334  -8.605  -9.000
  101   2HE   LYS  16           HE1      LYS  16  -1.694  -9.051  -8.488
  102   1HZ   LYS  16           HZ2      LYS  16  -1.766  -7.128  -6.947
  103   2HZ   LYS  16           HZ1      LYS  16  -3.406  -6.914  -7.335
  104   3HZ   LYS  16           HZ3      LYS  16  -2.899  -8.336  -6.565
  105    H    TYR  17           HN       TYR  17   2.654  -7.177  -8.059
  106    HA   TYR  17           HA       TYR  17   4.766  -9.249  -7.666
  107   1HB   TYR  17           HB2      TYR  17   5.429  -6.299  -7.776
  108   2HB   TYR  17           HB1      TYR  17   6.514  -7.697  -7.762
  109    HD1  TYR  17           HD1      TYR  17   4.069  -5.849  -9.900
  110    HD2  TYR  17           HD2      TYR  17   7.018  -8.926  -9.648
  111    HE1  TYR  17           HE1      TYR  17   4.099  -6.037 -12.378
  112    HE2  TYR  17           HE2      TYR  17   7.073  -9.120 -12.093
  113    HH   TYR  17           HH       TYR  17   5.087  -8.461 -14.025
  114    H    CYS  18           HN       CYS  18   6.060  -8.547  -5.425
  115    HA   CYS  18           HA       CYS  18   4.068  -7.281  -3.576
  116   1HB   CYS  18           HB2      CYS  18   5.452  -9.979  -3.420
  117   2HB   CYS  18           HB1      CYS  18   4.736  -9.213  -2.002
  118    H    CYS  19           HN       CYS  19   5.066  -6.599  -1.537
  119    HA   CYS  19           HA       CYS  19   8.003  -6.259  -1.670
  120   1HB   CYS  19           HB2      CYS  19   7.440  -3.897  -0.707
  121   2HB   CYS  19           HB1      CYS  19   7.181  -4.194  -2.428
  122    H    SER  20           HN       SER  20   8.681  -7.480   0.038
  123    HA   SER  20           HA       SER  20   8.108  -6.679   2.745
  124   1HB   SER  20           HB2      SER  20   7.033  -9.020   3.279
  125   2HB   SER  20           HB1      SER  20   6.018  -7.786   2.526
  126    HG   SER  20           HG       SER  20   6.728 -10.199   1.595
  127    HA   PRO  21           HA       PRO  21  11.955  -8.885   2.727
  128   1HB   PRO  21           HB2      PRO  21  12.642  -8.556   5.363
  129   2HB   PRO  21           HB1      PRO  21  12.783  -7.261   4.155
  130   1HG   PRO  21           HG2      PRO  21  10.703  -7.640   6.258
  131   2HG   PRO  21           HG1      PRO  21  11.374  -6.148   5.570
  132   1HD   PRO  21           HD2      PRO  21   8.916  -7.315   4.921
  133   2HD   PRO  21           HD1      PRO  21   9.762  -6.082   3.957
  134    H    ILE  22           HN       ILE  22   9.140  -9.732   4.249
  135    HA   ILE  22           HA       ILE  22   9.808 -12.570   4.428
  136    HB   ILE  22           HB       ILE  22  10.744 -11.285   6.503
  137   1HG1  ILE  22          HG12      ILE  22   8.843 -13.624   6.954
  138   2HG1  ILE  22          HG11      ILE  22  10.546 -13.757   6.517
  139   1HG2  ILE  22          HG22      ILE  22   8.292 -10.209   6.578
  140   2HG2  ILE  22          HG21      ILE  22   8.055 -11.550   7.696
  141   3HG2  ILE  22          HG23      ILE  22   9.318 -10.358   8.003
  142   1HD1  ILE  22          HD12      ILE  22  10.989 -12.349   8.650
  143   2HD1  ILE  22          HD11      ILE  22   9.342 -12.782   9.105
  144   3HD1  ILE  22          HD13      ILE  22  10.550 -14.044   8.857
  145    H    GLY  23           HN       GLY  23   7.672 -13.466   5.852
  146   1HA   GLY  23           HA2      GLY  23   5.415 -12.649   4.136
  147   2HA   GLY  23           HA1      GLY  23   5.418 -14.003   5.260
  148    H    LYS  24           HN       LYS  24   6.533 -11.106   6.646
  149    HA   LYS  24           HA       LYS  24   4.152 -11.017   8.330
  150   1HB   LYS  24           HB2      LYS  24   5.411  -9.550   9.714
  151   2HB   LYS  24           HB1      LYS  24   6.530 -10.772   9.121
  152   1HG   LYS  24           HG2      LYS  24   7.106  -9.128   7.248
  153   2HG   LYS  24           HG1      LYS  24   6.218  -7.920   8.171
  154   1HD   LYS  24           HD2      LYS  24   8.327  -9.549   9.550
  155   2HD   LYS  24           HD1      LYS  24   8.814  -8.190   8.536
  156   1HE   LYS  24           HE2      LYS  24   8.089  -6.663  10.061
  157   2HE   LYS  24           HE1      LYS  24   6.578  -7.549  10.347
  158   1HZ   LYS  24           HZ1      LYS  24   9.239  -8.425  11.335
  159   2HZ   LYS  24           HZ3      LYS  24   8.114  -7.576  12.278
  160   3HZ   LYS  24           HZ2      LYS  24   7.735  -9.127  11.696
  161    H    TYR  25           HN       TYR  25   5.721  -8.792   6.015
  162    HA   TYR  25           HA       TYR  25   3.507  -6.867   6.266
  163   1HB   TYR  25           HB2      TYR  25   6.113  -7.006   4.764
  164   2HB   TYR  25           HB1      TYR  25   4.928  -5.750   4.406
  165    HD1  TYR  25           HD2      TYR  25   4.084  -4.303   6.380
  166    HD2  TYR  25           HD1      TYR  25   7.589  -6.769   6.563
  167    HE1  TYR  25           HE2      TYR  25   4.897  -2.993   8.329
  168    HE2  TYR  25           HE1      TYR  25   8.417  -5.452   8.514
  169    HH   TYR  25           HH       TYR  25   7.596  -2.624   9.287
  170    H    CYS  26           HN       CYS  26   4.927  -8.840   3.641
  171    HA   CYS  26           HA       CYS  26   4.030  -9.351   1.477
  172   1HB   CYS  26           HB2      CYS  26   3.077 -11.079   2.936
  173   2HB   CYS  26           HB1      CYS  26   1.799  -9.982   3.473
  174    H    VAL  27           HN       VAL  27   3.963  -6.827   1.015
  175    HA   VAL  27           HA       VAL  27   1.079  -5.966   0.751
  176    HB   VAL  27           HB       VAL  27   3.653  -4.353   0.823
  177   1HG1  VAL  27          HG11      VAL  27   1.223  -3.680  -0.284
  178   2HG1  VAL  27          HG13      VAL  27   1.067  -3.054   1.357
  179   3HG1  VAL  27          HG12      VAL  27   2.402  -2.522   0.335
  180   1HG2  VAL  27          HG22      VAL  27   2.317  -5.604   2.933
  181   2HG2  VAL  27          HG21      VAL  27   3.449  -4.260   3.077
  182   3HG2  VAL  27          HG23      VAL  27   1.716  -3.948   2.975
  183    H    CYS  28           HN       CYS  28   0.445  -6.407  -1.353
  184    HA   CYS  28           HA       CYS  28   2.524  -6.113  -3.494
  185   1HB   CYS  28           HB2      CYS  28  -0.025  -7.736  -3.478
  186   2HB   CYS  28           HB1      CYS  28   1.336  -7.916  -4.583
  187    H    TYR  29           HN       TYR  29   1.829  -5.483  -5.603
  188    HA   TYR  29           HA       TYR  29  -0.704  -3.964  -5.842
  189   1HB   TYR  29           HB2      TYR  29   2.076  -2.906  -6.262
  190   2HB   TYR  29           HB1      TYR  29   0.599  -2.071  -6.693
  191    HD1  TYR  29           HD1      TYR  29   2.527  -3.472  -3.905
  192    HD2  TYR  29           HD2      TYR  29  -0.629  -0.864  -5.114
  193    HE1  TYR  29           HE1      TYR  29   2.461  -2.512  -1.629
  194    HE2  TYR  29           HE2      TYR  29  -0.724   0.108  -2.845
  195    HH   TYR  29           HH       TYR  29  -0.108  -0.456  -0.573
  196    H    ASP  30           HN       ASP  30  -0.700  -3.082  -8.277
  197    HA   ASP  30           HA       ASP  30   0.009  -5.328  -9.994
  198   1HB   ASP  30           HB2      ASP  30  -1.358  -4.284 -11.562
  199   2HB   ASP  30           HB1      ASP  30  -2.098  -3.893 -10.012
  200    H    SER  31           HN       SER  31   1.054  -1.936  -9.678
  201    HA   SER  31           HA       SER  31   3.032  -2.230 -11.861
  202   1HB   SER  31           HB2      SER  31   2.908  -0.035  -9.855
  203   2HB   SER  31           HB1      SER  31   3.412   0.047 -11.536
  204    HG   SER  31           HG       SER  31   1.341  -0.094 -12.177
  205    H    LYS  32           HN       LYS  32   4.996  -3.408 -11.418
  206    HA   LYS  32           HA       LYS  32   5.798  -4.191  -8.816
  207   1HB   LYS  32           HB2      LYS  32   7.872  -4.825  -9.888
  208   2HB   LYS  32           HB1      LYS  32   6.682  -4.860 -11.194
  209   1HG   LYS  32           HG2      LYS  32   7.455  -2.809 -12.107
  210   2HG   LYS  32           HG1      LYS  32   8.358  -2.406 -10.646
  211   1HD   LYS  32           HD2      LYS  32   9.944  -3.202 -12.334
  212   2HD   LYS  32           HD1      LYS  32   9.809  -4.437 -11.071
  213   1HE   LYS  32           HE2      LYS  32   7.741  -4.914 -13.049
  214   2HE   LYS  32           HE1      LYS  32   9.319  -4.821 -13.862
  215   1HZ   LYS  32           HZ3      LYS  32   8.813  -6.367 -11.374
  216   2HZ   LYS  32           HZ2      LYS  32   8.815  -7.049 -12.931
  217   3HZ   LYS  32           HZ1      LYS  32  10.234  -6.361 -12.300
  218    H    ALA  33           HN       ALA  33   6.336  -1.181 -10.611
  219    HA   ALA  33           HA       ALA  33   8.117   0.137  -8.855
  220   1HB   ALA  33           HB3      ALA  33   7.292   0.805 -11.185
  221   2HB   ALA  33           HB2      ALA  33   5.773   1.283 -10.420
  222   3HB   ALA  33           HB1      ALA  33   7.272   2.118 -10.004
  223    H    ILE  34           HN       ILE  34   4.465  -0.031  -8.884
  224    HA   ILE  34           HA       ILE  34   4.095   1.649  -6.666
  225    HB   ILE  34           HB       ILE  34   2.685  -0.597  -7.963
  226   1HG1  ILE  34          HG12      ILE  34   2.425   2.402  -7.792
  227   2HG1  ILE  34          HG11      ILE  34   2.576   1.394  -9.225
  228   1HG2  ILE  34          HG21      ILE  34   2.173  -0.483  -5.438
  229   2HG2  ILE  34          HG23      ILE  34   1.498   1.111  -5.753
  230   3HG2  ILE  34          HG22      ILE  34   0.784  -0.309  -6.507
  231   1HD1  ILE  34          HD13      ILE  34   0.347   0.363  -8.557
  232   2HD1  ILE  34          HD12      ILE  34   0.204   1.679  -7.394
  233   3HD1  ILE  34          HD11      ILE  34   0.284   2.034  -9.121
  234    H    CYS  35           HN       CYS  35   5.174  -1.557  -6.945
  235    HA   CYS  35           HA       CYS  35   4.762  -2.509  -4.252
  236   1HB   CYS  35           HB2      CYS  35   5.506  -4.067  -5.973
  237   2HB   CYS  35           HB1      CYS  35   6.930  -3.071  -6.328
  238    H    ASN  36           HN       ASN  36   7.842  -1.318  -5.695
  239    HA   ASN  36           HA       ASN  36   9.121  -0.700  -3.207
  240   1HB   ASN  36           HB2      ASN  36   9.285   0.515  -6.002
  241   2HB   ASN  36           HB1      ASN  36  10.413   0.926  -4.704
  242   1HD2  ASN  36          HD22      ASN  36  12.389  -1.892  -5.447
  243   2HD2  ASN  36          HD21      ASN  36  12.319  -0.267  -4.964
  244    H    LYS  37           HN       LYS  37   7.368   1.555  -5.336
  245    HA   LYS  37           HA       LYS  37   7.502   3.851  -3.719
  246   1HB   LYS  37           HB2      LYS  37   6.986   3.538  -6.174
  247   2HB   LYS  37           HB1      LYS  37   5.346   3.119  -5.686
  248   1HG   LYS  37           HG2      LYS  37   6.656   5.694  -4.790
  249   2HG   LYS  37           HG1      LYS  37   5.786   5.586  -6.318
  250   1HD   LYS  37           HD2      LYS  37   3.894   4.521  -4.799
  251   2HD   LYS  37           HD1      LYS  37   4.728   5.399  -3.518
  252   1HE   LYS  37           HE2      LYS  37   3.586   7.256  -4.175
  253   2HE   LYS  37           HE1      LYS  37   4.522   7.225  -5.683
  254   1HZ   LYS  37           HZ3      LYS  37   2.051   5.658  -5.164
  255   2HZ   LYS  37           HZ2      LYS  37   2.132   7.069  -6.105
  256   3HZ   LYS  37           HZ1      LYS  37   2.942   5.663  -6.608
  257    H    ASN  38           HN       ASN  38   4.306   2.467  -4.454
  258    HA   ASN  38           HA       ASN  38   2.961   3.650  -2.353
  259   1HB   ASN  38           HB2      ASN  38   2.602   1.402  -4.206
  260   2HB   ASN  38           HB1      ASN  38   1.348   1.771  -3.019
  261   1HD2  ASN  38          HD22      ASN  38   1.814   4.078  -6.302
  262   2HD2  ASN  38          HD21      ASN  38   2.780   2.708  -6.009
  263    H    CYS  39           HN       CYS  39   4.637   0.618  -2.486
  264    HA   CYS  39           HA       CYS  39   3.444  -0.778  -0.346
  265   1HB   CYS  39           HB2      CYS  39   6.326  -0.501  -1.162
  266   2HB   CYS  39           HB1      CYS  39   5.799  -1.662   0.062
  267    H    THR  40           HN       THR  40   5.434   2.097  -0.132
  268    HA   THR  40           HA       THR  40   6.016   1.837   2.718
  269    HB   THR  40           HB       THR  40   6.630   4.319   2.335
  270    HG1  THR  40           HG1      THR  40   6.699   4.880   0.123
  271   1HG2  THR  40          HG21      THR  40   7.840   1.890   1.116
  272   2HG2  THR  40          HG23      THR  40   8.386   3.421   0.429
  273   3HG2  THR  40          HG22      THR  40   8.573   3.116   2.155
   
  No H/Q in entry =         273
  Start of MODEL   13
    1   1H    ASP   1           HT3      ASP   1   8.974   1.489   7.484
    2   2H    ASP   1           HT2      ASP   1   9.549   3.086   7.412
    3   3H    ASP   1           HT1      ASP   1   7.880   2.778   7.345
    4    HA   ASP   1           HA       ASP   1   8.065   1.769   5.194
    5   1HB   ASP   1           HB2      ASP   1   9.622   4.354   5.538
    6   2HB   ASP   1           HB1      ASP   1   8.932   3.797   4.013
    7    H    ASP   2           HN       ASP   2   9.520  -0.140   5.465
    8    HA   ASP   2           HA       ASP   2  12.080   0.274   4.021
    9   1HB   ASP   2           HB2      ASP   2  11.751  -0.591   6.927
   10   2HB   ASP   2           HB1      ASP   2  13.177  -1.079   5.997
   11    H    GLY   3           HN       GLY   3  12.595  -1.560   2.829
   12   1HA   GLY   3           HA2      GLY   3  12.180  -4.233   3.411
   13   2HA   GLY   3           HA1      GLY   3  10.655  -3.721   2.695
   14    H    LEU   4           HN       LEU   4  11.429  -5.416   1.082
   15    HA   LEU   4           HA       LEU   4  13.050  -4.089  -1.054
   16   1HB   LEU   4           HB2      LEU   4  13.063  -7.047  -0.386
   17   2HB   LEU   4           HB1      LEU   4  14.156  -6.181  -1.460
   18    HG   LEU   4           HG       LEU   4  13.979  -5.474   1.471
   19   1HD1  LEU   4          HD11      LEU   4  15.247  -7.823   0.170
   20   2HD1  LEU   4          HD13      LEU   4  16.247  -6.942   1.326
   21   3HD1  LEU   4          HD12      LEU   4  14.697  -7.615   1.833
   22   1HD2  LEU   4          HD22      LEU   4  15.762  -4.882  -0.853
   23   2HD2  LEU   4          HD21      LEU   4  15.258  -3.829   0.470
   24   3HD2  LEU   4          HD23      LEU   4  16.521  -5.032   0.731
   25    H    CYS   5           HN       CYS   5  12.640  -5.575  -3.227
   26    HA   CYS   5           HA       CYS   5   9.717  -6.340  -3.266
   27   1HB   CYS   5           HB2      CYS   5  10.175  -3.992  -4.124
   28   2HB   CYS   5           HB1      CYS   5  11.099  -4.725  -5.434
   29    H    TYR   6           HN       TYR   6   9.302  -8.158  -4.381
   30    HA   TYR   6           HA       TYR   6  11.374  -9.239  -6.248
   31   1HB   TYR   6           HB2      TYR   6  11.355 -11.373  -5.090
   32   2HB   TYR   6           HB1      TYR   6  11.668 -10.116  -3.906
   33    HD1  TYR   6           HD1      TYR   6   9.168 -12.459  -5.235
   34    HD2  TYR   6           HD2      TYR   6  10.101  -9.639  -2.158
   35    HE1  TYR   6           HE1      TYR   6   7.240 -13.276  -3.917
   36    HE2  TYR   6           HE2      TYR   6   8.158 -10.439  -0.824
   37    HH   TYR   6           HH       TYR   6   6.765 -12.418  -0.630
   38    H    GLU   7           HN       GLU   7  10.354 -11.079  -7.588
   39    HA   GLU   7           HA       GLU   7   7.415 -10.520  -7.922
   40   1HB   GLU   7           HB2      GLU   7   7.825 -10.525 -10.261
   41   2HB   GLU   7           HB1      GLU   7   9.188  -9.641  -9.589
   42   1HG   GLU   7           HG2      GLU   7  10.387 -11.951  -9.622
   43   2HG   GLU   7           HG1      GLU   7   9.036 -12.414 -10.676
   44    H    GLY   8           HN       GLY   8   6.105 -12.252  -8.557
   45   1HA   GLY   8           HA2      GLY   8   6.616 -14.760  -9.377
   46   2HA   GLY   8           HA1      GLY   8   7.090 -14.900  -7.688
   47    H    THR   9           HN       THR   9   5.463 -15.685  -6.411
   48    HA   THR   9           HA       THR   9   2.668 -14.832  -6.870
   49    HB   THR   9           HB       THR   9   3.770 -17.622  -7.010
   50    HG1  THR   9           HG1      THR   9   3.144 -17.483  -9.160
   51   1HG2  THR   9          HG22      THR   9   0.972 -16.590  -6.789
   52   2HG2  THR   9          HG21      THR   9   1.259 -17.959  -7.863
   53   3HG2  THR   9          HG23      THR   9   1.673 -18.077  -6.153
   54    H    ASN  10           HN       ASN  10   4.884 -14.881  -4.557
   55    HA   ASN  10           HA       ASN  10   3.927 -16.804  -2.621
   56   1HB   ASN  10           HB2      ASN  10   6.191 -15.815  -2.808
   57   2HB   ASN  10           HB1      ASN  10   5.542 -14.291  -2.203
   58   1HD2  ASN  10          HD22      ASN  10   5.534 -15.420   1.202
   59   2HD2  ASN  10          HD21      ASN  10   5.239 -14.097   0.121
   60    H    CYS  11           HN       CYS  11   2.699 -13.786  -3.492
   61    HA   CYS  11           HA       CYS  11   1.008 -13.760  -1.015
   62   1HB   CYS  11           HB2      CYS  11   2.280 -11.551  -2.620
   63   2HB   CYS  11           HB1      CYS  11   0.862 -11.214  -1.620
   64    H    GLY  12           HN       GLY  12   0.745 -15.004  -3.716
   65   1HA   GLY  12           HA2      GLY  12  -1.169 -15.424  -5.047
   66   2HA   GLY  12           HA1      GLY  12  -2.035 -14.298  -3.990
   67    H    LYS  13           HN       LYS  13   0.875 -13.080  -5.260
   68    HA   LYS  13           HA       LYS  13  -0.561 -11.081  -6.802
   69   1HB   LYS  13           HB2      LYS  13   1.478  -9.908  -6.671
   70   2HB   LYS  13           HB1      LYS  13   1.299 -10.797  -5.172
   71   1HG   LYS  13           HG2      LYS  13   2.682 -12.654  -6.295
   72   2HG   LYS  13           HG1      LYS  13   3.091 -11.439  -7.495
   73   1HD   LYS  13           HD2      LYS  13   3.692  -9.986  -5.405
   74   2HD   LYS  13           HD1      LYS  13   3.799 -11.543  -4.591
   75   1HE   LYS  13           HE2      LYS  13   5.164 -11.379  -7.223
   76   2HE   LYS  13           HE1      LYS  13   5.902 -10.455  -5.902
   77   1HZ   LYS  13           HZ1      LYS  13   5.588 -12.475  -4.496
   78   2HZ   LYS  13           HZ3      LYS  13   5.181 -13.329  -5.900
   79   3HZ   LYS  13           HZ2      LYS  13   6.732 -12.658  -5.739
   80    H    VAL  14           HN       VAL  14  -0.961 -13.375  -8.038
   81    HA   VAL  14           HA       VAL  14   0.961 -14.086 -10.087
   82    HB   VAL  14           HB       VAL  14  -2.028 -14.415  -9.700
   83   1HG1  VAL  14          HG12      VAL  14  -1.556 -14.377 -12.133
   84   2HG1  VAL  14          HG11      VAL  14  -0.324 -15.620 -11.909
   85   3HG1  VAL  14          HG13      VAL  14  -2.019 -15.992 -11.596
   86   1HG2  VAL  14          HG23      VAL  14  -0.093 -15.675  -8.378
   87   2HG2  VAL  14          HG22      VAL  14  -1.543 -16.533  -8.896
   88   3HG2  VAL  14          HG21      VAL  14  -0.058 -16.669  -9.836
   89    H    GLY  15           HN       GLY  15   1.635 -12.513 -11.567
   90   1HA   GLY  15           HA2      GLY  15   1.030 -11.267 -13.611
   91   2HA   GLY  15           HA1      GLY  15  -0.552 -10.937 -12.898
   92    H    LYS  16           HN       LYS  16   0.883 -10.279 -10.223
   93    HA   LYS  16           HA       LYS  16   1.899  -7.584 -11.072
   94   1HB   LYS  16           HB2      LYS  16   0.397  -8.307  -8.564
   95   2HB   LYS  16           HB1      LYS  16   0.864  -6.697  -9.099
   96   1HG   LYS  16           HG2      LYS  16  -0.546  -6.973 -11.125
   97   2HG   LYS  16           HG1      LYS  16  -1.098  -8.529 -10.500
   98   1HD   LYS  16           HD2      LYS  16  -1.321  -6.136  -8.714
   99   2HD   LYS  16           HD1      LYS  16  -2.477  -6.298 -10.038
  100   1HE   LYS  16           HE2      LYS  16  -2.996  -8.625  -9.232
  101   2HE   LYS  16           HE1      LYS  16  -1.963  -8.313  -7.822
  102   1HZ   LYS  16           HZ2      LYS  16  -3.286  -6.277  -7.424
  103   2HZ   LYS  16           HZ1      LYS  16  -4.347  -6.752  -8.664
  104   3HZ   LYS  16           HZ3      LYS  16  -4.199  -7.701  -7.266
  105    H    TYR  17           HN       TYR  17   2.662  -7.124  -8.070
  106    HA   TYR  17           HA       TYR  17   4.790  -9.200  -7.801
  107   1HB   TYR  17           HB2      TYR  17   5.424  -6.238  -7.829
  108   2HB   TYR  17           HB1      TYR  17   6.524  -7.627  -7.873
  109    HD1  TYR  17           HD1      TYR  17   4.030  -5.738  -9.913
  110    HD2  TYR  17           HD2      TYR  17   6.986  -8.817  -9.802
  111    HE1  TYR  17           HE1      TYR  17   4.003  -5.866 -12.394
  112    HE2  TYR  17           HE2      TYR  17   6.984  -8.953 -12.251
  113    HH   TYR  17           HH       TYR  17   5.917  -6.705 -14.210
  114    H    CYS  18           HN       CYS  18   6.121  -8.602  -5.546
  115    HA   CYS  18           HA       CYS  18   4.151  -7.413  -3.614
  116   1HB   CYS  18           HB2      CYS  18   5.533 -10.119  -3.590
  117   2HB   CYS  18           HB1      CYS  18   4.819  -9.416  -2.136
  118    H    CYS  19           HN       CYS  19   5.156  -6.805  -1.560
  119    HA   CYS  19           HA       CYS  19   8.106  -6.553  -1.612
  120   1HB   CYS  19           HB2      CYS  19   7.613  -4.144  -0.742
  121   2HB   CYS  19           HB1      CYS  19   7.399  -4.477  -2.462
  122    H    SER  20           HN       SER  20   8.683  -7.710   0.199
  123    HA   SER  20           HA       SER  20   7.966  -6.764   2.830
  124   1HB   SER  20           HB2      SER  20   6.857  -9.093   3.407
  125   2HB   SER  20           HB1      SER  20   5.889  -7.862   2.590
  126    HG   SER  20           HG       SER  20   6.708 -10.304   1.721
  127    HA   PRO  21           HA       PRO  21  11.783  -8.948   3.201
  128   1HB   PRO  21           HB2      PRO  21  12.244  -8.561   5.877
  129   2HB   PRO  21           HB1      PRO  21  12.472  -7.289   4.659
  130   1HG   PRO  21           HG2      PRO  21  10.219  -7.659   6.579
  131   2HG   PRO  21           HG1      PRO  21  10.942  -6.170   5.936
  132   1HD   PRO  21           HD2      PRO  21   8.559  -7.347   5.084
  133   2HD   PRO  21           HD1      PRO  21   9.496  -6.140   4.169
  134    H    ILE  22           HN       ILE  22   8.899  -9.698   4.802
  135    HA   ILE  22           HA       ILE  22   9.462 -12.565   4.864
  136    HB   ILE  22           HB       ILE  22  10.629 -11.388   6.874
  137   1HG1  ILE  22          HG12      ILE  22   8.672 -13.660   7.414
  138   2HG1  ILE  22          HG11      ILE  22  10.339 -13.836   6.872
  139   1HG2  ILE  22          HG23      ILE  22   8.281 -10.174   7.201
  140   2HG2  ILE  22          HG22      ILE  22   8.035 -11.538   8.288
  141   3HG2  ILE  22          HG21      ILE  22   9.402 -10.450   8.531
  142   1HD1  ILE  22          HD12      ILE  22  10.892 -12.438   9.032
  143   2HD1  ILE  22          HD11      ILE  22   9.302 -12.988   9.562
  144   3HD1  ILE  22          HD13      ILE  22  10.558 -14.164   9.171
  145    H    GLY  23           HN       GLY  23   7.409 -13.340   6.542
  146   1HA   GLY  23           HA2      GLY  23   5.075 -12.526   4.954
  147   2HA   GLY  23           HA1      GLY  23   5.082 -13.771   6.198
  148    H    LYS  24           HN       LYS  24   6.499 -10.915   7.304
  149    HA   LYS  24           HA       LYS  24   4.165 -10.414   8.992
  150   1HB   LYS  24           HB2      LYS  24   5.628  -9.164  10.359
  151   2HB   LYS  24           HB1      LYS  24   6.578 -10.521   9.766
  152   1HG   LYS  24           HG2      LYS  24   7.296  -8.941   7.858
  153   2HG   LYS  24           HG1      LYS  24   6.646  -7.654   8.867
  154   1HD   LYS  24           HD2      LYS  24   8.532  -9.616  10.107
  155   2HD   LYS  24           HD1      LYS  24   9.190  -8.340   9.083
  156   1HE   LYS  24           HE2      LYS  24   7.713  -6.732  10.509
  157   2HE   LYS  24           HE1      LYS  24   7.664  -8.072  11.672
  158   1HZ   LYS  24           HZ1      LYS  24  10.159  -7.017  10.453
  159   2HZ   LYS  24           HZ3      LYS  24   9.593  -6.562  11.985
  160   3HZ   LYS  24           HZ2      LYS  24  10.036  -8.175  11.691
  161    H    TYR  25           HN       TYR  25   4.669  -9.554   5.957
  162    HA   TYR  25           HA       TYR  25   3.166  -7.032   6.230
  163   1HB   TYR  25           HB2      TYR  25   5.919  -7.305   5.029
  164   2HB   TYR  25           HB1      TYR  25   4.824  -6.028   4.508
  165    HD1  TYR  25           HD2      TYR  25   3.737  -4.595   6.485
  166    HD2  TYR  25           HD1      TYR  25   7.326  -6.921   6.797
  167    HE1  TYR  25           HE2      TYR  25   4.430  -3.251   8.451
  168    HE2  TYR  25           HE1      TYR  25   8.036  -5.568   8.762
  169    HH   TYR  25           HH       TYR  25   6.786  -2.665   9.530
  170    H    CYS  26           HN       CYS  26   4.872  -9.059   3.794
  171    HA   CYS  26           HA       CYS  26   4.177  -9.536   1.526
  172   1HB   CYS  26           HB2      CYS  26   3.213 -11.368   2.799
  173   2HB   CYS  26           HB1      CYS  26   1.902 -10.344   3.402
  174    H    VAL  27           HN       VAL  27   4.018  -7.040   1.045
  175    HA   VAL  27           HA       VAL  27   1.123  -6.252   0.715
  176    HB   VAL  27           HB       VAL  27   3.658  -4.585   0.863
  177   1HG1  VAL  27          HG13      VAL  27   1.247  -3.934  -0.281
  178   2HG1  VAL  27          HG12      VAL  27   1.028  -3.362   1.372
  179   3HG1  VAL  27          HG11      VAL  27   2.377  -2.766   0.406
  180   1HG2  VAL  27          HG21      VAL  27   1.740  -5.602   2.899
  181   2HG2  VAL  27          HG23      VAL  27   3.446  -5.188   3.069
  182   3HG2  VAL  27          HG22      VAL  27   2.227  -3.914   3.059
  183    H    CYS  28           HN       CYS  28   0.515  -6.611  -1.386
  184    HA   CYS  28           HA       CYS  28   2.599  -6.252  -3.510
  185   1HB   CYS  28           HB2      CYS  28   0.053  -7.879  -3.549
  186   2HB   CYS  28           HB1      CYS  28   1.411  -8.016  -4.662
  187    H    TYR  29           HN       TYR  29   1.888  -5.526  -5.590
  188    HA   TYR  29           HA       TYR  29  -0.653  -4.007  -5.724
  189   1HB   TYR  29           HB2      TYR  29   2.112  -2.914  -6.158
  190   2HB   TYR  29           HB1      TYR  29   0.617  -2.064  -6.482
  191    HD1  TYR  29           HD1      TYR  29   2.675  -3.594  -3.864
  192    HD2  TYR  29           HD2      TYR  29  -0.583  -0.993  -4.783
  193    HE1  TYR  29           HE1      TYR  29   2.686  -2.775  -1.534
  194    HE2  TYR  29           HE2      TYR  29  -0.602  -0.162  -2.456
  195    HH   TYR  29           HH       TYR  29   1.089  -0.003  -0.543
  196    H    ASP  30           HN       ASP  30  -0.749  -3.055  -8.104
  197    HA   ASP  30           HA       ASP  30  -0.018  -5.200  -9.933
  198   1HB   ASP  30           HB2      ASP  30  -1.449  -4.118 -11.426
  199   2HB   ASP  30           HB1      ASP  30  -2.168  -3.849  -9.840
  200    H    SER  31           HN       SER  31   0.966  -1.811  -9.467
  201    HA   SER  31           HA       SER  31   2.853  -1.937 -11.742
  202   1HB   SER  31           HB2      SER  31   2.786   0.124  -9.595
  203   2HB   SER  31           HB1      SER  31   3.217   0.322 -11.287
  204    HG   SER  31           HG       SER  31   1.025   1.019 -10.543
  205    H    LYS  32           HN       LYS  32   4.814  -3.181 -11.428
  206    HA   LYS  32           HA       LYS  32   5.735  -4.065  -8.902
  207   1HB   LYS  32           HB2      LYS  32   7.765  -4.643 -10.084
  208   2HB   LYS  32           HB1      LYS  32   6.524  -4.626 -11.343
  209   1HG   LYS  32           HG2      LYS  32   7.275  -2.580 -12.233
  210   2HG   LYS  32           HG1      LYS  32   8.164  -2.160 -10.768
  211   1HD   LYS  32           HD2      LYS  32   9.820  -2.874 -12.378
  212   2HD   LYS  32           HD1      LYS  32   9.634  -4.217 -11.236
  213   1HE   LYS  32           HE2      LYS  32   9.315  -5.473 -13.169
  214   2HE   LYS  32           HE1      LYS  32   7.672  -4.795 -13.111
  215   1HZ   LYS  32           HZ1      LYS  32   8.600  -2.815 -14.296
  216   2HZ   LYS  32           HZ3      LYS  32  10.026  -3.699 -14.547
  217   3HZ   LYS  32           HZ2      LYS  32   8.562  -4.241 -15.219
  218    H    ALA  33           HN       ALA  33   6.161  -0.973 -10.577
  219    HA   ALA  33           HA       ALA  33   8.025   0.280  -8.862
  220   1HB   ALA  33           HB2      ALA  33   7.066   1.036 -11.116
  221   2HB   ALA  33           HB1      ALA  33   5.598   1.485 -10.242
  222   3HB   ALA  33           HB3      ALA  33   7.122   2.300  -9.885
  223    H    ILE  34           HN       ILE  34   4.374   0.102  -8.706
  224    HA   ILE  34           HA       ILE  34   4.115   1.674  -6.400
  225    HB   ILE  34           HB       ILE  34   2.654  -0.526  -7.718
  226   1HG1  ILE  34          HG12      ILE  34   2.376   2.459  -7.384
  227   2HG1  ILE  34          HG11      ILE  34   2.462   1.523  -8.873
  228   1HG2  ILE  34          HG21      ILE  34   2.271  -0.579  -5.188
  229   2HG2  ILE  34          HG23      ILE  34   1.623   1.052  -5.333
  230   3HG2  ILE  34          HG22      ILE  34   0.820  -0.288  -6.143
  231   1HD1  ILE  34          HD13      ILE  34   0.281   0.445  -8.184
  232   2HD1  ILE  34          HD12      ILE  34   0.188   1.651  -6.901
  233   3HD1  ILE  34          HD11      ILE  34   0.171   2.157  -8.591
  234    H    CYS  35           HN       CYS  35   5.185  -1.508  -6.877
  235    HA   CYS  35           HA       CYS  35   4.931  -2.559  -4.199
  236   1HB   CYS  35           HB2      CYS  35   5.518  -4.037  -6.054
  237   2HB   CYS  35           HB1      CYS  35   6.955  -3.068  -6.426
  238    H    ASN  36           HN       ASN  36   7.956  -1.385  -5.778
  239    HA   ASN  36           HA       ASN  36   9.372  -0.863  -3.336
  240   1HB   ASN  36           HB2      ASN  36  10.405  -0.888  -5.582
  241   2HB   ASN  36           HB1      ASN  36   9.459   0.527  -6.062
  242   1HD2  ASN  36          HD22      ASN  36  12.661   1.986  -5.103
  243   2HD2  ASN  36          HD21      ASN  36  11.954   1.153  -6.402
  244    H    LYS  37           HN       LYS  37   7.541   1.457  -5.316
  245    HA   LYS  37           HA       LYS  37   7.812   3.740  -3.700
  246   1HB   LYS  37           HB2      LYS  37   7.106   3.442  -6.109
  247   2HB   LYS  37           HB1      LYS  37   5.507   3.024  -5.498
  248   1HG   LYS  37           HG2      LYS  37   6.887   5.590  -4.693
  249   2HG   LYS  37           HG1      LYS  37   5.906   5.491  -6.153
  250   1HD   LYS  37           HD2      LYS  37   4.192   4.367  -4.399
  251   2HD   LYS  37           HD1      LYS  37   5.068   5.428  -3.299
  252   1HE   LYS  37           HE2      LYS  37   3.753   6.322  -5.898
  253   2HE   LYS  37           HE1      LYS  37   3.098   6.594  -4.271
  254   1HZ   LYS  37           HZ3      LYS  37   5.240   7.660  -3.693
  255   2HZ   LYS  37           HZ2      LYS  37   5.712   7.540  -5.321
  256   3HZ   LYS  37           HZ1      LYS  37   4.381   8.503  -4.888
  257    H    ASN  38           HN       ASN  38   4.553   2.396  -4.191
  258    HA   ASN  38           HA       ASN  38   3.425   3.548  -1.944
  259   1HB   ASN  38           HB2      ASN  38   2.840   1.390  -3.847
  260   2HB   ASN  38           HB1      ASN  38   1.701   1.743  -2.543
  261   1HD2  ASN  38          HD22      ASN  38   1.972   4.180  -5.755
  262   2HD2  ASN  38          HD21      ASN  38   2.909   2.769  -5.603
  263    H    CYS  39           HN       CYS  39   4.974   0.469  -2.331
  264    HA   CYS  39           HA       CYS  39   3.946  -0.960  -0.131
  265   1HB   CYS  39           HB2      CYS  39   6.759  -0.732  -1.178
  266   2HB   CYS  39           HB1      CYS  39   6.275  -1.952   0.006
  267    H    THR  40           HN       THR  40   6.182   1.765  -0.037
  268    HA   THR  40           HA       THR  40   6.896   1.400   2.775
  269    HB   THR  40           HB       THR  40   7.751   3.820   2.365
  270    HG1  THR  40           HG1      THR  40   7.803   4.364   0.159
  271   1HG2  THR  40          HG23      THR  40   8.648   1.315   0.951
  272   2HG2  THR  40          HG22      THR  40   9.447   2.838   0.559
  273   3HG2  THR  40          HG21      THR  40   9.463   2.238   2.217
   
  No H/Q in entry =         273
  Start of MODEL   14
    1   1H    ASP   1           HT2      ASP   1   8.396   2.583   6.884
    2   2H    ASP   1           HT1      ASP   1   9.275   3.172   8.214
    3   3H    ASP   1           HT3      ASP   1   9.465   3.889   6.689
    4    HA   ASP   1           HA       ASP   1  11.365   2.519   7.017
    5   1HB   ASP   1           HB2      ASP   1  10.995   0.142   7.689
    6   2HB   ASP   1           HB1      ASP   1  10.380   1.280   8.886
    7    H    ASP   2           HN       ASP   2  12.181   1.900   5.062
    8    HA   ASP   2           HA       ASP   2  10.333   1.355   2.826
    9   1HB   ASP   2           HB2      ASP   2  13.409   1.402   3.000
   10   2HB   ASP   2           HB1      ASP   2  12.460   1.479   1.509
   11    H    GLY   3           HN       GLY   3  12.345  -0.455   1.491
   12   1HA   GLY   3           HA2      GLY   3  12.953  -2.779   2.873
   13   2HA   GLY   3           HA1      GLY   3  11.262  -2.980   2.434
   14    H    LEU   4           HN       LEU   4  11.804  -4.729   1.026
   15    HA   LEU   4           HA       LEU   4  13.072  -3.882  -1.552
   16   1HB   LEU   4           HB2      LEU   4  13.323  -6.623  -0.289
   17   2HB   LEU   4           HB1      LEU   4  14.275  -5.941  -1.603
   18    HG   LEU   4           HG       LEU   4  14.299  -4.683   1.144
   19   1HD1  LEU   4          HD12      LEU   4  15.935  -7.001   0.098
   20   2HD1  LEU   4          HD11      LEU   4  16.455  -5.995   1.451
   21   3HD1  LEU   4          HD13      LEU   4  14.969  -6.940   1.575
   22   1HD2  LEU   4          HD23      LEU   4  15.821  -4.469  -1.412
   23   2HD2  LEU   4          HD22      LEU   4  15.418  -3.215  -0.238
   24   3HD2  LEU   4          HD21      LEU   4  16.751  -4.323   0.080
   25    H    CYS   5           HN       CYS   5  12.492  -5.833  -3.269
   26    HA   CYS   5           HA       CYS   5   9.710  -6.822  -2.727
   27   1HB   CYS   5           HB2      CYS   5   9.707  -4.548  -3.893
   28   2HB   CYS   5           HB1      CYS   5  10.443  -5.353  -5.277
   29    H    TYR   6           HN       TYR   6   9.078  -8.568  -4.070
   30    HA   TYR   6           HA       TYR   6  11.205  -9.758  -5.801
   31   1HB   TYR   6           HB2      TYR   6  11.113 -11.860  -4.620
   32   2HB   TYR   6           HB1      TYR   6  11.329 -10.603  -3.418
   33    HD1  TYR   6           HD2      TYR   6   9.543 -10.024  -1.882
   34    HD2  TYR   6           HD1      TYR   6   9.049 -13.093  -4.820
   35    HE1  TYR   6           HE2      TYR   6   7.522 -10.827  -0.687
   36    HE2  TYR   6           HE1      TYR   6   7.041 -13.924  -3.624
   37    HH   TYR   6           HH       TYR   6   5.272 -12.392  -1.728
   38    H    GLU   7           HN       GLU   7  10.182 -11.597  -7.166
   39    HA   GLU   7           HA       GLU   7   7.309 -10.874  -7.702
   40   1HB   GLU   7           HB2      GLU   7   7.870 -10.947 -10.005
   41   2HB   GLU   7           HB1      GLU   7   9.238 -10.137  -9.254
   42   1HG   GLU   7           HG2      GLU   7  10.288 -12.518  -9.175
   43   2HG   GLU   7           HG1      GLU   7   8.985 -12.914 -10.312
   44    H    GLY   8           HN       GLY   8   5.943 -12.511  -8.454
   45   1HA   GLY   8           HA2      GLY   8   6.301 -15.066  -9.196
   46   2HA   GLY   8           HA1      GLY   8   6.642 -15.212  -7.473
   47    H    THR   9           HN       THR   9   4.873 -15.864  -6.326
   48    HA   THR   9           HA       THR   9   2.194 -14.762  -6.947
   49    HB   THR   9           HB       THR   9   3.051 -17.642  -7.024
   50    HG1  THR   9           HG1      THR   9   2.053 -15.905  -9.028
   51   1HG2  THR   9          HG22      THR   9   0.340 -16.360  -7.010
   52   2HG2  THR   9          HG21      THR   9   0.586 -17.803  -7.993
   53   3HG2  THR   9          HG23      THR   9   0.870 -17.862  -6.254
   54    H    ASN  10           HN       ASN  10   4.316 -15.108  -4.519
   55    HA   ASN  10           HA       ASN  10   2.961 -16.852  -2.644
   56   1HB   ASN  10           HB2      ASN  10   5.376 -16.284  -2.753
   57   2HB   ASN  10           HB1      ASN  10   4.988 -14.680  -2.134
   58   1HD2  ASN  10          HD22      ASN  10   4.656 -15.845   1.243
   59   2HD2  ASN  10          HD21      ASN  10   4.642 -14.474   0.183
   60    H    CYS  11           HN       CYS  11   2.231 -13.711  -3.567
   61    HA   CYS  11           HA       CYS  11   0.574 -13.375  -1.092
   62   1HB   CYS  11           HB2      CYS  11   2.219 -11.420  -2.687
   63   2HB   CYS  11           HB1      CYS  11   0.888 -10.845  -1.670
   64    H    GLY  12           HN       GLY  12   0.094 -14.574  -3.768
   65   1HA   GLY  12           HA2      GLY  12  -1.876 -14.678  -5.077
   66   2HA   GLY  12           HA1      GLY  12  -2.516 -13.384  -4.054
   67    H    LYS  13           HN       LYS  13   0.551 -12.738  -5.359
   68    HA   LYS  13           HA       LYS  13  -0.523 -10.582  -6.993
   69   1HB   LYS  13           HB2      LYS  13   1.689  -9.771  -6.880
   70   2HB   LYS  13           HB1      LYS  13   1.349 -10.553  -5.349
   71   1HG   LYS  13           HG2      LYS  13   2.385 -12.665  -6.382
   72   2HG   LYS  13           HG1      LYS  13   3.008 -11.594  -7.624
   73   1HD   LYS  13           HD2      LYS  13   3.830 -10.199  -5.556
   74   2HD   LYS  13           HD1      LYS  13   3.704 -11.744  -4.727
   75   1HE   LYS  13           HE2      LYS  13   5.053 -12.722  -6.676
   76   2HE   LYS  13           HE1      LYS  13   5.433 -11.045  -7.106
   77   1HZ   LYS  13           HZ2      LYS  13   5.718 -12.040  -4.341
   78   2HZ   LYS  13           HZ1      LYS  13   6.974 -12.205  -5.471
   79   3HZ   LYS  13           HZ3      LYS  13   6.417 -10.663  -5.045
   80    H    VAL  14           HN       VAL  14  -1.276 -12.858  -8.133
   81    HA   VAL  14           HA       VAL  14   0.524 -13.948 -10.123
   82    HB   VAL  14           HB       VAL  14  -2.482 -13.796  -9.772
   83   1HG1  VAL  14          HG11      VAL  14  -1.976 -13.972 -12.193
   84   2HG1  VAL  14          HG13      VAL  14  -0.952 -15.374 -11.870
   85   3HG1  VAL  14          HG12      VAL  14  -2.689 -15.465 -11.578
   86   1HG2  VAL  14          HG23      VAL  14  -0.720 -15.275  -8.379
   87   2HG2  VAL  14          HG22      VAL  14  -2.330 -15.868  -8.781
   88   3HG2  VAL  14          HG21      VAL  14  -0.945 -16.353  -9.757
   89    H    GLY  15           HN       GLY  15   1.457 -12.546 -11.631
   90   1HA   GLY  15           HA2      GLY  15   1.113 -11.328 -13.745
   91   2HA   GLY  15           HA1      GLY  15  -0.450 -10.780 -13.135
   92    H    LYS  16           HN       LYS  16   0.997 -10.188 -10.422
   93    HA   LYS  16           HA       LYS  16   2.329  -7.661 -11.344
   94   1HB   LYS  16           HB2      LYS  16   0.565  -8.060  -8.935
   95   2HB   LYS  16           HB1      LYS  16   1.253  -6.546  -9.511
   96   1HG   LYS  16           HG2      LYS  16  -0.010  -6.770 -11.624
   97   2HG   LYS  16           HG1      LYS  16  -0.753  -8.247 -11.012
   98   1HD   LYS  16           HD2      LYS  16  -1.031  -6.115  -9.065
   99   2HD   LYS  16           HD1      LYS  16  -1.655  -5.595 -10.631
  100   1HE   LYS  16           HE2      LYS  16  -2.543  -8.282 -10.233
  101   2HE   LYS  16           HE1      LYS  16  -2.893  -7.372  -8.750
  102   1HZ   LYS  16           HZ1      LYS  16  -3.438  -6.298 -11.459
  103   2HZ   LYS  16           HZ3      LYS  16  -4.598  -7.162 -10.573
  104   3HZ   LYS  16           HZ2      LYS  16  -3.988  -5.696  -9.969
  105    H    TYR  17           HN       TYR  17   2.850  -7.159  -8.251
  106    HA   TYR  17           HA       TYR  17   4.782  -9.391  -7.799
  107   1HB   TYR  17           HB2      TYR  17   5.644  -6.496  -7.714
  108   2HB   TYR  17           HB1      TYR  17   6.628  -7.968  -7.717
  109    HD1  TYR  17           HD1      TYR  17   4.469  -5.824  -9.880
  110    HD2  TYR  17           HD2      TYR  17   7.148  -9.142  -9.640
  111    HE1  TYR  17           HE1      TYR  17   4.647  -5.870 -12.356
  112    HE2  TYR  17           HE2      TYR  17   7.346  -9.198 -12.083
  113    HH   TYR  17           HH       TYR  17   6.627  -6.802 -14.040
  114    H    CYS  18           HN       CYS  18   5.978  -8.842  -5.450
  115    HA   CYS  18           HA       CYS  18   3.928  -7.564  -3.674
  116   1HB   CYS  18           HB2      CYS  18   5.207 -10.318  -3.503
  117   2HB   CYS  18           HB1      CYS  18   4.301  -9.592  -2.174
  118    H    CYS  19           HN       CYS  19   4.824  -7.092  -1.502
  119    HA   CYS  19           HA       CYS  19   7.776  -6.799  -1.494
  120   1HB   CYS  19           HB2      CYS  19   7.177  -4.532  -0.333
  121   2HB   CYS  19           HB1      CYS  19   6.972  -4.671  -2.081
  122    H    SER  20           HN       SER  20   8.659  -7.730   0.289
  123    HA   SER  20           HA       SER  20   7.584  -7.375   2.969
  124   1HB   SER  20           HB2      SER  20   7.140  -9.837   3.339
  125   2HB   SER  20           HB1      SER  20   6.078  -9.146   2.110
  126    HG   SER  20           HG       SER  20   7.057 -11.131   1.465
  127    HA   PRO  21           HA       PRO  21  11.992  -8.119   3.019
  128   1HB   PRO  21           HB2      PRO  21  12.507  -7.069   5.498
  129   2HB   PRO  21           HB1      PRO  21  12.270  -6.073   4.047
  130   1HG   PRO  21           HG2      PRO  21  10.388  -6.576   6.295
  131   2HG   PRO  21           HG1      PRO  21  10.552  -5.162   5.236
  132   1HD   PRO  21           HD2      PRO  21   8.624  -7.208   5.053
  133   2HD   PRO  21           HD1      PRO  21   8.964  -5.972   3.820
  134    H    ILE  22           HN       ILE  22   9.572  -9.453   4.917
  135    HA   ILE  22           HA       ILE  22  11.177 -11.811   5.533
  136    HB   ILE  22           HB       ILE  22  11.731  -9.986   7.250
  137   1HG1  ILE  22          HG12      ILE  22  10.518 -12.607   8.226
  138   2HG1  ILE  22          HG11      ILE  22  12.218 -12.306   7.865
  139   1HG2  ILE  22          HG21      ILE  22   9.044  -9.619   7.207
  140   2HG2  ILE  22          HG23      ILE  22   9.216 -10.597   8.664
  141   3HG2  ILE  22          HG22      ILE  22  10.093  -9.075   8.519
  142   1HD1  ILE  22          HD12      ILE  22  11.561 -10.312   9.710
  143   2HD1  ILE  22          HD11      ILE  22  10.724 -11.746  10.309
  144   3HD1  ILE  22          HD13      ILE  22  12.468 -11.787  10.048
  145    H    GLY  23           HN       GLY  23   8.596 -10.785   4.411
  146   1HA   GLY  23           HA2      GLY  23   6.481 -11.814   3.994
  147   2HA   GLY  23           HA1      GLY  23   6.952 -13.052   5.150
  148    H    LYS  24           HN       LYS  24   7.401  -9.965   6.410
  149    HA   LYS  24           HA       LYS  24   5.076 -10.321   8.160
  150   1HB   LYS  24           HB2      LYS  24   6.157  -8.795   9.613
  151   2HB   LYS  24           HB1      LYS  24   7.427  -9.808   8.937
  152   1HG   LYS  24           HG2      LYS  24   7.769  -8.016   7.172
  153   2HG   LYS  24           HG1      LYS  24   6.675  -7.006   8.116
  154   1HD   LYS  24           HD2      LYS  24   8.770  -8.232   9.750
  155   2HD   LYS  24           HD1      LYS  24   9.413  -7.179   8.491
  156   1HE   LYS  24           HE2      LYS  24   8.920  -5.425   9.844
  157   2HE   LYS  24           HE1      LYS  24   7.204  -5.784   9.570
  158   1HZ   LYS  24           HZ2      LYS  24   7.393  -7.507  11.324
  159   2HZ   LYS  24           HZ1      LYS  24   8.958  -6.944  11.668
  160   3HZ   LYS  24           HZ3      LYS  24   7.621  -5.927  11.907
  161    H    TYR  25           HN       TYR  25   4.971  -9.320   5.249
  162    HA   TYR  25           HA       TYR  25   3.104  -7.081   5.791
  163   1HB   TYR  25           HB2      TYR  25   5.609  -6.978   4.121
  164   2HB   TYR  25           HB1      TYR  25   4.256  -5.899   3.795
  165    HD1  TYR  25           HD1      TYR  25   3.396  -4.425   5.720
  166    HD2  TYR  25           HD2      TYR  25   7.140  -6.510   5.823
  167    HE1  TYR  25           HE1      TYR  25   4.182  -2.912   7.526
  168    HE2  TYR  25           HE2      TYR  25   7.936  -4.997   7.631
  169    HH   TYR  25           HH       TYR  25   7.447  -2.747   8.483
  170    H    CYS  26           HN       CYS  26   4.575  -9.182   3.280
  171    HA   CYS  26           HA       CYS  26   3.621  -9.928   1.195
  172   1HB   CYS  26           HB2      CYS  26   2.783 -11.407   3.069
  173   2HB   CYS  26           HB1      CYS  26   1.340 -10.397   3.177
  174    H    VAL  27           HN       VAL  27   3.461  -7.302   0.879
  175    HA   VAL  27           HA       VAL  27   0.563  -6.654   0.345
  176    HB   VAL  27           HB       VAL  27   2.986  -4.867   0.762
  177   1HG1  VAL  27          HG12      VAL  27   0.749  -4.241  -0.620
  178   2HG1  VAL  27          HG11      VAL  27   0.201  -3.868   1.013
  179   3HG1  VAL  27          HG13      VAL  27   1.631  -3.067   0.358
  180   1HG2  VAL  27          HG21      VAL  27   0.742  -5.774   2.578
  181   2HG2  VAL  27          HG23      VAL  27   2.480  -5.867   2.865
  182   3HG2  VAL  27          HG22      VAL  27   1.663  -4.304   2.899
  183    H    CYS  28           HN       CYS  28   0.096  -6.796  -1.835
  184    HA   CYS  28           HA       CYS  28   2.382  -6.423  -3.736
  185   1HB   CYS  28           HB2      CYS  28  -0.200  -7.942  -4.110
  186   2HB   CYS  28           HB1      CYS  28   1.268  -8.097  -5.070
  187    H    TYR  29           HN       TYR  29   1.917  -5.583  -5.832
  188    HA   TYR  29           HA       TYR  29  -0.534  -3.946  -6.169
  189   1HB   TYR  29           HB2      TYR  29   2.315  -2.990  -6.239
  190   2HB   TYR  29           HB1      TYR  29   0.932  -2.062  -6.776
  191    HD1  TYR  29           HD1      TYR  29   2.437  -3.746  -3.883
  192    HD2  TYR  29           HD2      TYR  29  -0.383  -0.860  -5.276
  193    HE1  TYR  29           HE1      TYR  29   2.150  -2.925  -1.571
  194    HE2  TYR  29           HE2      TYR  29  -0.698  -0.023  -2.973
  195    HH   TYR  29           HH       TYR  29  -0.402  -0.777  -0.685
  196    H    ASP  30           HN       ASP  30  -0.254  -2.859  -8.516
  197    HA   ASP  30           HA       ASP  30   0.490  -5.002 -10.346
  198   1HB   ASP  30           HB2      ASP  30  -0.674  -3.762 -11.936
  199   2HB   ASP  30           HB1      ASP  30  -1.534  -3.458 -10.430
  200    H    SER  31           HN       SER  31   1.664  -1.703  -9.692
  201    HA   SER  31           HA       SER  31   3.830  -1.979 -11.691
  202   1HB   SER  31           HB2      SER  31   3.636   0.085  -9.553
  203   2HB   SER  31           HB1      SER  31   4.308   0.245 -11.169
  204    HG   SER  31           HG       SER  31   2.226   1.189 -10.994
  205    H    LYS  32           HN       LYS  32   5.647  -3.340 -11.127
  206    HA   LYS  32           HA       LYS  32   6.111  -4.327  -8.519
  207   1HB   LYS  32           HB2      LYS  32   8.243  -5.052  -9.402
  208   2HB   LYS  32           HB1      LYS  32   7.200  -4.927 -10.824
  209   1HG   LYS  32           HG2      LYS  32   8.224  -2.940 -11.560
  210   2HG   LYS  32           HG1      LYS  32   8.925  -2.605  -9.976
  211   1HD   LYS  32           HD2      LYS  32  10.759  -3.440 -11.265
  212   2HD   LYS  32           HD1      LYS  32  10.230  -4.836 -10.307
  213   1HE   LYS  32           HE2      LYS  32  10.241  -5.843 -12.428
  214   2HE   LYS  32           HE1      LYS  32   8.608  -5.138 -12.483
  215   1HZ   LYS  32           HZ1      LYS  32  11.045  -3.647 -13.289
  216   2HZ   LYS  32           HZ3      LYS  32  10.094  -4.520 -14.389
  217   3HZ   LYS  32           HZ2      LYS  32   9.424  -3.207 -13.545
  218    H    ALA  33           HN       ALA  33   7.019  -1.250 -10.016
  219    HA   ALA  33           HA       ALA  33   8.680  -0.189  -7.984
  220   1HB   ALA  33           HB1      ALA  33   8.169   0.692 -10.337
  221   2HB   ALA  33           HB3      ALA  33   6.612   1.233  -9.704
  222   3HB   ALA  33           HB2      ALA  33   8.109   1.921  -9.070
  223    H    ILE  34           HN       ILE  34   5.052  -0.076  -8.430
  224    HA   ILE  34           HA       ILE  34   4.533   1.466  -6.142
  225    HB   ILE  34           HB       ILE  34   3.148  -0.579  -7.757
  226   1HG1  ILE  34          HG12      ILE  34   3.051   2.411  -7.387
  227   2HG1  ILE  34          HG11      ILE  34   3.306   1.495  -8.868
  228   1HG2  ILE  34          HG22      ILE  34   2.366  -0.578  -5.285
  229   2HG2  ILE  34          HG21      ILE  34   1.787   1.053  -5.597
  230   3HG2  ILE  34          HG23      ILE  34   1.122  -0.302  -6.501
  231   1HD1  ILE  34          HD12      ILE  34   0.956   0.569  -8.520
  232   2HD1  ILE  34          HD11      ILE  34   0.761   1.821  -7.294
  233   3HD1  ILE  34          HD13      ILE  34   1.057   2.272  -8.974
  234    H    CYS  35           HN       CYS  35   5.416  -1.783  -6.548
  235    HA   CYS  35           HA       CYS  35   4.620  -2.889  -4.009
  236   1HB   CYS  35           HB2      CYS  35   5.444  -4.342  -5.799
  237   2HB   CYS  35           HB1      CYS  35   6.988  -3.470  -5.845
  238    H    ASN  36           HN       ASN  36   7.923  -1.835  -4.993
  239    HA   ASN  36           HA       ASN  36   8.931  -1.516  -2.319
  240   1HB   ASN  36           HB2      ASN  36  10.348  -1.516  -4.333
  241   2HB   ASN  36           HB1      ASN  36   9.560  -0.048  -4.930
  242   1HD2  ASN  36          HD21      ASN  36  10.569   1.900  -4.344
  243   2HD2  ASN  36          HD22      ASN  36  11.705   2.061  -3.093
  244    H    LYS  37           HN       LYS  37   7.635   1.012  -4.464
  245    HA   LYS  37           HA       LYS  37   7.727   3.188  -2.687
  246   1HB   LYS  37           HB2      LYS  37   7.496   3.057  -5.200
  247   2HB   LYS  37           HB1      LYS  37   5.784   2.734  -4.939
  248   1HG   LYS  37           HG2      LYS  37   7.144   5.148  -3.728
  249   2HG   LYS  37           HG1      LYS  37   6.464   5.190  -5.354
  250   1HD   LYS  37           HD2      LYS  37   4.353   4.145  -4.084
  251   2HD   LYS  37           HD1      LYS  37   5.070   5.000  -2.720
  252   1HE   LYS  37           HE2      LYS  37   4.381   6.259  -5.407
  253   2HE   LYS  37           HE1      LYS  37   3.463   6.468  -3.902
  254   1HZ   LYS  37           HZ3      LYS  37   5.638   7.166  -2.873
  255   2HZ   LYS  37           HZ2      LYS  37   6.267   7.266  -4.448
  256   3HZ   LYS  37           HZ1      LYS  37   4.971   8.261  -3.982
  257    H    ASN  38           HN       ASN  38   4.552   2.112  -3.883
  258    HA   ASN  38           HA       ASN  38   3.061   3.260  -1.860
  259   1HB   ASN  38           HB2      ASN  38   2.747   1.204  -3.930
  260   2HB   ASN  38           HB1      ASN  38   1.392   1.591  -2.867
  261   1HD2  ASN  38          HD22      ASN  38   2.450   4.107  -5.850
  262   2HD2  ASN  38          HD21      ASN  38   3.258   2.634  -5.574
  263    H    CYS  39           HN       CYS  39   4.523   0.128  -2.023
  264    HA   CYS  39           HA       CYS  39   2.982  -1.356  -0.199
  265   1HB   CYS  39           HB2      CYS  39   5.958  -1.145  -0.575
  266   2HB   CYS  39           HB1      CYS  39   5.246  -2.323   0.532
  267    H    THR  40           HN       THR  40   5.125   1.328   0.552
  268    HA   THR  40           HA       THR  40   5.116   0.872   3.439
  269    HB   THR  40           HB       THR  40   6.045   3.294   3.328
  270    HG1  THR  40           HG1      THR  40   6.415   2.784   0.608
  271   1HG2  THR  40          HG21      THR  40   7.275   0.843   2.057
  272   2HG2  THR  40          HG23      THR  40   8.155   2.373   2.026
  273   3HG2  THR  40          HG22      THR  40   7.703   1.647   3.568
   
  No H/Q in entry =         273
  Start of MODEL   15
    1   1H    ASP   1           HT2      ASP   1  10.688   3.156   7.795
    2   2H    ASP   1           HT1      ASP   1  10.000   2.598   9.245
    3   3H    ASP   1           HT3      ASP   1  11.297   1.759   8.545
    4    HA   ASP   1           HA       ASP   1   9.360   0.507   8.033
    5   1HB   ASP   1           HB2      ASP   1   7.427   1.728   6.990
    6   2HB   ASP   1           HB1      ASP   1   7.793   2.266   8.627
    7    H    ASP   2           HN       ASP   2  10.562  -0.540   6.471
    8    HA   ASP   2           HA       ASP   2  10.371   0.471   3.690
    9   1HB   ASP   2           HB2      ASP   2  12.914   0.211   5.353
   10   2HB   ASP   2           HB1      ASP   2  12.979   0.095   3.588
   11    H    GLY   3           HN       GLY   3  12.180  -1.303   2.521
   12   1HA   GLY   3           HA2      GLY   3  12.395  -3.912   3.427
   13   2HA   GLY   3           HA1      GLY   3  10.772  -3.835   2.753
   14    H    LEU   4           HN       LEU   4  11.418  -5.327   1.086
   15    HA   LEU   4           HA       LEU   4  13.035  -4.057  -1.090
   16   1HB   LEU   4           HB2      LEU   4  13.011  -7.007  -0.395
   17   2HB   LEU   4           HB1      LEU   4  14.121  -6.158  -1.465
   18    HG   LEU   4           HG       LEU   4  13.936  -5.442   1.464
   19   1HD1  LEU   4          HD13      LEU   4  14.649  -7.966   0.576
   20   2HD1  LEU   4          HD12      LEU   4  16.198  -7.132   0.683
   21   3HD1  LEU   4          HD11      LEU   4  15.153  -7.237   2.100
   22   1HD2  LEU   4          HD22      LEU   4  15.702  -4.836  -0.857
   23   2HD2  LEU   4          HD21      LEU   4  15.262  -3.818   0.515
   24   3HD2  LEU   4          HD23      LEU   4  16.501  -5.059   0.699
   25    H    CYS   5           HN       CYS   5  12.594  -5.572  -3.232
   26    HA   CYS   5           HA       CYS   5   9.669  -6.321  -3.252
   27   1HB   CYS   5           HB2      CYS   5  10.103  -3.979  -4.123
   28   2HB   CYS   5           HB1      CYS   5  11.040  -4.704  -5.428
   29    H    TYR   6           HN       TYR   6   9.237  -8.131  -4.374
   30    HA   TYR   6           HA       TYR   6  11.309  -9.232  -6.232
   31   1HB   TYR   6           HB2      TYR   6  11.244 -11.369  -5.076
   32   2HB   TYR   6           HB1      TYR   6  11.578 -10.116  -3.892
   33    HD1  TYR   6           HD1      TYR   6   9.025 -12.393  -5.242
   34    HD2  TYR   6           HD2      TYR   6  10.023  -9.620  -2.144
   35    HE1  TYR   6           HE1      TYR   6   7.064 -13.159  -3.941
   36    HE2  TYR   6           HE2      TYR   6   8.050 -10.369  -0.825
   37    HH   TYR   6           HH       TYR   6   5.708 -11.510  -1.522
   38    H    GLU   7           HN       GLU   7  10.284 -11.054  -7.587
   39    HA   GLU   7           HA       GLU   7   7.347 -10.491  -7.926
   40   1HB   GLU   7           HB2      GLU   7   7.757 -10.485 -10.265
   41   2HB   GLU   7           HB1      GLU   7   9.121  -9.605  -9.591
   42   1HG   GLU   7           HG2      GLU   7  10.317 -11.916  -9.631
   43   2HG   GLU   7           HG1      GLU   7   8.963 -12.374 -10.683
   44    H    GLY   8           HN       GLY   8   6.026 -12.232  -8.500
   45   1HA   GLY   8           HA2      GLY   8   6.551 -14.723  -9.370
   46   2HA   GLY   8           HA1      GLY   8   7.059 -14.882  -7.694
   47    H    THR   9           HN       THR   9   5.467 -15.685  -6.378
   48    HA   THR   9           HA       THR   9   2.642 -14.914  -6.818
   49    HB   THR   9           HB       THR   9   3.822 -17.673  -6.929
   50    HG1  THR   9           HG1      THR   9   4.058 -17.031  -8.915
   51   1HG2  THR   9          HG23      THR   9   0.990 -16.707  -6.747
   52   2HG2  THR   9          HG22      THR   9   1.331 -18.110  -7.760
   53   3HG2  THR   9          HG21      THR   9   1.731 -18.145  -6.042
   54    H    ASN  10           HN       ASN  10   4.893 -14.898  -4.517
   55    HA   ASN  10           HA       ASN  10   3.962 -16.813  -2.557
   56   1HB   ASN  10           HB2      ASN  10   6.218 -15.779  -2.787
   57   2HB   ASN  10           HB1      ASN  10   5.549 -14.283  -2.135
   58   1HD2  ASN  10          HD22      ASN  10   5.617 -15.498   1.241
   59   2HD2  ASN  10          HD21      ASN  10   5.274 -14.156   0.198
   60    H    CYS  11           HN       CYS  11   2.720 -13.808  -3.449
   61    HA   CYS  11           HA       CYS  11   1.025 -13.761  -0.975
   62   1HB   CYS  11           HB2      CYS  11   2.307 -11.566  -2.589
   63   2HB   CYS  11           HB1      CYS  11   0.884 -11.219  -1.600
   64    H    GLY  12           HN       GLY  12   0.753 -15.023  -3.665
   65   1HA   GLY  12           HA2      GLY  12  -1.160 -15.419  -5.007
   66   2HA   GLY  12           HA1      GLY  12  -2.018 -14.284  -3.951
   67    H    LYS  13           HN       LYS  13   0.916 -13.120  -5.204
   68    HA   LYS  13           HA       LYS  13  -0.452 -11.070  -6.735
   69   1HB   LYS  13           HB2      LYS  13   1.635  -9.977  -6.596
   70   2HB   LYS  13           HB1      LYS  13   1.422 -10.867  -5.104
   71   1HG   LYS  13           HG2      LYS  13   2.723 -12.773  -6.250
   72   2HG   LYS  13           HG1      LYS  13   3.184 -11.562  -7.434
   73   1HD   LYS  13           HD2      LYS  13   4.177 -10.189  -5.681
   74   2HD   LYS  13           HD1      LYS  13   3.648 -11.340  -4.457
   75   1HE   LYS  13           HE2      LYS  13   5.400 -12.724  -4.866
   76   2HE   LYS  13           HE1      LYS  13   5.182 -12.600  -6.621
   77   1HZ   LYS  13           HZ2      LYS  13   6.082 -10.298  -6.439
   78   2HZ   LYS  13           HZ1      LYS  13   6.512 -10.644  -4.834
   79   3HZ   LYS  13           HZ3      LYS  13   7.211 -11.519  -6.102
   80    H    VAL  14           HN       VAL  14  -0.911 -13.380  -7.960
   81    HA   VAL  14           HA       VAL  14   0.978 -14.116 -10.033
   82    HB   VAL  14           HB       VAL  14  -2.008 -14.425  -9.611
   83   1HG1  VAL  14          HG12      VAL  14  -1.474 -14.424 -12.060
   84   2HG1  VAL  14          HG11      VAL  14  -0.337 -15.743 -11.779
   85   3HG1  VAL  14          HG13      VAL  14  -2.060 -15.986 -11.489
   86   1HG2  VAL  14          HG22      VAL  14   0.043 -15.687  -8.355
   87   2HG2  VAL  14          HG21      VAL  14  -1.522 -16.444  -8.652
   88   3HG2  VAL  14          HG23      VAL  14  -0.173 -16.756  -9.743
   89    H    GLY  15           HN       GLY  15   1.640 -12.540 -11.511
   90   1HA   GLY  15           HA2      GLY  15   1.041 -11.283 -13.546
   91   2HA   GLY  15           HA1      GLY  15  -0.554 -10.983 -12.849
   92    H    LYS  16           HN       LYS  16   0.870 -10.328 -10.159
   93    HA   LYS  16           HA       LYS  16   1.816  -7.601 -10.982
   94   1HB   LYS  16           HB2      LYS  16   0.347  -8.372  -8.469
   95   2HB   LYS  16           HB1      LYS  16   0.758  -6.749  -9.010
   96   1HG   LYS  16           HG2      LYS  16  -0.644  -7.138 -11.058
   97   2HG   LYS  16           HG1      LYS  16  -1.196  -8.647 -10.326
   98   1HD   LYS  16           HD2      LYS  16  -1.540  -6.771  -8.290
   99   2HD   LYS  16           HD1      LYS  16  -2.011  -5.897  -9.747
  100   1HE   LYS  16           HE2      LYS  16  -3.072  -8.627  -9.729
  101   2HE   LYS  16           HE1      LYS  16  -3.640  -7.664  -8.349
  102   1HZ   LYS  16           HZ2      LYS  16  -3.624  -6.736 -11.174
  103   2HZ   LYS  16           HZ1      LYS  16  -4.998  -7.309 -10.356
  104   3HZ   LYS  16           HZ3      LYS  16  -4.237  -5.886  -9.837
  105    H    TYR  17           HN       TYR  17   2.590  -7.131  -8.000
  106    HA   TYR  17           HA       TYR  17   4.736  -9.186  -7.722
  107   1HB   TYR  17           HB2      TYR  17   5.355  -6.222  -7.796
  108   2HB   TYR  17           HB1      TYR  17   6.460  -7.606  -7.844
  109    HD1  TYR  17           HD1      TYR  17   3.911  -5.761  -9.866
  110    HD2  TYR  17           HD2      TYR  17   6.911  -8.797  -9.771
  111    HE1  TYR  17           HE1      TYR  17   3.837  -5.926 -12.343
  112    HE2  TYR  17           HE2      TYR  17   6.865  -8.966 -12.219
  113    HH   TYR  17           HH       TYR  17   4.495  -7.985 -14.072
  114    H    CYS  18           HN       CYS  18   6.075  -8.560  -5.486
  115    HA   CYS  18           HA       CYS  18   4.124  -7.320  -3.571
  116   1HB   CYS  18           HB2      CYS  18   5.478 -10.035  -3.478
  117   2HB   CYS  18           HB1      CYS  18   4.723  -9.303  -2.064
  118    H    CYS  19           HN       CYS  19   5.134  -6.700  -1.522
  119    HA   CYS  19           HA       CYS  19   8.082  -6.440  -1.595
  120   1HB   CYS  19           HB2      CYS  19   7.579  -4.033  -0.711
  121   2HB   CYS  19           HB1      CYS  19   7.349  -4.364  -2.429
  122    H    SER  20           HN       SER  20   8.701  -7.586   0.204
  123    HA   SER  20           HA       SER  20   7.984  -6.679   2.853
  124   1HB   SER  20           HB2      SER  20   6.954  -9.047   3.415
  125   2HB   SER  20           HB1      SER  20   5.937  -7.841   2.621
  126    HG   SER  20           HG       SER  20   6.614 -10.250   1.757
  127    HA   PRO  21           HA       PRO  21  11.847  -8.775   3.208
  128   1HB   PRO  21           HB2      PRO  21  12.265  -8.496   5.903
  129   2HB   PRO  21           HB1      PRO  21  12.462  -7.163   4.747
  130   1HG   PRO  21           HG2      PRO  21  10.206  -7.694   6.626
  131   2HG   PRO  21           HG1      PRO  21  10.877  -6.154   6.049
  132   1HD   PRO  21           HD2      PRO  21   8.548  -7.395   5.128
  133   2HD   PRO  21           HD1      PRO  21   9.434  -6.102   4.285
  134    H    ILE  22           HN       ILE  22   8.977  -9.683   4.763
  135    HA   ILE  22           HA       ILE  22   9.609 -12.532   4.661
  136    HB   ILE  22           HB       ILE  22  10.750 -11.455   6.742
  137   1HG1  ILE  22          HG12      ILE  22   8.846 -13.803   7.126
  138   2HG1  ILE  22          HG11      ILE  22  10.521 -13.903   6.586
  139   1HG2  ILE  22          HG23      ILE  22   8.352 -10.337   7.136
  140   2HG2  ILE  22          HG22      ILE  22   8.177 -11.758   8.160
  141   3HG2  ILE  22          HG21      ILE  22   9.503 -10.628   8.437
  142   1HD1  ILE  22          HD11      ILE  22  10.804 -12.493   8.912
  143   2HD1  ILE  22          HD13      ILE  22   9.437 -13.533   9.309
  144   3HD1  ILE  22          HD12      ILE  22  10.965 -14.244   8.791
  145    H    GLY  23           HN       GLY  23   7.570 -13.441   6.308
  146   1HA   GLY  23           HA2      GLY  23   5.225 -12.606   4.750
  147   2HA   GLY  23           HA1      GLY  23   5.255 -13.908   5.934
  148    H    LYS  24           HN       LYS  24   6.602 -11.095   7.207
  149    HA   LYS  24           HA       LYS  24   4.229 -10.710   8.872
  150   1HB   LYS  24           HB2      LYS  24   5.651  -9.541  10.344
  151   2HB   LYS  24           HB1      LYS  24   6.625 -10.852   9.691
  152   1HG   LYS  24           HG2      LYS  24   7.373  -9.153   7.901
  153   2HG   LYS  24           HG1      LYS  24   6.690  -7.935   8.974
  154   1HD   LYS  24           HD2      LYS  24   8.557  -9.959  10.140
  155   2HD   LYS  24           HD1      LYS  24   9.237  -8.631   9.199
  156   1HE   LYS  24           HE2      LYS  24   8.889  -7.167  10.895
  157   2HE   LYS  24           HE1      LYS  24   7.196  -7.678  11.061
  158   1HZ   LYS  24           HZ1      LYS  24   9.509  -9.271  12.025
  159   2HZ   LYS  24           HZ3      LYS  24   8.610  -8.231  13.018
  160   3HZ   LYS  24           HZ2      LYS  24   7.862  -9.580  12.305
  161    H    TYR  25           HN       TYR  25   4.726  -9.682   5.909
  162    HA   TYR  25           HA       TYR  25   3.266  -7.149   6.328
  163   1HB   TYR  25           HB2      TYR  25   5.993  -7.423   5.063
  164   2HB   TYR  25           HB1      TYR  25   4.921  -6.092   4.637
  165    HD1  TYR  25           HD1      TYR  25   3.901  -4.757   6.725
  166    HD2  TYR  25           HD2      TYR  25   7.448  -7.166   6.811
  167    HE1  TYR  25           HE1      TYR  25   4.669  -3.547   8.749
  168    HE2  TYR  25           HE2      TYR  25   8.224  -5.956   8.843
  169    HH   TYR  25           HH       TYR  25   6.773  -3.061   9.909
  170    H    CYS  26           HN       CYS  26   4.908  -9.080   3.778
  171    HA   CYS  26           HA       CYS  26   4.163  -9.497   1.520
  172   1HB   CYS  26           HB2      CYS  26   3.199 -11.325   2.815
  173   2HB   CYS  26           HB1      CYS  26   1.888 -10.293   3.402
  174    H    VAL  27           HN       VAL  27   4.022  -6.991   1.065
  175    HA   VAL  27           HA       VAL  27   1.127  -6.171   0.782
  176    HB   VAL  27           HB       VAL  27   3.691  -4.547   0.938
  177   1HG1  VAL  27          HG12      VAL  27   1.293  -3.850  -0.242
  178   2HG1  VAL  27          HG11      VAL  27   1.110  -3.225   1.396
  179   3HG1  VAL  27          HG13      VAL  27   2.476  -2.710   0.406
  180   1HG2  VAL  27          HG21      VAL  27   2.323  -5.825   2.984
  181   2HG2  VAL  27          HG23      VAL  27   3.381  -4.429   3.182
  182   3HG2  VAL  27          HG22      VAL  27   1.641  -4.199   3.011
  183    H    CYS  28           HN       CYS  28   0.488  -6.515  -1.328
  184    HA   CYS  28           HA       CYS  28   2.567  -6.179  -3.463
  185   1HB   CYS  28           HB2      CYS  28  -0.004  -7.769  -3.494
  186   2HB   CYS  28           HB1      CYS  28   1.342  -7.918  -4.620
  187    H    TYR  29           HN       TYR  29   1.853  -5.478  -5.552
  188    HA   TYR  29           HA       TYR  29  -0.648  -3.896  -5.698
  189   1HB   TYR  29           HB2      TYR  29   2.149  -2.905  -6.166
  190   2HB   TYR  29           HB1      TYR  29   0.688  -2.028  -6.562
  191    HD1  TYR  29           HD1      TYR  29   2.604  -3.526  -3.810
  192    HD2  TYR  29           HD2      TYR  29  -0.467  -0.793  -4.961
  193    HE1  TYR  29           HE1      TYR  29   2.584  -2.598  -1.521
  194    HE2  TYR  29           HE2      TYR  29  -0.513   0.153  -2.679
  195    HH   TYR  29           HH       TYR  29   0.889   0.306  -0.719
  196    H    ASP  30           HN       ASP  30  -0.731  -3.010  -8.116
  197    HA   ASP  30           HA       ASP  30  -0.097  -5.246  -9.874
  198   1HB   ASP  30           HB2      ASP  30  -1.510  -4.171 -11.388
  199   2HB   ASP  30           HB1      ASP  30  -2.199  -3.819  -9.806
  200    H    SER  31           HN       SER  31   0.985  -1.868  -9.573
  201    HA   SER  31           HA       SER  31   2.852  -2.151 -11.851
  202   1HB   SER  31           HB2      SER  31   2.848   0.020  -9.814
  203   2HB   SER  31           HB1      SER  31   3.271   0.118 -11.516
  204    HG   SER  31           HG       SER  31   1.270   0.554 -11.890
  205    H    LYS  32           HN       LYS  32   4.850  -3.319 -11.532
  206    HA   LYS  32           HA       LYS  32   5.765  -4.170  -8.988
  207   1HB   LYS  32           HB2      LYS  32   7.792  -4.772 -10.160
  208   2HB   LYS  32           HB1      LYS  32   6.552  -4.775 -11.419
  209   1HG   LYS  32           HG2      LYS  32   7.310  -2.742 -12.346
  210   2HG   LYS  32           HG1      LYS  32   8.205  -2.306 -10.889
  211   1HD   LYS  32           HD2      LYS  32   9.903  -3.057 -12.392
  212   2HD   LYS  32           HD1      LYS  32   9.603  -4.462 -11.357
  213   1HE   LYS  32           HE2      LYS  32   8.170  -5.491 -13.054
  214   2HE   LYS  32           HE1      LYS  32   8.238  -4.027 -14.058
  215   1HZ   LYS  32           HZ2      LYS  32  10.616  -5.599 -13.207
  216   2HZ   LYS  32           HZ1      LYS  32   9.879  -5.723 -14.733
  217   3HZ   LYS  32           HZ3      LYS  32  10.605  -4.266 -14.261
  218    H    ALA  33           HN       ALA  33   6.218  -1.117 -10.728
  219    HA   ALA  33           HA       ALA  33   8.068   0.161  -9.015
  220   1HB   ALA  33           HB1      ALA  33   7.162   0.872 -11.301
  221   2HB   ALA  33           HB3      ALA  33   5.676   1.346 -10.474
  222   3HB   ALA  33           HB2      ALA  33   7.195   2.164 -10.099
  223    H    ILE  34           HN       ILE  34   4.414   0.014  -8.910
  224    HA   ILE  34           HA       ILE  34   4.142   1.666  -6.658
  225    HB   ILE  34           HB       ILE  34   2.665  -0.548  -7.931
  226   1HG1  ILE  34          HG12      ILE  34   2.435   2.451  -7.705
  227   2HG1  ILE  34          HG11      ILE  34   2.523   1.463  -9.158
  228   1HG2  ILE  34          HG23      ILE  34   2.241  -0.502  -5.405
  229   2HG2  ILE  34          HG22      ILE  34   1.610   1.125  -5.626
  230   3HG2  ILE  34          HG21      ILE  34   0.812  -0.241  -6.398
  231   1HD1  ILE  34          HD12      ILE  34   0.312   0.442  -8.432
  232   2HD1  ILE  34          HD11      ILE  34   0.226   1.729  -7.231
  233   3HD1  ILE  34          HD13      ILE  34   0.242   2.129  -8.948
  234    H    CYS  35           HN       CYS  35   5.161  -1.549  -7.021
  235    HA   CYS  35           HA       CYS  35   4.842  -2.519  -4.323
  236   1HB   CYS  35           HB2      CYS  35   5.448  -4.071  -6.096
  237   2HB   CYS  35           HB1      CYS  35   6.882  -3.115  -6.513
  238    H    ASN  36           HN       ASN  36   7.905  -1.415  -5.878
  239    HA   ASN  36           HA       ASN  36   9.294  -0.858  -3.427
  240   1HB   ASN  36           HB2      ASN  36  10.363  -0.939  -5.651
  241   2HB   ASN  36           HB1      ASN  36   9.429   0.466  -6.184
  242   1HD2  ASN  36          HD22      ASN  36  12.809   1.003  -3.998
  243   2HD2  ASN  36          HD21      ASN  36  12.272  -0.551  -4.422
  244    H    LYS  37           HN       LYS  37   7.523   1.441  -5.487
  245    HA   LYS  37           HA       LYS  37   7.790   3.747  -3.903
  246   1HB   LYS  37           HB2      LYS  37   7.152   3.420  -6.324
  247   2HB   LYS  37           HB1      LYS  37   5.529   3.034  -5.756
  248   1HG   LYS  37           HG2      LYS  37   6.921   5.594  -4.948
  249   2HG   LYS  37           HG1      LYS  37   5.984   5.484  -6.438
  250   1HD   LYS  37           HD2      LYS  37   4.149   4.462  -4.822
  251   2HD   LYS  37           HD1      LYS  37   5.047   5.350  -3.594
  252   1HE   LYS  37           HE2      LYS  37   3.963   6.580  -6.162
  253   2HE   LYS  37           HE1      LYS  37   3.214   6.743  -4.560
  254   1HZ   LYS  37           HZ1      LYS  37   5.420   7.546  -3.756
  255   2HZ   LYS  37           HZ3      LYS  37   5.935   7.614  -5.371
  256   3HZ   LYS  37           HZ2      LYS  37   4.651   8.597  -4.848
  257    H    ASN  38           HN       ASN  38   4.523   2.444  -4.463
  258    HA   ASN  38           HA       ASN  38   3.339   3.657  -2.282
  259   1HB   ASN  38           HB2      ASN  38   2.800   1.435  -4.125
  260   2HB   ASN  38           HB1      ASN  38   1.628   1.836  -2.865
  261   1HD2  ASN  38          HD22      ASN  38   1.983   4.157  -6.153
  262   2HD2  ASN  38          HD21      ASN  38   2.911   2.750  -5.929
  263    H    CYS  39           HN       CYS  39   4.907   0.570  -2.525
  264    HA   CYS  39           HA       CYS  39   3.816  -0.787  -0.305
  265   1HB   CYS  39           HB2      CYS  39   6.651  -0.609  -1.303
  266   2HB   CYS  39           HB1      CYS  39   6.158  -1.754  -0.052
  267    H    THR  40           HN       THR  40   5.945   2.005  -0.244
  268    HA   THR  40           HA       THR  40   6.687   1.729   2.569
  269    HB   THR  40           HB       THR  40   7.411   4.172   2.134
  270    HG1  THR  40           HG1      THR  40   7.379   4.734  -0.070
  271   1HG2  THR  40          HG21      THR  40   8.409   1.690   0.800
  272   2HG2  THR  40          HG23      THR  40   9.040   3.217   0.179
  273   3HG2  THR  40          HG22      THR  40   9.252   2.803   1.881
   
  No H/Q in entry =         273
  Start of MODEL   16
    1   1H    ASP   1           HT2      ASP   1   8.585   1.374   5.449
    2   2H    ASP   1           HT1      ASP   1   9.538   2.314   6.493
    3   3H    ASP   1           HT3      ASP   1   8.333   3.051   5.555
    4    HA   ASP   1           HA       ASP   1   9.518   2.622   3.534
    5   1HB   ASP   1           HB2      ASP   1  11.454   4.065   4.041
    6   2HB   ASP   1           HB1      ASP   1  10.025   4.616   4.914
    7    H    ASP   2           HN       ASP   2  10.528   0.690   6.206
    8    HA   ASP   2           HA       ASP   2  12.987  -0.310   4.922
    9   1HB   ASP   2           HB2      ASP   2  11.371  -1.284   7.356
   10   2HB   ASP   2           HB1      ASP   2  13.023  -1.775   6.959
   11    H    GLY   3           HN       GLY   3  12.871  -1.810   3.298
   12   1HA   GLY   3           HA2      GLY   3  11.668  -4.301   3.424
   13   2HA   GLY   3           HA1      GLY   3  10.424  -3.272   2.724
   14    H    LEU   4           HN       LEU   4  11.369  -5.339   1.236
   15    HA   LEU   4           HA       LEU   4  12.982  -3.989  -0.893
   16   1HB   LEU   4           HB2      LEU   4  13.120  -6.915  -0.101
   17   2HB   LEU   4           HB1      LEU   4  14.185  -6.053  -1.206
   18    HG   LEU   4           HG       LEU   4  13.938  -5.201   1.681
   19   1HD1  LEU   4          HD12      LEU   4  14.649  -7.711   1.195
   20   2HD1  LEU   4          HD11      LEU   4  16.181  -6.953   0.763
   21   3HD1  LEU   4          HD13      LEU   4  15.517  -6.738   2.383
   22   1HD2  LEU   4          HD23      LEU   4  15.775  -4.700  -0.637
   23   2HD2  LEU   4          HD22      LEU   4  15.133  -3.558   0.547
   24   3HD2  LEU   4          HD21      LEU   4  16.445  -4.647   0.992
   25    H    CYS   5           HN       CYS   5  12.668  -5.561  -3.049
   26    HA   CYS   5           HA       CYS   5   9.768  -6.413  -3.083
   27   1HB   CYS   5           HB2      CYS   5  10.285  -4.081  -4.041
   28   2HB   CYS   5           HB1      CYS   5  11.091  -4.926  -5.361
   29    H    TYR   6           HN       TYR   6   9.331  -8.211  -4.222
   30    HA   TYR   6           HA       TYR   6  11.459  -9.417  -5.952
   31   1HB   TYR   6           HB2      TYR   6  11.203 -11.542  -4.776
   32   2HB   TYR   6           HB1      TYR   6  11.574 -10.290  -3.603
   33    HD1  TYR   6           HD1      TYR   6   8.896 -12.376  -5.041
   34    HD2  TYR   6           HD2      TYR   6  10.019  -9.701  -1.898
   35    HE1  TYR   6           HE1      TYR   6   6.841 -12.987  -3.803
   36    HE2  TYR   6           HE2      TYR   6   7.954 -10.295  -0.643
   37    HH   TYR   6           HH       TYR   6   6.292 -12.818  -0.955
   38    H    GLU   7           HN       GLU   7  10.417 -11.213  -7.349
   39    HA   GLU   7           HA       GLU   7   7.530 -10.516  -7.826
   40   1HB   GLU   7           HB2      GLU   7   8.038 -10.547 -10.143
   41   2HB   GLU   7           HB1      GLU   7   9.411  -9.726  -9.415
   42   1HG   GLU   7           HG2      GLU   7  10.499 -12.089  -9.391
   43   2HG   GLU   7           HG1      GLU   7   9.174 -12.493 -10.498
   44    H    GLY   8           HN       GLY   8   6.159 -12.184  -8.486
   45   1HA   GLY   8           HA2      GLY   8   6.563 -14.715  -9.288
   46   2HA   GLY   8           HA1      GLY   8   6.995 -14.874  -7.588
   47    H    THR   9           HN       THR   9   5.309 -15.589  -6.352
   48    HA   THR   9           HA       THR   9   2.558 -14.613  -6.854
   49    HB   THR   9           HB       THR   9   3.540 -17.449  -6.983
   50    HG1  THR   9           HG1      THR   9   3.288 -17.260  -9.104
   51   1HG2  THR   9          HG23      THR   9   0.784 -16.287  -6.844
   52   2HG2  THR   9          HG22      THR   9   1.044 -17.686  -7.884
   53   3HG2  THR   9          HG21      THR   9   1.401 -17.791  -6.160
   54    H    ASN  10           HN       ASN  10   4.735 -14.761  -4.509
   55    HA   ASN  10           HA       ASN  10   3.671 -16.656  -2.599
   56   1HB   ASN  10           HB2      ASN  10   5.984 -15.706  -2.798
   57   2HB   ASN  10           HB1      ASN  10   5.366 -14.224  -2.071
   58   1HD2  ASN  10          HD22      ASN  10   5.356 -15.621   1.233
   59   2HD2  ASN  10          HD21      ASN  10   5.076 -14.211   0.264
   60    H    CYS  11           HN       CYS  11   2.548 -13.612  -3.479
   61    HA   CYS  11           HA       CYS  11   0.879 -13.504  -0.992
   62   1HB   CYS  11           HB2      CYS  11   2.235 -11.354  -2.607
   63   2HB   CYS  11           HB1      CYS  11   0.842 -10.957  -1.591
   64    H    GLY  12           HN       GLY  12   0.539 -14.764  -3.657
   65   1HA   GLY  12           HA2      GLY  12  -1.408 -15.133  -4.946
   66   2HA   GLY  12           HA1      GLY  12  -2.204 -13.923  -3.930
   67    H    LYS  13           HN       LYS  13   0.738 -12.842  -5.221
   68    HA   LYS  13           HA       LYS  13  -0.632 -10.908  -6.901
   69   1HB   LYS  13           HB2      LYS  13   1.434  -9.776  -6.802
   70   2HB   LYS  13           HB1      LYS  13   1.215 -10.572  -5.255
   71   1HG   LYS  13           HG2      LYS  13   2.558 -12.523  -6.252
   72   2HG   LYS  13           HG1      LYS  13   3.017 -11.392  -7.514
   73   1HD   LYS  13           HD2      LYS  13   4.458 -10.318  -6.166
   74   2HD   LYS  13           HD1      LYS  13   3.301 -10.284  -4.839
   75   1HE   LYS  13           HE2      LYS  13   4.802 -11.756  -3.883
   76   2HE   LYS  13           HE1      LYS  13   3.930 -12.939  -4.877
   77   1HZ   LYS  13           HZ1      LYS  13   5.497 -12.101  -6.724
   78   2HZ   LYS  13           HZ3      LYS  13   6.475 -11.566  -5.449
   79   3HZ   LYS  13           HZ2      LYS  13   6.094 -13.216  -5.594
   80    H    VAL  14           HN       VAL  14  -1.142 -13.163  -8.055
   81    HA   VAL  14           HA       VAL  14   0.787 -14.190  -9.952
   82    HB   VAL  14           HB       VAL  14  -2.234 -14.168  -9.717
   83   1HG1  VAL  14          HG12      VAL  14  -1.669 -14.293 -12.121
   84   2HG1  VAL  14          HG11      VAL  14  -0.573 -15.636 -11.793
   85   3HG1  VAL  14          HG13      VAL  14  -2.308 -15.832 -11.543
   86   1HG2  VAL  14          HG22      VAL  14  -0.604 -15.556  -8.205
   87   2HG2  VAL  14          HG21      VAL  14  -2.019 -16.352  -8.891
   88   3HG2  VAL  14          HG23      VAL  14  -0.435 -16.583  -9.630
   89    H    GLY  15           HN       GLY  15   1.746 -12.713 -11.376
   90   1HA   GLY  15           HA2      GLY  15   1.495 -11.529 -13.521
   91   2HA   GLY  15           HA1      GLY  15  -0.150 -11.094 -13.049
   92    H    LYS  16           HN       LYS  16   1.075 -10.403 -10.235
   93    HA   LYS  16           HA       LYS  16   2.124  -7.720 -11.071
   94   1HB   LYS  16           HB2      LYS  16   0.548  -8.450  -8.610
   95   2HB   LYS  16           HB1      LYS  16   1.017  -6.838  -9.133
   96   1HG   LYS  16           HG2      LYS  16  -0.321  -7.110 -11.196
   97   2HG   LYS  16           HG1      LYS  16  -0.851  -8.694 -10.630
   98   1HD   LYS  16           HD2      LYS  16  -1.221  -6.364  -8.790
   99   2HD   LYS  16           HD1      LYS  16  -2.305  -6.503 -10.177
  100   1HE   LYS  16           HE2      LYS  16  -3.135  -8.614  -9.462
  101   2HE   LYS  16           HE1      LYS  16  -1.796  -8.844  -8.321
  102   1HZ   LYS  16           HZ2      LYS  16  -3.092  -6.369  -7.832
  103   2HZ   LYS  16           HZ1      LYS  16  -4.235  -7.625  -7.807
  104   3HZ   LYS  16           HZ3      LYS  16  -2.886  -7.689  -6.783
  105    H    TYR  17           HN       TYR  17   2.780  -7.221  -8.039
  106    HA   TYR  17           HA       TYR  17   4.956  -9.237  -7.700
  107   1HB   TYR  17           HB2      TYR  17   5.515  -6.260  -7.713
  108   2HB   TYR  17           HB1      TYR  17   6.649  -7.621  -7.736
  109    HD1  TYR  17           HD1      TYR  17   4.155  -5.785  -9.823
  110    HD2  TYR  17           HD2      TYR  17   7.199  -8.777  -9.664
  111    HE1  TYR  17           HE1      TYR  17   4.195  -5.890 -12.304
  112    HE2  TYR  17           HE2      TYR  17   7.262  -8.887 -12.114
  113    HH   TYR  17           HH       TYR  17   5.941  -6.566 -14.084
  114    H    CYS  18           HN       CYS  18   6.223  -8.595  -5.432
  115    HA   CYS  18           HA       CYS  18   4.206  -7.439  -3.527
  116   1HB   CYS  18           HB2      CYS  18   5.675 -10.094  -3.465
  117   2HB   CYS  18           HB1      CYS  18   4.974  -9.386  -2.011
  118    H    CYS  19           HN       CYS  19   5.189  -6.768  -1.481
  119    HA   CYS  19           HA       CYS  19   8.125  -6.417  -1.529
  120   1HB   CYS  19           HB2      CYS  19   7.555  -4.019  -0.667
  121   2HB   CYS  19           HB1      CYS  19   7.360  -4.367  -2.386
  122    H    SER  20           HN       SER  20   8.766  -7.523   0.290
  123    HA   SER  20           HA       SER  20   7.939  -6.645   2.922
  124   1HB   SER  20           HB2      SER  20   6.990  -9.055   3.446
  125   2HB   SER  20           HB1      SER  20   5.953  -7.892   2.613
  126    HG   SER  20           HG       SER  20   6.573 -10.248   1.774
  127    HA   PRO  21           HA       PRO  21  11.875  -8.630   3.390
  128   1HB   PRO  21           HB2      PRO  21  12.260  -8.192   6.068
  129   2HB   PRO  21           HB1      PRO  21  12.439  -6.917   4.843
  130   1HG   PRO  21           HG2      PRO  21  10.194  -7.382   6.747
  131   2HG   PRO  21           HG1      PRO  21  10.816  -5.868   6.059
  132   1HD   PRO  21           HD2      PRO  21   8.528  -7.273   5.236
  133   2HD   PRO  21           HD1      PRO  21   9.338  -5.971   4.332
  134    H    ILE  22           HN       ILE  22   8.980  -9.634   4.638
  135    HA   ILE  22           HA       ILE  22   9.829 -12.406   4.999
  136    HB   ILE  22           HB       ILE  22  10.459 -10.990   7.097
  137   1HG1  ILE  22          HG12      ILE  22   8.675 -13.429   7.491
  138   2HG1  ILE  22          HG11      ILE  22  10.410 -13.479   7.177
  139   1HG2  ILE  22          HG23      ILE  22   7.864 -10.178   6.875
  140   2HG2  ILE  22          HG22      ILE  22   7.759 -11.395   8.145
  141   3HG2  ILE  22          HG21      ILE  22   8.851 -10.023   8.327
  142   1HD1  ILE  22          HD12      ILE  22  10.336 -11.776   9.305
  143   2HD1  ILE  22          HD11      ILE  22   8.960 -12.817   9.671
  144   3HD1  ILE  22          HD13      ILE  22  10.563 -13.520   9.450
  145    H    GLY  23           HN       GLY  23   7.653 -13.461   6.197
  146   1HA   GLY  23           HA2      GLY  23   5.531 -12.847   4.243
  147   2HA   GLY  23           HA1      GLY  23   5.528 -14.192   5.373
  148    H    LYS  24           HN       LYS  24   6.230 -11.403   7.074
  149    HA   LYS  24           HA       LYS  24   3.509 -11.410   8.158
  150   1HB   LYS  24           HB2      LYS  24   4.419 -10.263  10.011
  151   2HB   LYS  24           HB1      LYS  24   5.652 -11.412   9.508
  152   1HG   LYS  24           HG2      LYS  24   6.591  -9.467   8.086
  153   2HG   LYS  24           HG1      LYS  24   5.566  -8.442   9.083
  154   1HD   LYS  24           HD2      LYS  24   7.292 -10.416  10.494
  155   2HD   LYS  24           HD1      LYS  24   8.073  -8.990   9.810
  156   1HE   LYS  24           HE2      LYS  24   5.795  -7.950  11.044
  157   2HE   LYS  24           HE1      LYS  24   6.371  -9.191  12.177
  158   1HZ   LYS  24           HZ3      LYS  24   8.629  -8.283  11.894
  159   2HZ   LYS  24           HZ2      LYS  24   7.993  -7.026  10.946
  160   3HZ   LYS  24           HZ1      LYS  24   7.564  -7.159  12.583
  161    H    TYR  25           HN       TYR  25   5.517  -9.336   6.177
  162    HA   TYR  25           HA       TYR  25   3.616  -7.068   6.238
  163   1HB   TYR  25           HB2      TYR  25   6.225  -7.707   4.868
  164   2HB   TYR  25           HB1      TYR  25   5.282  -6.304   4.393
  165    HD1  TYR  25           HD2      TYR  25   5.320  -7.402   7.938
  166    HD2  TYR  25           HD1      TYR  25   7.016  -4.793   5.000
  167    HE1  TYR  25           HE2      TYR  25   6.335  -6.042   9.750
  168    HE2  TYR  25           HE1      TYR  25   8.047  -3.419   6.810
  169    HH   TYR  25           HH       TYR  25   7.120  -3.400   9.833
  170    H    CYS  26           HN       CYS  26   4.955  -9.192   3.690
  171    HA   CYS  26           HA       CYS  26   4.094  -9.611   1.488
  172   1HB   CYS  26           HB2      CYS  26   3.133 -11.368   2.899
  173   2HB   CYS  26           HB1      CYS  26   1.846 -10.286   3.449
  174    H    VAL  27           HN       VAL  27   4.026  -7.083   1.065
  175    HA   VAL  27           HA       VAL  27   1.147  -6.216   0.782
  176    HB   VAL  27           HB       VAL  27   3.724  -4.609   0.922
  177   1HG1  VAL  27          HG13      VAL  27   1.288  -3.921  -0.194
  178   2HG1  VAL  27          HG12      VAL  27   1.154  -3.291   1.448
  179   3HG1  VAL  27          HG11      VAL  27   2.488  -2.778   0.414
  180   1HG2  VAL  27          HG21      VAL  27   1.539  -5.118   2.967
  181   2HG2  VAL  27          HG23      VAL  27   3.218  -5.643   3.076
  182   3HG2  VAL  27          HG22      VAL  27   2.824  -3.926   3.160
  183    H    CYS  28           HN       CYS  28   0.565  -6.682  -1.322
  184    HA   CYS  28           HA       CYS  28   2.643  -6.281  -3.447
  185   1HB   CYS  28           HB2      CYS  28   0.158  -7.999  -3.469
  186   2HB   CYS  28           HB1      CYS  28   1.536  -8.119  -4.559
  187    H    TYR  29           HN       TYR  29   1.925  -5.629  -5.548
  188    HA   TYR  29           HA       TYR  29  -0.670  -4.215  -5.752
  189   1HB   TYR  29           HB2      TYR  29   2.052  -3.013  -6.164
  190   2HB   TYR  29           HB1      TYR  29   0.523  -2.232  -6.511
  191    HD1  TYR  29           HD1      TYR  29   2.634  -3.631  -3.865
  192    HD2  TYR  29           HD2      TYR  29  -0.744  -1.204  -4.829
  193    HE1  TYR  29           HE1      TYR  29   2.593  -2.785  -1.546
  194    HE2  TYR  29           HE2      TYR  29  -0.814  -0.348  -2.511
  195    HH   TYR  29           HH       TYR  29   0.682  -0.099  -0.592
  196    H    ASP  30           HN       ASP  30  -0.711  -3.253  -8.146
  197    HA   ASP  30           HA       ASP  30   0.092  -5.390  -9.953
  198   1HB   ASP  30           HB2      ASP  30  -1.321  -4.333 -11.478
  199   2HB   ASP  30           HB1      ASP  30  -2.080  -4.077  -9.910
  200    H    SER  31           HN       SER  31   0.991  -1.975  -9.507
  201    HA   SER  31           HA       SER  31   2.942  -2.102 -11.729
  202   1HB   SER  31           HB2      SER  31   2.753   0.016  -9.645
  203   2HB   SER  31           HB1      SER  31   3.228   0.178 -11.329
  204    HG   SER  31           HG       SER  31   1.211   0.703 -11.583
  205    H    LYS  32           HN       LYS  32   4.952  -3.235 -11.350
  206    HA   LYS  32           HA       LYS  32   5.846  -4.047  -8.787
  207   1HB   LYS  32           HB2      LYS  32   7.924  -4.556  -9.919
  208   2HB   LYS  32           HB1      LYS  32   6.712  -4.608 -11.203
  209   1HG   LYS  32           HG2      LYS  32   7.394  -2.539 -12.106
  210   2HG   LYS  32           HG1      LYS  32   8.241  -2.071 -10.631
  211   1HD   LYS  32           HD2      LYS  32   9.933  -2.745 -12.243
  212   2HD   LYS  32           HD1      LYS  32   9.816  -4.037 -11.038
  213   1HE   LYS  32           HE2      LYS  32   7.901  -4.871 -12.816
  214   2HE   LYS  32           HE1      LYS  32   9.064  -4.109 -13.923
  215   1HZ   LYS  32           HZ2      LYS  32   9.905  -5.918 -11.727
  216   2HZ   LYS  32           HZ1      LYS  32   9.540  -6.495 -13.282
  217   3HZ   LYS  32           HZ3      LYS  32  10.816  -5.399 -13.064
  218    H    ALA  33           HN       ALA  33   6.185  -0.972 -10.518
  219    HA   ALA  33           HA       ALA  33   7.949   0.406  -8.797
  220   1HB   ALA  33           HB1      ALA  33   7.048   1.108 -11.065
  221   2HB   ALA  33           HB3      ALA  33   5.491   1.408 -10.290
  222   3HB   ALA  33           HB2      ALA  33   6.900   2.372  -9.842
  223    H    ILE  34           HN       ILE  34   4.313   0.030  -8.697
  224    HA   ILE  34           HA       ILE  34   3.935   1.630  -6.425
  225    HB   ILE  34           HB       ILE  34   2.607  -0.664  -7.722
  226   1HG1  ILE  34          HG12      ILE  34   2.178   2.308  -7.451
  227   2HG1  ILE  34          HG11      ILE  34   2.329   1.350  -8.918
  228   1HG2  ILE  34          HG23      ILE  34   2.188  -0.682  -5.192
  229   2HG2  ILE  34          HG22      ILE  34   1.457   0.907  -5.389
  230   3HG2  ILE  34          HG21      ILE  34   0.741  -0.493  -6.179
  231   1HD1  ILE  34          HD11      ILE  34   0.194   0.148  -8.064
  232   2HD1  ILE  34          HD13      ILE  34   0.011   1.563  -7.030
  233   3HD1  ILE  34          HD12      ILE  34   0.022   1.750  -8.785
  234    H    CYS  35           HN       CYS  35   5.204  -1.489  -6.827
  235    HA   CYS  35           HA       CYS  35   4.969  -2.505  -4.129
  236   1HB   CYS  35           HB2      CYS  35   5.709  -3.953  -5.985
  237   2HB   CYS  35           HB1      CYS  35   7.125  -2.919  -6.256
  238    H    ASN  36           HN       ASN  36   7.946  -1.184  -5.677
  239    HA   ASN  36           HA       ASN  36   9.284  -0.500  -3.239
  240   1HB   ASN  36           HB2      ASN  36   9.285   0.711  -6.039
  241   2HB   ASN  36           HB1      ASN  36  10.427   1.205  -4.783
  242   1HD2  ASN  36          HD22      ASN  36  12.553  -1.496  -5.534
  243   2HD2  ASN  36          HD21      ASN  36  12.391   0.117  -5.034
  244    H    LYS  37           HN       LYS  37   7.339   1.654  -5.291
  245    HA   LYS  37           HA       LYS  37   7.424   3.977  -3.714
  246   1HB   LYS  37           HB2      LYS  37   6.785   3.566  -6.133
  247   2HB   LYS  37           HB1      LYS  37   5.199   3.088  -5.533
  248   1HG   LYS  37           HG2      LYS  37   6.441   5.742  -4.788
  249   2HG   LYS  37           HG1      LYS  37   5.488   5.550  -6.258
  250   1HD   LYS  37           HD2      LYS  37   3.820   4.383  -4.466
  251   2HD   LYS  37           HD1      LYS  37   4.608   5.566  -3.423
  252   1HE   LYS  37           HE2      LYS  37   3.226   6.188  -6.068
  253   2HE   LYS  37           HE1      LYS  37   2.601   6.571  -4.451
  254   1HZ   LYS  37           HZ1      LYS  37   4.776   7.737  -4.062
  255   2HZ   LYS  37           HZ3      LYS  37   5.080   7.588  -5.724
  256   3HZ   LYS  37           HZ2      LYS  37   3.744   8.489  -5.182
  257    H    ASN  38           HN       ASN  38   4.269   2.419  -4.242
  258    HA   ASN  38           HA       ASN  38   3.033   3.524  -2.023
  259   1HB   ASN  38           HB2      ASN  38   2.603   1.337  -3.931
  260   2HB   ASN  38           HB1      ASN  38   1.420   1.633  -2.653
  261   1HD2  ASN  38          HD22      ASN  38   1.633   4.078  -5.865
  262   2HD2  ASN  38          HD21      ASN  38   2.640   2.719  -5.690
  263    H    CYS  39           HN       CYS  39   4.743   0.517  -2.363
  264    HA   CYS  39           HA       CYS  39   3.715  -0.959  -0.194
  265   1HB   CYS  39           HB2      CYS  39   6.549  -0.604  -1.148
  266   2HB   CYS  39           HB1      CYS  39   6.092  -1.826   0.042
  267    H    THR  40           HN       THR  40   5.775   1.885  -0.032
  268    HA   THR  40           HA       THR  40   6.439   1.571   2.797
  269    HB   THR  40           HB       THR  40   7.153   4.030   2.412
  270    HG1  THR  40           HG1      THR  40   5.686   4.315   0.653
  271   1HG2  THR  40          HG23      THR  40   8.422   1.656   1.832
  272   2HG2  THR  40          HG22      THR  40   8.477   2.462   0.265
  273   3HG2  THR  40          HG21      THR  40   9.180   3.243   1.681
   
  No H/Q in entry =         273
  Start of MODEL   17
    1   1H    ASP   1           HT3      ASP   1  11.586   4.419   6.529
    2   2H    ASP   1           HT2      ASP   1   9.998   5.018   6.442
    3   3H    ASP   1           HT1      ASP   1  10.638   4.512   7.934
    4    HA   ASP   1           HA       ASP   1  10.601   2.244   7.314
    5   1HB   ASP   1           HB2      ASP   1   8.470   3.575   7.888
    6   2HB   ASP   1           HB1      ASP   1   8.096   3.493   6.166
    7    H    ASP   2           HN       ASP   2  11.151   0.823   5.705
    8    HA   ASP   2           HA       ASP   2  10.381   1.345   2.886
    9   1HB   ASP   2           HB2      ASP   2  13.193   1.463   4.063
   10   2HB   ASP   2           HB1      ASP   2  12.949   1.067   2.356
   11    H    GLY   3           HN       GLY   3  12.277  -0.560   1.814
   12   1HA   GLY   3           HA2      GLY   3  12.628  -2.956   3.162
   13   2HA   GLY   3           HA1      GLY   3  10.972  -3.040   2.576
   14    H    LEU   4           HN       LEU   4  11.573  -4.797   1.187
   15    HA   LEU   4           HA       LEU   4  13.071  -3.950  -1.264
   16   1HB   LEU   4           HB2      LEU   4  13.103  -6.709  -0.002
   17   2HB   LEU   4           HB1      LEU   4  14.150  -6.093  -1.277
   18    HG   LEU   4           HG       LEU   4  14.105  -4.794   1.449
   19   1HD1  LEU   4          HD11      LEU   4  15.237  -7.401   0.656
   20   2HD1  LEU   4          HD13      LEU   4  16.376  -6.315   1.454
   21   3HD1  LEU   4          HD12      LEU   4  14.875  -6.768   2.263
   22   1HD2  LEU   4          HD23      LEU   4  15.742  -4.683  -1.035
   23   2HD2  LEU   4          HD22      LEU   4  15.377  -3.406   0.129
   24   3HD2  LEU   4          HD21      LEU   4  16.628  -4.595   0.487
   25    H    CYS   5           HN       CYS   5  12.542  -5.838  -3.070
   26    HA   CYS   5           HA       CYS   5   9.659  -6.650  -2.784
   27   1HB   CYS   5           HB2      CYS   5   9.926  -4.404  -3.962
   28   2HB   CYS   5           HB1      CYS   5  10.758  -5.268  -5.252
   29    H    TYR   6           HN       TYR   6   9.067  -8.423  -4.037
   30    HA   TYR   6           HA       TYR   6  11.237  -9.791  -5.586
   31   1HB   TYR   6           HB2      TYR   6  10.844 -11.843  -4.375
   32   2HB   TYR   6           HB1      TYR   6  11.060 -10.576  -3.180
   33    HD1  TYR   6           HD1      TYR   6   8.596 -12.702  -4.916
   34    HD2  TYR   6           HD2      TYR   6   9.286  -9.963  -1.701
   35    HE1  TYR   6           HE1      TYR   6   6.399 -13.308  -3.942
   36    HE2  TYR   6           HE2      TYR   6   7.081 -10.555  -0.715
   37    HH   TYR   6           HH       TYR   6   5.528 -12.885  -0.975
   38    H    GLU   7           HN       GLU   7  10.239 -11.528  -7.041
   39    HA   GLU   7           HA       GLU   7   7.418 -10.747  -7.743
   40   1HB   GLU   7           HB2      GLU   7   8.101 -10.833 -10.014
   41   2HB   GLU   7           HB1      GLU   7   9.442 -10.045  -9.197
   42   1HG   GLU   7           HG2      GLU   7  10.444 -12.442  -9.055
   43   2HG   GLU   7           HG1      GLU   7   9.194 -12.820 -10.255
   44    H    GLY   8           HN       GLY   8   6.057 -12.392  -8.442
   45   1HA   GLY   8           HA2      GLY   8   6.407 -14.946  -9.179
   46   2HA   GLY   8           HA1      GLY   8   6.757 -15.088  -7.458
   47    H    THR   9           HN       THR   9   4.994 -15.786  -6.331
   48    HA   THR   9           HA       THR   9   2.316 -14.662  -6.892
   49    HB   THR   9           HB       THR   9   3.163 -17.537  -7.101
   50    HG1  THR   9           HG1      THR   9   3.040 -17.238  -9.200
   51   1HG2  THR   9          HG23      THR   9   0.472 -16.269  -6.892
   52   2HG2  THR   9          HG22      THR   9   0.652 -17.571  -8.066
   53   3HG2  THR   9          HG21      THR   9   1.007 -17.865  -6.365
   54    H    ASN  10           HN       ASN  10   4.378 -14.942  -4.494
   55    HA   ASN  10           HA       ASN  10   3.220 -16.859  -2.664
   56   1HB   ASN  10           HB2      ASN  10   5.548 -15.982  -2.739
   57   2HB   ASN  10           HB1      ASN  10   4.951 -14.459  -2.079
   58   1HD2  ASN  10          HD22      ASN  10   4.760 -15.755   1.259
   59   2HD2  ASN  10          HD21      ASN  10   4.572 -14.367   0.238
   60    H    CYS  11           HN       CYS  11   2.091 -13.852  -3.560
   61    HA   CYS  11           HA       CYS  11   0.373 -13.738  -1.109
   62   1HB   CYS  11           HB2      CYS  11   1.811 -11.587  -2.652
   63   2HB   CYS  11           HB1      CYS  11   0.400 -11.182  -1.665
   64    H    GLY  12           HN       GLY  12   0.072 -14.954  -3.805
   65   1HA   GLY  12           HA2      GLY  12  -1.838 -15.229  -5.184
   66   2HA   GLY  12           HA1      GLY  12  -2.639 -14.031  -4.156
   67    H    LYS  13           HN       LYS  13   0.366 -13.020  -5.279
   68    HA   LYS  13           HA       LYS  13  -0.798 -10.930  -6.911
   69   1HB   LYS  13           HB2      LYS  13   1.449 -10.044  -6.755
   70   2HB   LYS  13           HB1      LYS  13   0.895 -10.650  -5.206
   71   1HG   LYS  13           HG2      LYS  13   2.228 -12.619  -5.348
   72   2HG   LYS  13           HG1      LYS  13   2.519 -12.364  -7.065
   73   1HD   LYS  13           HD2      LYS  13   3.430 -10.048  -5.823
   74   2HD   LYS  13           HD1      LYS  13   3.951 -11.357  -4.773
   75   1HE   LYS  13           HE2      LYS  13   5.591 -10.763  -6.639
   76   2HE   LYS  13           HE1      LYS  13   5.097 -12.466  -6.597
   77   1HZ   LYS  13           HZ3      LYS  13   3.336 -10.692  -8.079
   78   2HZ   LYS  13           HZ2      LYS  13   4.871 -10.915  -8.769
   79   3HZ   LYS  13           HZ1      LYS  13   3.874 -12.255  -8.462
   80    H    VAL  14           HN       VAL  14  -1.275 -13.207  -8.182
   81    HA   VAL  14           HA       VAL  14   0.738 -14.049 -10.089
   82    HB   VAL  14           HB       VAL  14  -2.286 -14.177  -9.926
   83   1HG1  VAL  14          HG13      VAL  14  -1.624 -14.203 -12.315
   84   2HG1  VAL  14          HG12      VAL  14  -0.499 -15.522 -11.982
   85   3HG1  VAL  14          HG11      VAL  14  -2.234 -15.776 -11.802
   86   1HG2  VAL  14          HG21      VAL  14  -0.450 -15.564  -8.503
   87   2HG2  VAL  14          HG23      VAL  14  -2.007 -16.244  -8.974
   88   3HG2  VAL  14          HG22      VAL  14  -0.566 -16.605  -9.922
   89    H    GLY  15           HN       GLY  15   1.617 -12.546 -11.534
   90   1HA   GLY  15           HA2      GLY  15   1.226 -11.309 -13.634
   91   2HA   GLY  15           HA1      GLY  15  -0.369 -10.858 -13.028
   92    H    LYS  16           HN       LYS  16   0.999 -10.221 -10.282
   93    HA   LYS  16           HA       LYS  16   2.190  -7.611 -11.180
   94   1HB   LYS  16           HB2      LYS  16   0.527  -8.164  -8.729
   95   2HB   LYS  16           HB1      LYS  16   1.113  -6.599  -9.286
   96   1HG   LYS  16           HG2      LYS  16  -0.206  -6.833 -11.359
   97   2HG   LYS  16           HG1      LYS  16  -0.843  -8.370 -10.773
   98   1HD   LYS  16           HD2      LYS  16  -1.102  -5.931  -9.038
   99   2HD   LYS  16           HD1      LYS  16  -2.212  -6.145 -10.393
  100   1HE   LYS  16           HE2      LYS  16  -3.420  -7.613  -9.166
  101   2HE   LYS  16           HE1      LYS  16  -1.992  -8.655  -9.001
  102   1HZ   LYS  16           HZ1      LYS  16  -1.202  -7.110  -7.247
  103   2HZ   LYS  16           HZ3      LYS  16  -2.692  -6.306  -7.322
  104   3HZ   LYS  16           HZ2      LYS  16  -2.629  -7.929  -6.828
  105    H    TYR  17           HN       TYR  17   2.782  -7.134  -8.105
  106    HA   TYR  17           HA       TYR  17   4.852  -9.249  -7.729
  107   1HB   TYR  17           HB2      TYR  17   5.527  -6.303  -7.692
  108   2HB   TYR  17           HB1      TYR  17   6.609  -7.704  -7.642
  109    HD1  TYR  17           HD1      TYR  17   4.303  -5.807  -9.887
  110    HD2  TYR  17           HD2      TYR  17   7.235  -8.893  -9.519
  111    HE1  TYR  17           HE1      TYR  17   4.485  -5.941 -12.361
  112    HE2  TYR  17           HE2      TYR  17   7.436  -9.036 -11.960
  113    HH   TYR  17           HH       TYR  17   5.622  -8.365 -13.992
  114    H    CYS  18           HN       CYS  18   6.017  -8.759  -5.391
  115    HA   CYS  18           HA       CYS  18   3.977  -7.508  -3.577
  116   1HB   CYS  18           HB2      CYS  18   5.267 -10.258  -3.475
  117   2HB   CYS  18           HB1      CYS  18   4.415  -9.553  -2.101
  118    H    CYS  19           HN       CYS  19   4.893  -7.012  -1.421
  119    HA   CYS  19           HA       CYS  19   7.849  -6.797  -1.390
  120   1HB   CYS  19           HB2      CYS  19   7.339  -4.451  -0.352
  121   2HB   CYS  19           HB1      CYS  19   7.164  -4.666  -2.096
  122    H    SER  20           HN       SER  20   8.663  -7.654   0.466
  123    HA   SER  20           HA       SER  20   7.487  -7.168   3.089
  124   1HB   SER  20           HB2      SER  20   7.102  -9.688   3.482
  125   2HB   SER  20           HB1      SER  20   5.969  -8.925   2.366
  126    HG   SER  20           HG       SER  20   8.343 -10.295   1.621
  127    HA   PRO  21           HA       PRO  21  11.852  -7.940   3.468
  128   1HB   PRO  21           HB2      PRO  21  12.175  -7.090   6.052
  129   2HB   PRO  21           HB1      PRO  21  12.018  -5.984   4.670
  130   1HG   PRO  21           HG2      PRO  21   9.992  -6.702   6.733
  131   2HG   PRO  21           HG1      PRO  21  10.206  -5.198   5.815
  132   1HD   PRO  21           HD2      PRO  21   8.325  -7.230   5.316
  133   2HD   PRO  21           HD1      PRO  21   8.749  -5.898   4.214
  134    H    ILE  22           HN       ILE  22   9.385  -9.618   4.869
  135    HA   ILE  22           HA       ILE  22  11.106 -11.860   5.558
  136    HB   ILE  22           HB       ILE  22  11.191 -10.205   7.494
  137   1HG1  ILE  22          HG12      ILE  22  10.044 -12.977   8.034
  138   2HG1  ILE  22          HG11      ILE  22  11.754 -12.545   7.974
  139   1HG2  ILE  22          HG21      ILE  22   8.463 -10.161   7.025
  140   2HG2  ILE  22          HG23      ILE  22   8.612 -11.055   8.536
  141   3HG2  ILE  22          HG22      ILE  22   9.293  -9.435   8.401
  142   1HD1  ILE  22          HD11      ILE  22  11.003 -10.805   9.858
  143   2HD1  ILE  22          HD13      ILE  22   9.733 -12.004  10.112
  144   3HD1  ILE  22          HD12      ILE  22  11.428 -12.470  10.260
  145    H    GLY  23           HN       GLY  23   8.502 -10.860   4.244
  146   1HA   GLY  23           HA2      GLY  23   6.612 -12.032   3.367
  147   2HA   GLY  23           HA1      GLY  23   7.154 -13.420   4.298
  148    H    LYS  24           HN       LYS  24   6.966 -10.655   6.207
  149    HA   LYS  24           HA       LYS  24   4.623 -11.733   7.588
  150   1HB   LYS  24           HB2      LYS  24   5.225 -10.231   9.344
  151   2HB   LYS  24           HB1      LYS  24   6.709 -10.935   8.713
  152   1HG   LYS  24           HG2      LYS  24   7.002  -8.900   7.272
  153   2HG   LYS  24           HG1      LYS  24   5.584  -8.198   8.049
  154   1HD   LYS  24           HD2      LYS  24   7.854  -9.223   9.729
  155   2HD   LYS  24           HD1      LYS  24   7.960  -7.626   8.987
  156   1HE   LYS  24           HE2      LYS  24   6.427  -6.736  10.427
  157   2HE   LYS  24           HE1      LYS  24   5.379  -8.165  10.327
  158   1HZ   LYS  24           HZ3      LYS  24   7.088  -9.370  11.643
  159   2HZ   LYS  24           HZ2      LYS  24   7.898  -7.895  11.879
  160   3HZ   LYS  24           HZ1      LYS  24   6.333  -8.118  12.502
  161    H    TYR  25           HN       TYR  25   5.453  -8.853   5.711
  162    HA   TYR  25           HA       TYR  25   2.860  -7.584   6.228
  163   1HB   TYR  25           HB2      TYR  25   5.325  -6.960   4.618
  164   2HB   TYR  25           HB1      TYR  25   3.866  -5.978   4.464
  165    HD1  TYR  25           HD2      TYR  25   2.887  -4.901   6.548
  166    HD2  TYR  25           HD1      TYR  25   6.781  -6.702   6.464
  167    HE1  TYR  25           HE2      TYR  25   3.492  -3.674   8.623
  168    HE2  TYR  25           HE1      TYR  25   7.399  -5.466   8.544
  169    HH   TYR  25           HH       TYR  25   5.693  -2.874   9.701
  170    H    CYS  26           HN       CYS  26   4.451  -9.226   3.483
  171    HA   CYS  26           HA       CYS  26   3.560  -9.865   1.357
  172   1HB   CYS  26           HB2      CYS  26   2.603 -11.547   2.877
  173   2HB   CYS  26           HB1      CYS  26   1.305 -10.442   3.345
  174    H    VAL  27           HN       VAL  27   3.508  -7.304   1.014
  175    HA   VAL  27           HA       VAL  27   0.653  -6.450   0.549
  176    HB   VAL  27           HB       VAL  27   3.210  -4.847   0.919
  177   1HG1  VAL  27          HG12      VAL  27   0.933  -4.094  -0.407
  178   2HG1  VAL  27          HG11      VAL  27   0.571  -3.569   1.237
  179   3HG1  VAL  27          HG13      VAL  27   2.018  -2.977   0.421
  180   1HG2  VAL  27          HG21      VAL  27   0.853  -5.337   2.771
  181   2HG2  VAL  27          HG23      VAL  27   2.488  -5.961   2.990
  182   3HG2  VAL  27          HG22      VAL  27   2.185  -4.227   3.097
  183    H    CYS  28           HN       CYS  28   0.170  -6.694  -1.624
  184    HA   CYS  28           HA       CYS  28   2.429  -6.349  -3.564
  185   1HB   CYS  28           HB2      CYS  28  -0.158  -7.882  -3.866
  186   2HB   CYS  28           HB1      CYS  28   1.278  -8.025  -4.877
  187    H    TYR  29           HN       TYR  29   1.905  -5.543  -5.675
  188    HA   TYR  29           HA       TYR  29  -0.546  -3.899  -5.950
  189   1HB   TYR  29           HB2      TYR  29   2.298  -2.958  -6.166
  190   2HB   TYR  29           HB1      TYR  29   0.887  -2.028  -6.619
  191    HD1  TYR  29           HD1      TYR  29   2.584  -3.689  -3.821
  192    HD2  TYR  29           HD2      TYR  29  -0.360  -0.848  -5.040
  193    HE1  TYR  29           HE1      TYR  29   2.432  -2.867  -1.498
  194    HE2  TYR  29           HE2      TYR  29  -0.537  -0.007  -2.724
  195    HH   TYR  29           HH       TYR  29   1.328  -0.101  -0.584
  196    H    ASP  30           HN       ASP  30  -0.424  -2.908  -8.320
  197    HA   ASP  30           HA       ASP  30   0.299  -5.073 -10.131
  198   1HB   ASP  30           HB2      ASP  30  -0.968  -3.888 -11.695
  199   2HB   ASP  30           HB1      ASP  30  -1.773  -3.603 -10.154
  200    H    SER  31           HN       SER  31   1.426  -1.739  -9.585
  201    HA   SER  31           HA       SER  31   3.458  -1.970 -11.724
  202   1HB   SER  31           HB2      SER  31   3.354   0.100  -9.588
  203   2HB   SER  31           HB1      SER  31   3.911   0.266 -11.246
  204    HG   SER  31           HG       SER  31   1.949   1.016 -11.489
  205    H    LYS  32           HN       LYS  32   5.352  -3.267 -11.297
  206    HA   LYS  32           HA       LYS  32   6.057  -4.245  -8.741
  207   1HB   LYS  32           HB2      LYS  32   8.150  -4.857  -9.793
  208   2HB   LYS  32           HB1      LYS  32   7.003  -4.761 -11.135
  209   1HG   LYS  32           HG2      LYS  32   7.863  -2.683 -11.877
  210   2HG   LYS  32           HG1      LYS  32   8.703  -2.390 -10.354
  211   1HD   LYS  32           HD2      LYS  32  10.441  -3.104 -11.819
  212   2HD   LYS  32           HD1      LYS  32  10.028  -4.574 -10.922
  213   1HE   LYS  32           HE2      LYS  32   8.760  -5.467 -12.764
  214   2HE   LYS  32           HE1      LYS  32   8.698  -3.890 -13.579
  215   1HZ   LYS  32           HZ1      LYS  32  11.222  -5.327 -12.953
  216   2HZ   LYS  32           HZ3      LYS  32  10.445  -5.408 -14.459
  217   3HZ   LYS  32           HZ2      LYS  32  11.046  -3.923 -13.894
  218    H    ALA  33           HN       ALA  33   6.751  -1.135 -10.294
  219    HA   ALA  33           HA       ALA  33   8.504  -0.007  -8.384
  220   1HB   ALA  33           HB2      ALA  33   7.814   0.841 -10.695
  221   2HB   ALA  33           HB1      ALA  33   6.278   1.327  -9.972
  222   3HB   ALA  33           HB3      ALA  33   7.784   2.078  -9.435
  223    H    ILE  34           HN       ILE  34   4.851  -0.010  -8.570
  224    HA   ILE  34           HA       ILE  34   4.458   1.545  -6.269
  225    HB   ILE  34           HB       ILE  34   3.013  -0.557  -7.755
  226   1HG1  ILE  34          HG12      ILE  34   2.867   2.435  -7.412
  227   2HG1  ILE  34          HG11      ILE  34   3.037   1.508  -8.897
  228   1HG2  ILE  34          HG22      ILE  34   2.400  -0.576  -5.254
  229   2HG2  ILE  34          HG21      ILE  34   1.810   1.064  -5.490
  230   3HG2  ILE  34          HG23      ILE  34   1.064  -0.271  -6.360
  231   1HD1  ILE  34          HD13      ILE  34   0.741   0.517  -8.326
  232   2HD1  ILE  34          HD12      ILE  34   0.607   1.830  -7.157
  233   3HD1  ILE  34          HD11      ILE  34   0.772   2.193  -8.877
  234    H    CYS  35           HN       CYS  35   5.401  -1.685  -6.701
  235    HA   CYS  35           HA       CYS  35   4.827  -2.769  -4.089
  236   1HB   CYS  35           HB2      CYS  35   5.552  -4.218  -5.941
  237   2HB   CYS  35           HB1      CYS  35   7.087  -3.336  -6.064
  238    H    ASN  36           HN       ASN  36   8.027  -1.680  -5.340
  239    HA   ASN  36           HA       ASN  36   9.225  -1.286  -2.756
  240   1HB   ASN  36           HB2      ASN  36  10.475  -1.308  -4.885
  241   2HB   ASN  36           HB1      ASN  36   9.634   0.149  -5.430
  242   1HD2  ASN  36          HD22      ASN  36  12.558   1.767  -4.157
  243   2HD2  ASN  36          HD21      ASN  36  11.809   1.194  -5.569
  244    H    LYS  37           HN       LYS  37   7.717   1.166  -4.849
  245    HA   LYS  37           HA       LYS  37   7.913   3.387  -3.139
  246   1HB   LYS  37           HB2      LYS  37   7.472   3.186  -5.620
  247   2HB   LYS  37           HB1      LYS  37   5.794   2.848  -5.203
  248   1HG   LYS  37           HG2      LYS  37   7.219   5.307  -4.171
  249   2HG   LYS  37           HG1      LYS  37   6.401   5.303  -5.733
  250   1HD   LYS  37           HD2      LYS  37   4.413   4.275  -4.282
  251   2HD   LYS  37           HD1      LYS  37   5.239   5.132  -2.982
  252   1HE   LYS  37           HE2      LYS  37   4.322   6.387  -5.603
  253   2HE   LYS  37           HE1      LYS  37   3.539   6.601  -4.023
  254   1HZ   LYS  37           HZ2      LYS  37   5.743   7.340  -3.169
  255   2HZ   LYS  37           HZ1      LYS  37   6.315   7.349  -4.768
  256   3HZ   LYS  37           HZ3      LYS  37   5.060   8.395  -4.312
  257    H    ASN  38           HN       ASN  38   4.670   2.224  -4.036
  258    HA   ASN  38           HA       ASN  38   3.340   3.395  -1.915
  259   1HB   ASN  38           HB2      ASN  38   2.883   1.290  -3.908
  260   2HB   ASN  38           HB1      ASN  38   1.619   1.682  -2.739
  261   1HD2  ASN  38          HD22      ASN  38   2.372   4.144  -5.853
  262   2HD2  ASN  38          HD21      ASN  38   3.221   2.688  -5.618
  263    H    CYS  39           HN       CYS  39   4.817   0.269  -2.150
  264    HA   CYS  39           HA       CYS  39   3.463  -1.169  -0.145
  265   1HB   CYS  39           HB2      CYS  39   6.389  -0.989  -0.817
  266   2HB   CYS  39           HB1      CYS  39   5.772  -2.155   0.356
  267    H    THR  40           HN       THR  40   5.656   1.539   0.321
  268    HA   THR  40           HA       THR  40   5.963   1.133   3.200
  269    HB   THR  40           HB       THR  40   6.847   3.563   2.948
  270    HG1  THR  40           HG1      THR  40   6.077   4.323   1.129
  271   1HG2  THR  40          HG22      THR  40   7.984   1.148   1.506
  272   2HG2  THR  40          HG21      THR  40   8.847   2.688   1.531
  273   3HG2  THR  40          HG23      THR  40   8.492   1.850   3.043
   
  No H/Q in entry =         273
  Start of MODEL   18
    1   1H    ASP   1           HT2      ASP   1  11.665   4.123   5.799
    2   2H    ASP   1           HT1      ASP   1  10.566   5.270   5.197
    3   3H    ASP   1           HT3      ASP   1  10.546   4.862   6.843
    4    HA   ASP   1           HA       ASP   1   9.800   2.630   6.340
    5   1HB   ASP   1           HB2      ASP   1   8.464   5.133   5.890
    6   2HB   ASP   1           HB1      ASP   1   7.812   3.946   4.760
    7    H    ASP   2           HN       ASP   2  11.045   1.346   4.906
    8    HA   ASP   2           HA       ASP   2  10.085   1.282   2.101
    9   1HB   ASP   2           HB2      ASP   2  12.882   2.061   3.035
   10   2HB   ASP   2           HB1      ASP   2  12.634   1.354   1.432
   11    H    GLY   3           HN       GLY   3  12.137  -0.442   1.135
   12   1HA   GLY   3           HA2      GLY   3  13.058  -2.494   2.755
   13   2HA   GLY   3           HA1      GLY   3  11.391  -2.943   2.416
   14    H    LEU   4           HN       LEU   4  11.777  -4.679   1.048
   15    HA   LEU   4           HA       LEU   4  13.145  -4.055  -1.544
   16   1HB   LEU   4           HB2      LEU   4  13.234  -6.720  -0.105
   17   2HB   LEU   4           HB1      LEU   4  14.243  -6.171  -1.437
   18    HG   LEU   4           HG       LEU   4  14.277  -4.737   1.221
   19   1HD1  LEU   4          HD13      LEU   4  15.513  -7.337   0.449
   20   2HD1  LEU   4          HD12      LEU   4  16.503  -6.206   1.371
   21   3HD1  LEU   4          HD11      LEU   4  14.969  -6.777   2.031
   22   1HD2  LEU   4          HD23      LEU   4  15.874  -4.783  -1.300
   23   2HD2  LEU   4          HD22      LEU   4  15.488  -3.425  -0.242
   24   3HD2  LEU   4          HD21      LEU   4  16.761  -4.559   0.207
   25    H    CYS   5           HN       CYS   5  12.519  -6.071  -3.154
   26    HA   CYS   5           HA       CYS   5   9.697  -6.937  -2.633
   27   1HB   CYS   5           HB2      CYS   5   9.835  -4.695  -3.897
   28   2HB   CYS   5           HB1      CYS   5  10.485  -5.623  -5.245
   29    H    TYR   6           HN       TYR   6   9.016  -8.662  -4.000
   30    HA   TYR   6           HA       TYR   6  11.202 -10.053  -5.510
   31   1HB   TYR   6           HB2      TYR   6  10.722 -12.114  -4.332
   32   2HB   TYR   6           HB1      TYR   6  10.953 -10.861  -3.125
   33    HD1  TYR   6           HD1      TYR   6   8.462 -12.911  -4.910
   34    HD2  TYR   6           HD2      TYR   6   9.170 -10.191  -1.686
   35    HE1  TYR   6           HE1      TYR   6   6.229 -13.448  -3.983
   36    HE2  TYR   6           HE2      TYR   6   6.927 -10.707  -0.747
   37    HH   TYR   6           HH       TYR   6   5.312 -12.861  -0.952
   38    H    GLU   7           HN       GLU   7  10.205 -11.799  -6.977
   39    HA   GLU   7           HA       GLU   7   7.447 -10.926  -7.809
   40   1HB   GLU   7           HB2      GLU   7   8.221 -11.091 -10.047
   41   2HB   GLU   7           HB1      GLU   7   9.560 -10.341  -9.192
   42   1HG   GLU   7           HG2      GLU   7  10.451 -12.775  -8.956
   43   2HG   GLU   7           HG1      GLU   7   9.235 -13.128 -10.198
   44    H    GLY   8           HN       GLY   8   6.049 -12.525  -8.507
   45   1HA   GLY   8           HA2      GLY   8   6.262 -15.104  -9.183
   46   2HA   GLY   8           HA1      GLY   8   6.609 -15.229  -7.459
   47    H    THR   9           HN       THR   9   4.817 -15.813  -6.316
   48    HA   THR   9           HA       THR   9   2.202 -14.542  -6.870
   49    HB   THR   9           HB       THR   9   2.866 -17.468  -7.034
   50    HG1  THR   9           HG1      THR   9   2.423 -17.207  -9.200
   51   1HG2  THR   9          HG21      THR   9   0.325 -16.094  -6.610
   52   2HG2  THR   9          HG23      THR   9   0.304 -17.078  -8.075
   53   3HG2  THR   9          HG22      THR   9   0.691 -17.816  -6.521
   54    H    ASN  10           HN       ASN  10   4.293 -14.983  -4.483
   55    HA   ASN  10           HA       ASN  10   2.952 -16.766  -2.634
   56   1HB   ASN  10           HB2      ASN  10   5.376 -16.140  -2.785
   57   2HB   ASN  10           HB1      ASN  10   4.956 -14.602  -2.033
   58   1HD2  ASN  10          HD22      ASN  10   4.706 -16.045   1.241
   59   2HD2  ASN  10          HD21      ASN  10   4.642 -14.592   0.297
   60    H    CYS  11           HN       CYS  11   2.144 -13.654  -3.510
   61    HA   CYS  11           HA       CYS  11   0.564 -13.335  -0.982
   62   1HB   CYS  11           HB2      CYS  11   2.151 -11.360  -2.617
   63   2HB   CYS  11           HB1      CYS  11   0.859 -10.803  -1.542
   64    H    GLY  12           HN       GLY  12  -0.010 -14.538  -3.625
   65   1HA   GLY  12           HA2      GLY  12  -2.012 -14.619  -4.895
   66   2HA   GLY  12           HA1      GLY  12  -2.609 -13.303  -3.873
   67    H    LYS  13           HN       LYS  13   0.428 -12.692  -5.164
   68    HA   LYS  13           HA       LYS  13  -0.559 -10.540  -6.833
   69   1HB   LYS  13           HB2      LYS  13   1.771  -9.903  -6.785
   70   2HB   LYS  13           HB1      LYS  13   1.223 -10.402  -5.198
   71   1HG   LYS  13           HG2      LYS  13   2.285 -12.558  -5.394
   72   2HG   LYS  13           HG1      LYS  13   2.628 -12.272  -7.094
   73   1HD   LYS  13           HD2      LYS  13   3.738 -10.115  -5.694
   74   2HD   LYS  13           HD1      LYS  13   4.147 -11.551  -4.768
   75   1HE   LYS  13           HE2      LYS  13   5.796 -10.897  -6.638
   76   2HE   LYS  13           HE1      LYS  13   5.224 -12.574  -6.646
   77   1HZ   LYS  13           HZ1      LYS  13   3.529 -10.656  -8.032
   78   2HZ   LYS  13           HZ3      LYS  13   5.029 -10.954  -8.763
   79   3HZ   LYS  13           HZ2      LYS  13   3.960 -12.240  -8.470
   80    H    VAL  14           HN       VAL  14  -1.322 -12.821  -7.983
   81    HA   VAL  14           HA       VAL  14   0.519 -13.932  -9.926
   82    HB   VAL  14           HB       VAL  14  -2.492 -13.771  -9.634
   83   1HG1  VAL  14          HG12      VAL  14  -1.931 -13.950 -12.050
   84   2HG1  VAL  14          HG11      VAL  14  -0.940 -15.368 -11.701
   85   3HG1  VAL  14          HG13      VAL  14  -2.684 -15.426 -11.445
   86   1HG2  VAL  14          HG23      VAL  14  -0.798 -15.240  -8.184
   87   2HG2  VAL  14          HG22      VAL  14  -2.366 -15.874  -8.681
   88   3HG2  VAL  14          HG21      VAL  14  -0.914 -16.313  -9.580
   89    H    GLY  15           HN       GLY  15   1.485 -12.559 -11.445
   90   1HA   GLY  15           HA2      GLY  15   1.148 -11.393 -13.592
   91   2HA   GLY  15           HA1      GLY  15  -0.398 -10.799 -12.985
   92    H    LYS  16           HN       LYS  16   1.113 -10.147 -10.298
   93    HA   LYS  16           HA       LYS  16   2.465  -7.675 -11.344
   94   1HB   LYS  16           HB2      LYS  16   0.728  -7.961  -8.901
   95   2HB   LYS  16           HB1      LYS  16   1.442  -6.478  -9.526
   96   1HG   LYS  16           HG2      LYS  16   0.135  -6.664 -11.580
   97   2HG   LYS  16           HG1      LYS  16  -0.563  -8.184 -11.022
   98   1HD   LYS  16           HD2      LYS  16  -0.809  -5.744  -9.286
   99   2HD   LYS  16           HD1      LYS  16  -1.882  -5.922 -10.676
  100   1HE   LYS  16           HE2      LYS  16  -2.096  -8.415  -9.620
  101   2HE   LYS  16           HE1      LYS  16  -1.814  -7.472  -8.143
  102   1HZ   LYS  16           HZ2      LYS  16  -3.741  -6.662 -10.248
  103   2HZ   LYS  16           HZ1      LYS  16  -4.192  -7.567  -8.882
  104   3HZ   LYS  16           HZ3      LYS  16  -3.569  -6.000  -8.693
  105    H    TYR  17           HN       TYR  17   2.974  -7.123  -8.223
  106    HA   TYR  17           HA       TYR  17   4.959  -9.307  -7.777
  107   1HB   TYR  17           HB2      TYR  17   5.728  -6.392  -7.655
  108   2HB   TYR  17           HB1      TYR  17   6.755  -7.835  -7.623
  109    HD1  TYR  17           HD1      TYR  17   4.605  -5.761  -9.857
  110    HD2  TYR  17           HD2      TYR  17   7.373  -8.996  -9.518
  111    HE1  TYR  17           HE1      TYR  17   4.866  -5.807 -12.327
  112    HE2  TYR  17           HE2      TYR  17   7.653  -9.057 -11.951
  113    HH   TYR  17           HH       TYR  17   5.614  -7.806 -14.059
  114    H    CYS  18           HN       CYS  18   6.049  -8.866  -5.409
  115    HA   CYS  18           HA       CYS  18   3.968  -7.587  -3.662
  116   1HB   CYS  18           HB2      CYS  18   5.247 -10.340  -3.509
  117   2HB   CYS  18           HB1      CYS  18   4.338  -9.632  -2.173
  118    H    CYS  19           HN       CYS  19   4.820  -7.114  -1.477
  119    HA   CYS  19           HA       CYS  19   7.770  -6.817  -1.412
  120   1HB   CYS  19           HB2      CYS  19   7.151  -4.563  -0.239
  121   2HB   CYS  19           HB1      CYS  19   6.985  -4.684  -1.993
  122    H    SER  20           HN       SER  20   8.620  -7.758   0.375
  123    HA   SER  20           HA       SER  20   7.458  -7.462   3.032
  124   1HB   SER  20           HB2      SER  20   7.088  -9.965   3.317
  125   2HB   SER  20           HB1      SER  20   6.009  -9.241   2.121
  126    HG   SER  20           HG       SER  20   8.312 -10.819   1.735
  127    HA   PRO  21           HA       PRO  21  11.879  -8.111   3.194
  128   1HB   PRO  21           HB2      PRO  21  12.303  -7.052   5.688
  129   2HB   PRO  21           HB1      PRO  21  12.083  -6.061   4.231
  130   1HG   PRO  21           HG2      PRO  21  10.150  -6.608   6.427
  131   2HG   PRO  21           HG1      PRO  21  10.316  -5.187   5.375
  132   1HD   PRO  21           HD2      PRO  21   8.435  -7.269   5.133
  133   2HD   PRO  21           HD1      PRO  21   8.786  -6.025   3.911
  134    H    ILE  22           HN       ILE  22   9.460  -9.663   4.775
  135    HA   ILE  22           HA       ILE  22  11.173 -11.864   5.595
  136    HB   ILE  22           HB       ILE  22  11.304 -10.081   7.409
  137   1HG1  ILE  22          HG12      ILE  22  10.123 -12.790   8.150
  138   2HG1  ILE  22          HG11      ILE  22  11.836 -12.380   8.060
  139   1HG2  ILE  22          HG23      ILE  22   8.564 -10.036   6.965
  140   2HG2  ILE  22          HG22      ILE  22   8.728 -10.797   8.547
  141   3HG2  ILE  22          HG21      ILE  22   9.426  -9.204   8.258
  142   1HD1  ILE  22          HD13      ILE  22  11.531 -10.745   9.901
  143   2HD1  ILE  22          HD12      ILE  22   9.830 -11.199  10.010
  144   3HD1  ILE  22          HD11      ILE  22  11.084 -12.378  10.400
  145    H    GLY  23           HN       GLY  23   8.586 -10.945   4.220
  146   1HA   GLY  23           HA2      GLY  23   6.671 -12.150   3.447
  147   2HA   GLY  23           HA1      GLY  23   7.186 -13.464   4.497
  148    H    LYS  24           HN       LYS  24   7.046 -10.513   6.125
  149    HA   LYS  24           HA       LYS  24   4.695 -11.423   7.615
  150   1HB   LYS  24           HB2      LYS  24   5.342  -9.787   9.230
  151   2HB   LYS  24           HB1      LYS  24   6.806 -10.576   8.654
  152   1HG   LYS  24           HG2      LYS  24   7.123  -8.680   7.033
  153   2HG   LYS  24           HG1      LYS  24   5.734  -7.882   7.771
  154   1HD   LYS  24           HD2      LYS  24   7.975  -8.821   9.525
  155   2HD   LYS  24           HD1      LYS  24   8.169  -7.325   8.611
  156   1HE   LYS  24           HE2      LYS  24   6.326  -6.287   9.700
  157   2HE   LYS  24           HE1      LYS  24   5.721  -7.837  10.319
  158   1HZ   LYS  24           HZ1      LYS  24   7.855  -8.070  11.527
  159   2HZ   LYS  24           HZ3      LYS  24   8.263  -6.492  11.061
  160   3HZ   LYS  24           HZ2      LYS  24   6.922  -6.757  12.068
  161    H    TYR  25           HN       TYR  25   5.553  -8.764   5.448
  162    HA   TYR  25           HA       TYR  25   3.009  -7.375   5.895
  163   1HB   TYR  25           HB2      TYR  25   5.449  -6.982   4.185
  164   2HB   TYR  25           HB1      TYR  25   4.010  -5.987   3.951
  165    HD1  TYR  25           HD2      TYR  25   3.129  -4.611   5.847
  166    HD2  TYR  25           HD1      TYR  25   6.898  -6.645   6.058
  167    HE1  TYR  25           HE2      TYR  25   3.783  -3.184   7.775
  168    HE2  TYR  25           HE1      TYR  25   7.567  -5.213   7.989
  169    HH   TYR  25           HH       TYR  25   5.383  -3.361   9.727
  170    H    CYS  26           HN       CYS  26   4.472  -9.284   3.239
  171    HA   CYS  26           HA       CYS  26   3.478 -10.075   1.209
  172   1HB   CYS  26           HB2      CYS  26   2.525 -11.348   3.288
  173   2HB   CYS  26           HB1      CYS  26   1.051 -10.425   3.005
  174    H    VAL  27           HN       VAL  27   3.410  -7.414   0.916
  175    HA   VAL  27           HA       VAL  27   0.538  -6.673   0.354
  176    HB   VAL  27           HB       VAL  27   3.006  -4.963   0.819
  177   1HG1  VAL  27          HG11      VAL  27   0.767  -4.276  -0.562
  178   2HG1  VAL  27          HG13      VAL  27   0.272  -3.860   1.079
  179   3HG1  VAL  27          HG12      VAL  27   1.720  -3.131   0.384
  180   1HG2  VAL  27          HG23      VAL  27   0.636  -5.581   2.614
  181   2HG2  VAL  27          HG22      VAL  27   2.283  -6.165   2.849
  182   3HG2  VAL  27          HG21      VAL  27   1.932  -4.444   2.990
  183    H    CYS  28           HN       CYS  28   0.109  -6.817  -1.844
  184    HA   CYS  28           HA       CYS  28   2.431  -6.424  -3.699
  185   1HB   CYS  28           HB2      CYS  28  -0.143  -7.941  -4.138
  186   2HB   CYS  28           HB1      CYS  28   1.341  -8.079  -5.076
  187    H    TYR  29           HN       TYR  29   2.000  -5.559  -5.797
  188    HA   TYR  29           HA       TYR  29  -0.441  -3.915  -6.157
  189   1HB   TYR  29           HB2      TYR  29   2.409  -2.963  -6.184
  190   2HB   TYR  29           HB1      TYR  29   1.030  -2.027  -6.716
  191    HD1  TYR  29           HD1      TYR  29   2.523  -3.749  -3.839
  192    HD2  TYR  29           HD2      TYR  29  -0.299  -0.851  -5.205
  193    HE1  TYR  29           HE1      TYR  29   2.223  -2.960  -1.517
  194    HE2  TYR  29           HE2      TYR  29  -0.625  -0.047  -2.891
  195    HH   TYR  29           HH       TYR  29  -0.333  -0.807  -0.619
  196    H    ASP  30           HN       ASP  30  -0.129  -2.815  -8.491
  197    HA   ASP  30           HA       ASP  30   0.650  -4.938 -10.328
  198   1HB   ASP  30           HB2      ASP  30  -0.489  -3.682 -11.925
  199   2HB   ASP  30           HB1      ASP  30  -1.376  -3.404 -10.431
  200    H    SER  31           HN       SER  31   1.807  -1.646  -9.621
  201    HA   SER  31           HA       SER  31   3.999  -1.892 -11.597
  202   1HB   SER  31           HB2      SER  31   3.764   0.153  -9.446
  203   2HB   SER  31           HB1      SER  31   4.456   0.330 -11.051
  204    HG   SER  31           HG       SER  31   2.452   1.249 -11.122
  205    H    LYS  32           HN       LYS  32   5.821  -3.240 -11.030
  206    HA   LYS  32           HA       LYS  32   6.275  -4.251  -8.430
  207   1HB   LYS  32           HB2      LYS  32   8.428  -4.930  -9.307
  208   2HB   LYS  32           HB1      LYS  32   7.394  -4.803 -10.735
  209   1HG   LYS  32           HG2      LYS  32   8.382  -2.774 -11.423
  210   2HG   LYS  32           HG1      LYS  32   9.088  -2.476  -9.834
  211   1HD   LYS  32           HD2      LYS  32  10.939  -3.260 -11.108
  212   2HD   LYS  32           HD1      LYS  32  10.392  -4.715 -10.258
  213   1HE   LYS  32           HE2      LYS  32   9.277  -5.567 -12.214
  214   2HE   LYS  32           HE1      LYS  32   9.359  -3.992 -13.033
  215   1HZ   LYS  32           HZ1      LYS  32  11.774  -4.126 -12.973
  216   2HZ   LYS  32           HZ3      LYS  32  11.696  -5.641 -12.215
  217   3HZ   LYS  32           HZ2      LYS  32  11.125  -5.456 -13.805
  218    H    ALA  33           HN       ALA  33   7.168  -1.147  -9.887
  219    HA   ALA  33           HA       ALA  33   8.796  -0.082  -7.833
  220   1HB   ALA  33           HB3      ALA  33   8.293   0.810 -10.181
  221   2HB   ALA  33           HB2      ALA  33   6.725   1.329  -9.556
  222   3HB   ALA  33           HB1      ALA  33   8.209   2.029  -8.905
  223    H    ILE  34           HN       ILE  34   5.172  -0.005  -8.306
  224    HA   ILE  34           HA       ILE  34   4.615   1.507  -6.008
  225    HB   ILE  34           HB       ILE  34   3.270  -0.538  -7.656
  226   1HG1  ILE  34          HG12      ILE  34   3.140   2.448  -7.259
  227   2HG1  ILE  34          HG11      ILE  34   3.414   1.548  -8.746
  228   1HG2  ILE  34          HG23      ILE  34   2.464  -0.575  -5.194
  229   2HG2  ILE  34          HG22      ILE  34   1.877   1.058  -5.488
  230   3HG2  ILE  34          HG21      ILE  34   1.228  -0.289  -6.416
  231   1HD1  ILE  34          HD11      ILE  34   1.071   0.601  -8.433
  232   2HD1  ILE  34          HD13      ILE  34   0.853   1.831  -7.191
  233   3HD1  ILE  34          HD12      ILE  34   1.163   2.311  -8.862
  234    H    CYS  35           HN       CYS  35   5.559  -1.723  -6.438
  235    HA   CYS  35           HA       CYS  35   4.756  -2.876  -3.919
  236   1HB   CYS  35           HB2      CYS  35   5.657  -4.266  -5.751
  237   2HB   CYS  35           HB1      CYS  35   7.200  -3.393  -5.682
  238    H    ASN  36           HN       ASN  36   8.047  -1.734  -4.855
  239    HA   ASN  36           HA       ASN  36   9.021  -1.409  -2.173
  240   1HB   ASN  36           HB2      ASN  36   9.616  -0.087  -4.846
  241   2HB   ASN  36           HB1      ASN  36  10.482   0.389  -3.383
  242   1HD2  ASN  36          HD22      ASN  36  12.568  -2.283  -4.756
  243   2HD2  ASN  36          HD21      ASN  36  12.210  -0.652  -5.064
  244    H    LYS  37           HN       LYS  37   7.693   1.116  -4.293
  245    HA   LYS  37           HA       LYS  37   7.705   3.264  -2.484
  246   1HB   LYS  37           HB2      LYS  37   7.502   3.164  -5.001
  247   2HB   LYS  37           HB1      LYS  37   5.794   2.804  -4.761
  248   1HG   LYS  37           HG2      LYS  37   7.096   5.221  -3.496
  249   2HG   LYS  37           HG1      LYS  37   6.429   5.280  -5.127
  250   1HD   LYS  37           HD2      LYS  37   4.309   4.212  -3.951
  251   2HD   LYS  37           HD1      LYS  37   5.007   4.941  -2.507
  252   1HE   LYS  37           HE2      LYS  37   4.344   6.421  -5.087
  253   2HE   LYS  37           HE1      LYS  37   3.448   6.535  -3.559
  254   1HZ   LYS  37           HZ2      LYS  37   5.623   7.130  -2.499
  255   2HZ   LYS  37           HZ1      LYS  37   6.273   7.296  -4.061
  256   3HZ   LYS  37           HZ3      LYS  37   5.005   8.305  -3.560
  257    H    ASN  38           HN       ASN  38   4.570   2.133  -3.732
  258    HA   ASN  38           HA       ASN  38   3.030   3.228  -1.716
  259   1HB   ASN  38           HB2      ASN  38   2.789   1.180  -3.805
  260   2HB   ASN  38           HB1      ASN  38   1.412   1.531  -2.757
  261   1HD2  ASN  38          HD22      ASN  38   2.446   4.081  -5.715
  262   2HD2  ASN  38          HD21      ASN  38   3.281   2.625  -5.436
  263    H    CYS  39           HN       CYS  39   4.543   0.120  -1.905
  264    HA   CYS  39           HA       CYS  39   3.010  -1.394  -0.096
  265   1HB   CYS  39           HB2      CYS  39   5.984  -1.162  -0.475
  266   2HB   CYS  39           HB1      CYS  39   5.277  -2.366   0.608
  267    H    THR  40           HN       THR  40   5.178   1.269   0.690
  268    HA   THR  40           HA       THR  40   5.136   0.777   3.572
  269    HB   THR  40           HB       THR  40   6.139   3.169   3.492
  270    HG1  THR  40           HG1      THR  40   5.227   3.707   1.481
  271   1HG2  THR  40          HG21      THR  40   7.248   0.637   2.353
  272   2HG2  THR  40          HG23      THR  40   8.155   2.112   2.012
  273   3HG2  THR  40          HG22      THR  40   7.850   1.630   3.682
   
  No H/Q in entry =         273
  Start of MODEL   19
    1   1H    ASP   1           HT1      ASP   1  11.026   4.806   5.836
    2   2H    ASP   1           HT3      ASP   1   9.406   5.210   5.537
    3   3H    ASP   1           HT2      ASP   1   9.866   3.578   5.645
    4    HA   ASP   1           HA       ASP   1   9.536   4.221   3.323
    5   1HB   ASP   1           HB2      ASP   1  10.183   6.627   4.041
    6   2HB   ASP   1           HB1      ASP   1  11.848   6.103   3.794
    7    H    ASP   2           HN       ASP   2  10.574   1.989   4.278
    8    HA   ASP   2           HA       ASP   2  13.045   1.584   2.685
    9   1HB   ASP   2           HB2      ASP   2  12.787   1.423   5.718
   10   2HB   ASP   2           HB1      ASP   2  14.024   0.483   4.867
   11    H    GLY   3           HN       GLY   3  13.197  -0.553   1.976
   12   1HA   GLY   3           HA2      GLY   3  12.280  -2.894   3.131
   13   2HA   GLY   3           HA1      GLY   3  10.866  -2.262   2.291
   14    H    LEU   4           HN       LEU   4  11.529  -4.549   1.286
   15    HA   LEU   4           HA       LEU   4  13.071  -3.951  -1.208
   16   1HB   LEU   4           HB2      LEU   4  13.049  -6.598   0.271
   17   2HB   LEU   4           HB1      LEU   4  14.124  -6.095  -1.029
   18    HG   LEU   4           HG       LEU   4  14.062  -4.599   1.594
   19   1HD1  LEU   4          HD11      LEU   4  14.523  -7.116   1.851
   20   2HD1  LEU   4          HD13      LEU   4  16.004  -6.812   0.943
   21   3HD1  LEU   4          HD12      LEU   4  15.737  -6.011   2.491
   22   1HD2  LEU   4          HD22      LEU   4  15.767  -4.720  -0.852
   23   2HD2  LEU   4          HD21      LEU   4  15.347  -3.333   0.155
   24   3HD2  LEU   4          HD23      LEU   4  16.589  -4.466   0.687
   25    H    CYS   5           HN       CYS   5  12.492  -5.968  -2.859
   26    HA   CYS   5           HA       CYS   5   9.633  -6.781  -2.463
   27   1HB   CYS   5           HB2      CYS   5   9.803  -4.542  -3.681
   28   2HB   CYS   5           HB1      CYS   5  10.574  -5.414  -5.003
   29    H    TYR   6           HN       TYR   6   8.978  -8.515  -3.813
   30    HA   TYR   6           HA       TYR   6  11.150  -9.878  -5.358
   31   1HB   TYR   6           HB2      TYR   6  10.794 -11.938  -4.166
   32   2HB   TYR   6           HB1      TYR   6  10.969 -10.682  -2.953
   33    HD1  TYR   6           HD1      TYR   6   8.622 -12.913  -4.681
   34    HD2  TYR   6           HD2      TYR   6   9.124 -10.051  -1.543
   35    HE1  TYR   6           HE1      TYR   6   6.432 -13.578  -3.740
   36    HE2  TYR   6           HE2      TYR   6   6.918 -10.692  -0.592
   37    HH   TYR   6           HH       TYR   6   5.420 -12.679  -0.635
   38    H    GLU   7           HN       GLU   7  10.172 -11.568  -6.858
   39    HA   GLU   7           HA       GLU   7   7.349 -10.794  -7.559
   40   1HB   GLU   7           HB2      GLU   7   8.054 -10.788  -9.825
   41   2HB   GLU   7           HB1      GLU   7   9.377 -10.016  -8.962
   42   1HG   GLU   7           HG2      GLU   7  10.408 -12.402  -8.899
   43   2HG   GLU   7           HG1      GLU   7   9.173 -12.755 -10.123
   44    H    GLY   8           HN       GLY   8   5.986 -12.416  -8.316
   45   1HA   GLY   8           HA2      GLY   8   6.403 -14.926  -9.184
   46   2HA   GLY   8           HA1      GLY   8   6.710 -15.154  -7.467
   47    H    THR   9           HN       THR   9   4.924 -15.864  -6.370
   48    HA   THR   9           HA       THR   9   2.237 -14.821  -7.055
   49    HB   THR   9           HB       THR   9   3.175 -17.672  -7.162
   50    HG1  THR   9           HG1      THR   9   2.204 -15.921  -9.165
   51   1HG2  THR   9          HG22      THR   9   0.513 -16.581  -6.799
   52   2HG2  THR   9          HG21      THR   9   0.619 -17.455  -8.326
   53   3HG2  THR   9          HG23      THR   9   1.026 -18.267  -6.816
   54    H    ASN  10           HN       ASN  10   4.264 -15.122  -4.556
   55    HA   ASN  10           HA       ASN  10   2.934 -16.970  -2.766
   56   1HB   ASN  10           HB2      ASN  10   5.317 -16.218  -2.770
   57   2HB   ASN  10           HB1      ASN  10   4.776 -14.679  -2.100
   58   1HD2  ASN  10          HD22      ASN  10   4.408 -16.023   1.204
   59   2HD2  ASN  10          HD21      ASN  10   4.324 -14.609   0.205
   60    H    CYS  11           HN       CYS  11   2.090 -13.852  -3.674
   61    HA   CYS  11           HA       CYS  11   0.275 -13.645  -1.299
   62   1HB   CYS  11           HB2      CYS  11   1.925 -11.591  -2.759
   63   2HB   CYS  11           HB1      CYS  11   0.511 -11.093  -1.817
   64    H    GLY  12           HN       GLY  12   0.004 -14.812  -4.015
   65   1HA   GLY  12           HA2      GLY  12  -1.867 -14.952  -5.463
   66   2HA   GLY  12           HA1      GLY  12  -2.625 -13.711  -4.455
   67    H    LYS  13           HN       LYS  13   0.491 -12.906  -5.493
   68    HA   LYS  13           HA       LYS  13  -0.524 -10.745  -7.147
   69   1HB   LYS  13           HB2      LYS  13   1.650  -9.873  -6.837
   70   2HB   LYS  13           HB1      LYS  13   1.202 -10.698  -5.359
   71   1HG   LYS  13           HG2      LYS  13   2.396 -12.757  -6.341
   72   2HG   LYS  13           HG1      LYS  13   3.096 -11.634  -7.493
   73   1HD   LYS  13           HD2      LYS  13   4.023 -10.314  -5.656
   74   2HD   LYS  13           HD1      LYS  13   3.290 -11.408  -4.489
   75   1HE   LYS  13           HE2      LYS  13   4.958 -12.920  -4.722
   76   2HE   LYS  13           HE1      LYS  13   4.908 -12.809  -6.491
   77   1HZ   LYS  13           HZ1      LYS  13   5.969 -10.590  -6.264
   78   2HZ   LYS  13           HZ3      LYS  13   6.202 -10.911  -4.617
   79   3HZ   LYS  13           HZ2      LYS  13   6.961 -11.879  -5.781
   80    H    VAL  14           HN       VAL  14  -1.121 -12.997  -8.395
   81    HA   VAL  14           HA       VAL  14   0.852 -13.987 -10.274
   82    HB   VAL  14           HB       VAL  14  -2.174 -13.942 -10.120
   83   1HG1  VAL  14          HG11      VAL  14  -0.385 -15.117 -12.253
   84   2HG1  VAL  14          HG13      VAL  14  -1.981 -15.790 -11.920
   85   3HG1  VAL  14          HG12      VAL  14  -1.824 -14.118 -12.459
   86   1HG2  VAL  14          HG21      VAL  14  -0.490 -15.388  -8.630
   87   2HG2  VAL  14          HG23      VAL  14  -2.017 -16.056  -9.202
   88   3HG2  VAL  14          HG22      VAL  14  -0.519 -16.432 -10.052
   89    H    GLY  15           HN       GLY  15   1.839 -12.499 -11.664
   90   1HA   GLY  15           HA2      GLY  15   1.606 -11.240 -13.768
   91   2HA   GLY  15           HA1      GLY  15  -0.024 -10.775 -13.271
   92    H    LYS  16           HN       LYS  16   1.113 -10.187 -10.441
   93    HA   LYS  16           HA       LYS  16   2.400  -7.580 -11.179
   94   1HB   LYS  16           HB2      LYS  16   0.550  -8.175  -8.877
   95   2HB   LYS  16           HB1      LYS  16   1.198  -6.606  -9.340
   96   1HG   LYS  16           HG2      LYS  16   0.004  -6.646 -11.442
   97   2HG   LYS  16           HG1      LYS  16  -0.566  -8.285 -11.138
   98   1HD   LYS  16           HD2      LYS  16  -1.171  -6.130  -9.132
   99   2HD   LYS  16           HD1      LYS  16  -2.134  -6.232 -10.609
  100   1HE   LYS  16           HE2      LYS  16  -3.116  -8.227  -9.991
  101   2HE   LYS  16           HE1      LYS  16  -1.672  -8.785  -9.123
  102   1HZ   LYS  16           HZ2      LYS  16  -3.440  -6.561  -8.248
  103   2HZ   LYS  16           HZ1      LYS  16  -3.457  -8.127  -7.593
  104   3HZ   LYS  16           HZ3      LYS  16  -2.083  -7.148  -7.412
  105    H    TYR  17           HN       TYR  17   2.816  -7.157  -8.085
  106    HA   TYR  17           HA       TYR  17   4.780  -9.356  -7.604
  107   1HB   TYR  17           HB2      TYR  17   5.587  -6.444  -7.504
  108   2HB   TYR  17           HB1      TYR  17   6.599  -7.894  -7.468
  109    HD1  TYR  17           HD1      TYR  17   4.417  -5.849  -9.716
  110    HD2  TYR  17           HD2      TYR  17   7.250  -9.025  -9.367
  111    HE1  TYR  17           HE1      TYR  17   4.664  -5.909 -12.186
  112    HE2  TYR  17           HE2      TYR  17   7.520  -9.093 -11.804
  113    HH   TYR  17           HH       TYR  17   6.542  -6.669 -13.824
  114    H    CYS  18           HN       CYS  18   5.901  -8.833  -5.231
  115    HA   CYS  18           HA       CYS  18   3.829  -7.528  -3.497
  116   1HB   CYS  18           HB2      CYS  18   5.066 -10.299  -3.294
  117   2HB   CYS  18           HB1      CYS  18   4.158  -9.553  -1.978
  118    H    CYS  19           HN       CYS  19   4.702  -7.001  -1.338
  119    HA   CYS  19           HA       CYS  19   7.661  -6.812  -1.278
  120   1HB   CYS  19           HB2      CYS  19   7.133  -4.508  -0.161
  121   2HB   CYS  19           HB1      CYS  19   6.954  -4.664  -1.911
  122    H    SER  20           HN       SER  20   8.501  -7.674   0.556
  123    HA   SER  20           HA       SER  20   7.322  -7.292   3.191
  124   1HB   SER  20           HB2      SER  20   6.984  -9.821   3.527
  125   2HB   SER  20           HB1      SER  20   5.844  -9.070   2.406
  126    HG   SER  20           HG       SER  20   6.629 -10.850   1.381
  127    HA   PRO  21           HA       PRO  21  11.710  -7.943   3.480
  128   1HB   PRO  21           HB2      PRO  21  12.056  -7.131   6.075
  129   2HB   PRO  21           HB1      PRO  21  11.845  -6.006   4.718
  130   1HG   PRO  21           HG2      PRO  21   9.865  -6.833   6.787
  131   2HG   PRO  21           HG1      PRO  21  10.039  -5.293   5.920
  132   1HD   PRO  21           HD2      PRO  21   8.187  -7.325   5.371
  133   2HD   PRO  21           HD1      PRO  21   8.601  -5.974   4.288
  134    H    ILE  22           HN       ILE  22   9.309  -9.719   4.840
  135    HA   ILE  22           HA       ILE  22  11.085 -11.939   5.453
  136    HB   ILE  22           HB       ILE  22  11.081 -10.331   7.454
  137   1HG1  ILE  22          HG12      ILE  22  10.142 -13.204   7.848
  138   2HG1  ILE  22          HG11      ILE  22  11.813 -12.636   7.836
  139   1HG2  ILE  22          HG21      ILE  22   8.399 -10.339   6.987
  140   2HG2  ILE  22          HG23      ILE  22   8.514 -11.455   8.346
  141   3HG2  ILE  22          HG22      ILE  22   9.147  -9.817   8.497
  142   1HD1  ILE  22          HD12      ILE  22  10.978 -11.083   9.807
  143   2HD1  ILE  22          HD11      ILE  22   9.715 -12.305   9.957
  144   3HD1  ILE  22          HD13      ILE  22  11.411 -12.763  10.123
  145    H    GLY  23           HN       GLY  23   8.477 -10.950   4.154
  146   1HA   GLY  23           HA2      GLY  23   6.626 -12.123   3.204
  147   2HA   GLY  23           HA1      GLY  23   7.175 -13.535   4.095
  148    H    LYS  24           HN       LYS  24   6.901 -10.843   6.099
  149    HA   LYS  24           HA       LYS  24   4.541 -12.015   7.378
  150   1HB   LYS  24           HB2      LYS  24   5.100 -10.624   9.229
  151   2HB   LYS  24           HB1      LYS  24   6.607 -11.256   8.578
  152   1HG   LYS  24           HG2      LYS  24   6.867  -9.131   7.266
  153   2HG   LYS  24           HG1      LYS  24   5.432  -8.508   8.081
  154   1HD   LYS  24           HD2      LYS  24   7.667  -9.613   9.740
  155   2HD   LYS  24           HD1      LYS  24   7.837  -7.998   9.052
  156   1HE   LYS  24           HE2      LYS  24   6.683  -7.304  10.899
  157   2HE   LYS  24           HE1      LYS  24   5.254  -7.962  10.077
  158   1HZ   LYS  24           HZ1      LYS  24   7.096  -9.571  11.761
  159   2HZ   LYS  24           HZ3      LYS  24   5.628  -8.928  12.315
  160   3HZ   LYS  24           HZ2      LYS  24   5.632 -10.086  11.072
  161    H    TYR  25           HN       TYR  25   5.357  -9.065   5.616
  162    HA   TYR  25           HA       TYR  25   2.772  -7.807   6.203
  163   1HB   TYR  25           HB2      TYR  25   5.222  -7.140   4.591
  164   2HB   TYR  25           HB1      TYR  25   3.765  -6.149   4.484
  165    HD1  TYR  25           HD1      TYR  25   2.854  -5.038   6.521
  166    HD2  TYR  25           HD2      TYR  25   6.630  -7.068   6.526
  167    HE1  TYR  25           HE1      TYR  25   3.462  -3.889   8.641
  168    HE2  TYR  25           HE2      TYR  25   7.252  -5.916   8.650
  169    HH   TYR  25           HH       TYR  25   4.990  -4.270  10.558
  170    H    CYS  26           HN       CYS  26   4.304  -9.412   3.418
  171    HA   CYS  26           HA       CYS  26   3.401  -9.967   1.276
  172   1HB   CYS  26           HB2      CYS  26   2.480 -11.668   2.826
  173   2HB   CYS  26           HB1      CYS  26   1.131 -10.599   3.230
  174    H    VAL  27           HN       VAL  27   3.312  -7.385   1.014
  175    HA   VAL  27           HA       VAL  27   0.441  -6.575   0.551
  176    HB   VAL  27           HB       VAL  27   2.958  -4.921   0.966
  177   1HG1  VAL  27          HG12      VAL  27   0.593  -4.220  -0.293
  178   2HG1  VAL  27          HG11      VAL  27   0.340  -3.662   1.360
  179   3HG1  VAL  27          HG13      VAL  27   1.734  -3.093   0.442
  180   1HG2  VAL  27          HG21      VAL  27   1.049  -6.156   2.815
  181   2HG2  VAL  27          HG23      VAL  27   2.616  -5.420   3.147
  182   3HG2  VAL  27          HG22      VAL  27   1.175  -4.410   3.040
  183    H    CYS  28           HN       CYS  28  -0.024  -6.756  -1.635
  184    HA   CYS  28           HA       CYS  28   2.268  -6.390  -3.534
  185   1HB   CYS  28           HB2      CYS  28  -0.325  -7.891  -3.911
  186   2HB   CYS  28           HB1      CYS  28   1.143  -8.052  -4.873
  187    H    TYR  29           HN       TYR  29   1.810  -5.578  -5.645
  188    HA   TYR  29           HA       TYR  29  -0.627  -3.931  -6.011
  189   1HB   TYR  29           HB2      TYR  29   2.222  -2.983  -6.087
  190   2HB   TYR  29           HB1      TYR  29   0.836  -2.054  -6.613
  191    HD1  TYR  29           HD1      TYR  29   2.389  -3.718  -3.737
  192    HD2  TYR  29           HD2      TYR  29  -0.493  -0.877  -5.096
  193    HE1  TYR  29           HE1      TYR  29   2.119  -2.898  -1.423
  194    HE2  TYR  29           HE2      TYR  29  -0.790  -0.041  -2.790
  195    HH   TYR  29           HH       TYR  29  -0.462  -0.863  -0.480
  196    H    ASP  30           HN       ASP  30  -0.357  -2.897  -8.369
  197    HA   ASP  30           HA       ASP  30   0.414  -5.059 -10.163
  198   1HB   ASP  30           HB2      ASP  30  -0.743  -3.836 -11.778
  199   2HB   ASP  30           HB1      ASP  30  -1.619  -3.538 -10.280
  200    H    SER  31           HN       SER  31   1.573  -1.753  -9.526
  201    HA   SER  31           HA       SER  31   3.726  -2.006 -11.541
  202   1HB   SER  31           HB2      SER  31   3.520   0.058  -9.406
  203   2HB   SER  31           HB1      SER  31   4.180   0.222 -11.025
  204    HG   SER  31           HG       SER  31   1.498   0.102 -10.182
  205    H    LYS  32           HN       LYS  32   5.563  -3.337 -10.998
  206    HA   LYS  32           HA       LYS  32   6.083  -4.321  -8.401
  207   1HB   LYS  32           HB2      LYS  32   8.207  -5.006  -9.306
  208   2HB   LYS  32           HB1      LYS  32   7.168  -4.880 -10.731
  209   1HG   LYS  32           HG2      LYS  32   8.110  -2.751 -11.343
  210   2HG   LYS  32           HG1      LYS  32   8.954  -2.616  -9.806
  211   1HD   LYS  32           HD2      LYS  32   9.643  -4.259 -12.232
  212   2HD   LYS  32           HD1      LYS  32  10.710  -3.341 -11.171
  213   1HE   LYS  32           HE2      LYS  32   9.356  -5.972 -10.369
  214   2HE   LYS  32           HE1      LYS  32  11.045  -5.821 -10.897
  215   1HZ   LYS  32           HZ1      LYS  32   9.880  -4.222  -8.682
  216   2HZ   LYS  32           HZ3      LYS  32  10.717  -5.677  -8.439
  217   3HZ   LYS  32           HZ2      LYS  32  11.516  -4.342  -9.121
  218    H    ALA  33           HN       ALA  33   6.941  -1.237  -9.921
  219    HA   ALA  33           HA       ALA  33   8.610  -0.142  -7.919
  220   1HB   ALA  33           HB1      ALA  33   8.054   0.721 -10.265
  221   2HB   ALA  33           HB3      ALA  33   6.497   1.241  -9.614
  222   3HB   ALA  33           HB2      ALA  33   7.993   1.953  -9.003
  223    H    ILE  34           HN       ILE  34   4.971  -0.089  -8.299
  224    HA   ILE  34           HA       ILE  34   4.483   1.471  -6.019
  225    HB   ILE  34           HB       ILE  34   3.088  -0.609  -7.578
  226   1HG1  ILE  34          HG12      ILE  34   2.966   2.385  -7.235
  227   2HG1  ILE  34          HG11      ILE  34   3.198   1.457  -8.712
  228   1HG2  ILE  34          HG22      ILE  34   2.347  -0.643  -5.121
  229   2HG2  ILE  34          HG21      ILE  34   1.814   1.017  -5.352
  230   3HG2  ILE  34          HG23      ILE  34   1.071  -0.282  -6.279
  231   1HD1  ILE  34          HD11      ILE  34   0.871   0.517  -8.326
  232   2HD1  ILE  34          HD13      ILE  34   0.685   1.751  -7.082
  233   3HD1  ILE  34          HD12      ILE  34   0.941   2.226  -8.764
  234    H    CYS  35           HN       CYS  35   5.415  -1.767  -6.408
  235    HA   CYS  35           HA       CYS  35   4.711  -2.848  -3.825
  236   1HB   CYS  35           HB2      CYS  35   5.517  -4.302  -5.641
  237   2HB   CYS  35           HB1      CYS  35   7.058  -3.425  -5.696
  238    H    ASN  36           HN       ASN  36   7.991  -1.821  -4.908
  239    HA   ASN  36           HA       ASN  36   9.056  -1.405  -2.280
  240   1HB   ASN  36           HB2      ASN  36   9.590  -0.084  -4.980
  241   2HB   ASN  36           HB1      ASN  36  10.618   0.161  -3.562
  242   1HD2  ASN  36          HD22      ASN  36  10.943  -3.275  -5.684
  243   2HD2  ASN  36          HD21      ASN  36   9.869  -2.045  -6.150
  244    H    LYS  37           HN       LYS  37   7.679   1.046  -4.461
  245    HA   LYS  37           HA       LYS  37   7.829   3.285  -2.773
  246   1HB   LYS  37           HB2      LYS  37   7.492   3.067  -5.265
  247   2HB   LYS  37           HB1      LYS  37   5.797   2.733  -4.920
  248   1HG   LYS  37           HG2      LYS  37   7.171   5.202  -3.850
  249   2HG   LYS  37           HG1      LYS  37   6.426   5.181  -5.447
  250   1HD   LYS  37           HD2      LYS  37   4.367   4.180  -4.103
  251   2HD   LYS  37           HD1      LYS  37   5.134   5.009  -2.752
  252   1HE   LYS  37           HE2      LYS  37   4.443   6.342  -5.401
  253   2HE   LYS  37           HE1      LYS  37   3.473   6.474  -3.919
  254   1HZ   LYS  37           HZ2      LYS  37   5.486   7.237  -2.757
  255   2HZ   LYS  37           HZ1      LYS  37   6.329   7.235  -4.232
  256   3HZ   LYS  37           HZ3      LYS  37   5.026   8.295  -4.005
  257    H    ASN  38           HN       ASN  38   4.610   2.144  -3.787
  258    HA   ASN  38           HA       ASN  38   3.213   3.352  -1.731
  259   1HB   ASN  38           HB2      ASN  38   2.811   1.220  -3.708
  260   2HB   ASN  38           HB1      ASN  38   1.509   1.636  -2.589
  261   1HD2  ASN  38          HD22      ASN  38   2.389   4.048  -5.711
  262   2HD2  ASN  38          HD21      ASN  38   3.219   2.591  -5.425
  263    H    CYS  39           HN       CYS  39   4.654   0.202  -1.891
  264    HA   CYS  39           HA       CYS  39   3.235  -1.172   0.121
  265   1HB   CYS  39           HB2      CYS  39   6.178  -1.076  -0.505
  266   2HB   CYS  39           HB1      CYS  39   5.493  -2.236   0.640
  267    H    THR  40           HN       THR  40   5.489   1.491   0.553
  268    HA   THR  40           HA       THR  40   5.793   1.120   3.436
  269    HB   THR  40           HB       THR  40   6.735   3.513   3.173
  270    HG1  THR  40           HG1      THR  40   6.730   2.971   0.430
  271   1HG2  THR  40          HG23      THR  40   7.759   0.990   1.928
  272   2HG2  THR  40          HG22      THR  40   8.593   2.483   1.496
  273   3HG2  THR  40          HG21      THR  40   8.480   1.995   3.188
   
  No H/Q in entry =         273
  Start of MODEL   20
    1   1H    ASP   1           HT3      ASP   1  11.527   3.011   6.966
    2   2H    ASP   1           HT2      ASP   1  10.226   3.444   7.968
    3   3H    ASP   1           HT1      ASP   1  10.239   1.932   7.194
    4    HA   ASP   1           HA       ASP   1   8.742   3.294   5.967
    5   1HB   ASP   1           HB2      ASP   1  10.920   5.228   6.599
    6   2HB   ASP   1           HB1      ASP   1  10.046   5.483   5.089
    7    H    ASP   2           HN       ASP   2  10.781   1.238   5.408
    8    HA   ASP   2           HA       ASP   2  11.008   1.664   2.482
    9   1HB   ASP   2           HB2      ASP   2  13.306   1.524   4.479
   10   2HB   ASP   2           HB1      ASP   2  13.548   1.038   2.794
   11    H    GLY   3           HN       GLY   3  12.530  -0.442   1.761
   12   1HA   GLY   3           HA2      GLY   3  12.530  -2.839   3.149
   13   2HA   GLY   3           HA1      GLY   3  10.909  -2.749   2.472
   14    H    LEU   4           HN       LEU   4  11.497  -4.642   1.191
   15    HA   LEU   4           HA       LEU   4  13.076  -3.924  -1.249
   16   1HB   LEU   4           HB2      LEU   4  13.013  -6.657   0.059
   17   2HB   LEU   4           HB1      LEU   4  14.125  -6.068  -1.172
   18    HG   LEU   4           HG       LEU   4  13.990  -4.762   1.549
   19   1HD1  LEU   4          HD12      LEU   4  14.689  -7.436   1.141
   20   2HD1  LEU   4          HD11      LEU   4  16.230  -6.581   1.171
   21   3HD1  LEU   4          HD13      LEU   4  15.118  -6.442   2.533
   22   1HD2  LEU   4          HD23      LEU   4  15.740  -4.688  -0.861
   23   2HD2  LEU   4          HD22      LEU   4  15.327  -3.395   0.267
   24   3HD2  LEU   4          HD21      LEU   4  16.548  -4.589   0.703
   25    H    CYS   5           HN       CYS   5  12.521  -5.853  -3.005
   26    HA   CYS   5           HA       CYS   5   9.634  -6.636  -2.727
   27   1HB   CYS   5           HB2      CYS   5   9.832  -4.383  -3.862
   28   2HB   CYS   5           HB1      CYS   5  10.730  -5.175  -5.156
   29    H    TYR   6           HN       TYR   6   9.036  -8.394  -4.023
   30    HA   TYR   6           HA       TYR   6  11.190  -9.687  -5.647
   31   1HB   TYR   6           HB2      TYR   6  10.947 -11.761  -4.452
   32   2HB   TYR   6           HB1      TYR   6  11.131 -10.505  -3.243
   33    HD1  TYR   6           HD1      TYR   6   8.778 -12.799  -4.887
   34    HD2  TYR   6           HD2      TYR   6   9.336  -9.951  -1.745
   35    HE1  TYR   6           HE1      TYR   6   6.657 -13.546  -3.847
   36    HE2  TYR   6           HE2      TYR   6   7.202 -10.680  -0.694
   37    HH   TYR   6           HH       TYR   6   5.729 -12.576  -0.672
   38    H    GLU   7           HN       GLU   7  10.196 -11.429  -7.097
   39    HA   GLU   7           HA       GLU   7   7.337 -10.713  -7.711
   40   1HB   GLU   7           HB2      GLU   7   7.966 -10.725  -9.998
   41   2HB   GLU   7           HB1      GLU   7   9.307  -9.923  -9.191
   42   1HG   GLU   7           HG2      GLU   7  10.371 -12.297  -9.128
   43   2HG   GLU   7           HG1      GLU   7   9.102 -12.680 -10.307
   44    H    GLY   8           HN       GLY   8   5.983 -12.375  -8.410
   45   1HA   GLY   8           HA2      GLY   8   6.425 -14.892  -9.248
   46   2HA   GLY   8           HA1      GLY   8   6.783 -15.084  -7.536
   47    H    THR   9           HN       THR   9   5.041 -15.821  -6.384
   48    HA   THR   9           HA       THR   9   2.316 -14.844  -7.006
   49    HB   THR   9           HB       THR   9   3.307 -17.674  -7.116
   50    HG1  THR   9           HG1      THR   9   2.323 -15.896  -9.086
   51   1HG2  THR   9          HG23      THR   9   0.561 -16.528  -7.000
   52   2HG2  THR   9          HG22      THR   9   0.823 -17.823  -8.167
   53   3HG2  THR   9          HG21      THR   9   1.148 -18.099  -6.455
   54    H    ASN  10           HN       ASN  10   4.404 -15.075  -4.558
   55    HA   ASN  10           HA       ASN  10   3.169 -16.949  -2.728
   56   1HB   ASN  10           HB2      ASN  10   5.531 -16.152  -2.799
   57   2HB   ASN  10           HB1      ASN  10   4.981 -14.617  -2.128
   58   1HD2  ASN  10          HD22      ASN  10   4.721 -15.939   1.197
   59   2HD2  ASN  10          HD21      ASN  10   4.584 -14.535   0.189
   60    H    CYS  11           HN       CYS  11   2.240 -13.838  -3.600
   61    HA   CYS  11           HA       CYS  11   0.464 -13.694  -1.188
   62   1HB   CYS  11           HB2      CYS  11   2.040 -11.585  -2.650
   63   2HB   CYS  11           HB1      CYS  11   0.625 -11.131  -1.689
   64    H    GLY  12           HN       GLY  12   0.160 -14.844  -3.899
   65   1HA   GLY  12           HA2      GLY  12  -1.739 -15.012  -5.308
   66   2HA   GLY  12           HA1      GLY  12  -2.495 -13.782  -4.283
   67    H    LYS  13           HN       LYS  13   0.593 -12.949  -5.404
   68    HA   LYS  13           HA       LYS  13  -0.480 -10.787  -7.019
   69   1HB   LYS  13           HB2      LYS  13   1.703  -9.911  -6.777
   70   2HB   LYS  13           HB1      LYS  13   1.304 -10.740  -5.288
   71   1HG   LYS  13           HG2      LYS  13   2.462 -12.795  -6.315
   72   2HG   LYS  13           HG1      LYS  13   3.122 -11.670  -7.487
   73   1HD   LYS  13           HD2      LYS  13   4.064 -10.337  -5.624
   74   2HD   LYS  13           HD1      LYS  13   3.458 -11.537  -4.488
   75   1HE   LYS  13           HE2      LYS  13   5.153 -12.976  -4.942
   76   2HE   LYS  13           HE1      LYS  13   5.026 -12.693  -6.688
   77   1HZ   LYS  13           HZ3      LYS  13   6.042 -10.501  -6.335
   78   2HZ   LYS  13           HZ2      LYS  13   6.274 -10.881  -4.697
   79   3HZ   LYS  13           HZ1      LYS  13   7.080 -11.765  -5.897
   80    H    VAL  14           HN       VAL  14  -1.087 -13.071  -8.243
   81    HA   VAL  14           HA       VAL  14   0.834 -14.011 -10.202
   82    HB   VAL  14           HB       VAL  14  -2.185 -14.044  -9.932
   83   1HG1  VAL  14          HG13      VAL  14  -1.609 -14.130 -12.340
   84   2HG1  VAL  14          HG12      VAL  14  -0.506 -15.470 -12.025
   85   3HG1  VAL  14          HG11      VAL  14  -2.240 -15.680 -11.781
   86   1HG2  VAL  14          HG22      VAL  14  -0.351 -15.457  -8.541
   87   2HG2  VAL  14          HG21      VAL  14  -1.936 -16.107  -8.961
   88   3HG2  VAL  14          HG23      VAL  14  -0.527 -16.517  -9.940
   89    H    GLY  15           HN       GLY  15   1.720 -12.517 -11.648
   90   1HA   GLY  15           HA2      GLY  15   1.369 -11.262 -13.736
   91   2HA   GLY  15           HA1      GLY  15  -0.248 -10.835 -13.168
   92    H    LYS  16           HN       LYS  16   1.006 -10.220 -10.389
   93    HA   LYS  16           HA       LYS  16   2.204  -7.586 -11.184
   94   1HB   LYS  16           HB2      LYS  16   0.463  -8.206  -8.805
   95   2HB   LYS  16           HB1      LYS  16   1.051  -6.626  -9.308
   96   1HG   LYS  16           HG2      LYS  16  -0.239  -6.705 -11.348
   97   2HG   LYS  16           HG1      LYS  16  -0.745  -8.361 -11.017
   98   1HD   LYS  16           HD2      LYS  16  -1.319  -6.261  -8.956
   99   2HD   LYS  16           HD1      LYS  16  -2.325  -6.316 -10.406
  100   1HE   LYS  16           HE2      LYS  16  -2.636  -8.814  -9.945
  101   2HE   LYS  16           HE1      LYS  16  -1.918  -8.508  -8.352
  102   1HZ   LYS  16           HZ1      LYS  16  -4.241  -7.053  -9.502
  103   2HZ   LYS  16           HZ3      LYS  16  -4.332  -8.242  -8.296
  104   3HZ   LYS  16           HZ2      LYS  16  -3.546  -6.769  -7.978
  105    H    TYR  17           HN       TYR  17   2.720  -7.152  -8.107
  106    HA   TYR  17           HA       TYR  17   4.744  -9.309  -7.697
  107   1HB   TYR  17           HB2      TYR  17   5.486  -6.374  -7.637
  108   2HB   TYR  17           HB1      TYR  17   6.534  -7.802  -7.622
  109    HD1  TYR  17           HD1      TYR  17   4.250  -5.811  -9.816
  110    HD2  TYR  17           HD2      TYR  17   7.114  -8.969  -9.533
  111    HE1  TYR  17           HE1      TYR  17   4.405  -5.905 -12.291
  112    HE2  TYR  17           HE2      TYR  17   7.288  -9.071 -11.977
  113    HH   TYR  17           HH       TYR  17   5.910  -6.645 -14.011
  114    H    CYS  18           HN       CYS  18   5.919  -8.795  -5.350
  115    HA   CYS  18           HA       CYS  18   3.886  -7.513  -3.551
  116   1HB   CYS  18           HB2      CYS  18   5.123 -10.289  -3.401
  117   2HB   CYS  18           HB1      CYS  18   4.221  -9.560  -2.074
  118    H    CYS  19           HN       CYS  19   4.810  -7.037  -1.393
  119    HA   CYS  19           HA       CYS  19   7.774  -6.912  -1.359
  120   1HB   CYS  19           HB2      CYS  19   7.325  -4.571  -0.283
  121   2HB   CYS  19           HB1      CYS  19   7.137  -4.753  -2.030
  122    H    SER  20           HN       SER  20   8.613  -7.718   0.515
  123    HA   SER  20           HA       SER  20   7.382  -7.306   3.128
  124   1HB   SER  20           HB2      SER  20   7.029  -9.816   3.492
  125   2HB   SER  20           HB1      SER  20   5.944  -9.104   2.299
  126    HG   SER  20           HG       SER  20   7.298 -11.146   1.845
  127    HA   PRO  21           HA       PRO  21  11.772  -7.976   3.536
  128   1HB   PRO  21           HB2      PRO  21  12.068  -7.012   6.084
  129   2HB   PRO  21           HB1      PRO  21  11.900  -5.967   4.659
  130   1HG   PRO  21           HG2      PRO  21   9.879  -6.627   6.742
  131   2HG   PRO  21           HG1      PRO  21  10.069  -5.163   5.756
  132   1HD   PRO  21           HD2      PRO  21   8.233  -7.261   5.347
  133   2HD   PRO  21           HD1      PRO  21   8.618  -5.959   4.197
  134    H    ILE  22           HN       ILE  22   9.302  -9.603   4.989
  135    HA   ILE  22           HA       ILE  22  11.019 -11.819   5.789
  136    HB   ILE  22           HB       ILE  22  10.984 -10.025   7.657
  137   1HG1  ILE  22          HG12      ILE  22  10.117 -12.889   8.244
  138   2HG1  ILE  22          HG11      ILE  22  11.771 -12.273   8.219
  139   1HG2  ILE  22          HG21      ILE  22   8.457  -9.793   7.239
  140   2HG2  ILE  22          HG23      ILE  22   8.295 -11.239   8.231
  141   3HG2  ILE  22          HG22      ILE  22   9.012  -9.780   8.915
  142   1HD1  ILE  22          HD12      ILE  22  10.453 -10.596  10.027
  143   2HD1  ILE  22          HD11      ILE  22   9.809 -12.201  10.376
  144   3HD1  ILE  22          HD13      ILE  22  11.549 -11.916  10.438
  145    H    GLY  23           HN       GLY  23   8.424 -10.847   4.417
  146   1HA   GLY  23           HA2      GLY  23   6.542 -12.044   3.561
  147   2HA   GLY  23           HA1      GLY  23   7.066 -13.401   4.546
  148    H    LYS  24           HN       LYS  24   6.874 -10.553   6.356
  149    HA   LYS  24           HA       LYS  24   4.498 -11.573   7.735
  150   1HB   LYS  24           HB2      LYS  24   5.067 -10.024   9.449
  151   2HB   LYS  24           HB1      LYS  24   6.576 -10.708   8.859
  152   1HG   LYS  24           HG2      LYS  24   6.874  -8.719   7.385
  153   2HG   LYS  24           HG1      LYS  24   5.395  -8.031   8.055
  154   1HD   LYS  24           HD2      LYS  24   7.780  -8.821   9.743
  155   2HD   LYS  24           HD1      LYS  24   7.514  -7.187   9.138
  156   1HE   LYS  24           HE2      LYS  24   5.344  -8.603  10.688
  157   2HE   LYS  24           HE1      LYS  24   6.648  -7.747  11.532
  158   1HZ   LYS  24           HZ2      LYS  24   4.985  -6.581   9.363
  159   2HZ   LYS  24           HZ1      LYS  24   4.741  -6.294  11.019
  160   3HZ   LYS  24           HZ3      LYS  24   6.171  -5.774  10.273
  161    H    TYR  25           HN       TYR  25   5.377  -8.827   5.709
  162    HA   TYR  25           HA       TYR  25   2.804  -7.481   6.115
  163   1HB   TYR  25           HB2      TYR  25   5.294  -7.012   4.493
  164   2HB   TYR  25           HB1      TYR  25   3.853  -6.021   4.253
  165    HD1  TYR  25           HD1      TYR  25   2.889  -4.747   6.207
  166    HD2  TYR  25           HD2      TYR  25   6.714  -6.679   6.366
  167    HE1  TYR  25           HE1      TYR  25   3.495  -3.370   8.186
  168    HE2  TYR  25           HE2      TYR  25   7.333  -5.299   8.351
  169    HH   TYR  25           HH       TYR  25   5.418  -3.904  10.270
  170    H    CYS  26           HN       CYS  26   4.414  -9.228   3.426
  171    HA   CYS  26           HA       CYS  26   3.513  -9.937   1.323
  172   1HB   CYS  26           HB2      CYS  26   2.622 -11.581   2.962
  173   2HB   CYS  26           HB1      CYS  26   1.249 -10.522   3.301
  174    H    VAL  27           HN       VAL  27   3.398  -7.365   1.009
  175    HA   VAL  27           HA       VAL  27   0.525  -6.582   0.530
  176    HB   VAL  27           HB       VAL  27   3.046  -4.937   0.952
  177   1HG1  VAL  27          HG11      VAL  27   0.764  -4.212  -0.414
  178   2HG1  VAL  27          HG13      VAL  27   0.412  -3.658   1.222
  179   3HG1  VAL  27          HG12      VAL  27   1.860  -3.088   0.391
  180   1HG2  VAL  27          HG22      VAL  27   2.025  -6.227   2.930
  181   2HG2  VAL  27          HG21      VAL  27   2.223  -4.487   3.140
  182   3HG2  VAL  27          HG23      VAL  27   0.634  -5.155   2.762
  183    H    CYS  28           HN       CYS  28   0.038  -6.766  -1.641
  184    HA   CYS  28           HA       CYS  28   2.302  -6.407  -3.573
  185   1HB   CYS  28           HB2      CYS  28  -0.297  -7.911  -3.908
  186   2HB   CYS  28           HB1      CYS  28   1.149  -8.056  -4.906
  187    H    TYR  29           HN       TYR  29   1.786  -5.580  -5.674
  188    HA   TYR  29           HA       TYR  29  -0.660  -3.930  -5.943
  189   1HB   TYR  29           HB2      TYR  29   2.183  -2.979  -6.147
  190   2HB   TYR  29           HB1      TYR  29   0.764  -2.044  -6.564
  191    HD1  TYR  29           HD1      TYR  29   2.519  -3.740  -3.827
  192    HD2  TYR  29           HD2      TYR  29  -0.492  -0.927  -4.940
  193    HE1  TYR  29           HE1      TYR  29   2.395  -2.964  -1.487
  194    HE2  TYR  29           HE2      TYR  29  -0.644  -0.136  -2.604
  195    HH   TYR  29           HH       TYR  29  -0.139  -0.890  -0.367
  196    H    ASP  30           HN       ASP  30  -0.540  -2.934  -8.304
  197    HA   ASP  30           HA       ASP  30   0.219  -5.082 -10.121
  198   1HB   ASP  30           HB2      ASP  30  -1.047  -3.903 -11.689
  199   2HB   ASP  30           HB1      ASP  30  -1.864  -3.627 -10.154
  200    H    SER  31           HN       SER  31   1.324  -1.753  -9.517
  201    HA   SER  31           HA       SER  31   3.362  -1.926 -11.655
  202   1HB   SER  31           HB2      SER  31   3.243   0.092  -9.470
  203   2HB   SER  31           HB1      SER  31   3.803   0.300 -11.123
  204    HG   SER  31           HG       SER  31   1.815   1.115 -11.209
  205    H    LYS  32           HN       LYS  32   5.237  -3.255 -11.243
  206    HA   LYS  32           HA       LYS  32   5.949  -4.263  -8.698
  207   1HB   LYS  32           HB2      LYS  32   8.031  -4.880  -9.769
  208   2HB   LYS  32           HB1      LYS  32   6.880  -4.760 -11.105
  209   1HG   LYS  32           HG2      LYS  32   7.736  -2.651 -11.800
  210   2HG   LYS  32           HG1      LYS  32   8.627  -2.432 -10.294
  211   1HD   LYS  32           HD2      LYS  32  10.291  -3.128 -11.872
  212   2HD   LYS  32           HD1      LYS  32   9.905  -4.598 -10.961
  213   1HE   LYS  32           HE2      LYS  32   8.253  -5.235 -12.763
  214   2HE   LYS  32           HE1      LYS  32   8.792  -3.828 -13.704
  215   1HZ   LYS  32           HZ2      LYS  32  11.102  -4.676 -13.413
  216   2HZ   LYS  32           HZ1      LYS  32  10.453  -6.104 -12.760
  217   3HZ   LYS  32           HZ3      LYS  32  10.114  -5.677 -14.367
  218    H    ALA  33           HN       ALA  33   6.646  -1.143 -10.226
  219    HA   ALA  33           HA       ALA  33   8.419  -0.043  -8.316
  220   1HB   ALA  33           HB1      ALA  33   7.701   0.829 -10.618
  221   2HB   ALA  33           HB3      ALA  33   6.187   1.328  -9.861
  222   3HB   ALA  33           HB2      ALA  33   7.713   2.052  -9.344
  223    H    ILE  34           HN       ILE  34   4.763  -0.040  -8.470
  224    HA   ILE  34           HA       ILE  34   4.401   1.492  -6.149
  225    HB   ILE  34           HB       ILE  34   2.933  -0.591  -7.639
  226   1HG1  ILE  34          HG12      ILE  34   2.793   2.397  -7.253
  227   2HG1  ILE  34          HG11      ILE  34   2.947   1.490  -8.753
  228   1HG2  ILE  34          HG21      ILE  34   2.344  -0.672  -5.150
  229   2HG2  ILE  34          HG23      ILE  34   1.804   0.994  -5.305
  230   3HG2  ILE  34          HG22      ILE  34   0.993  -0.281  -6.209
  231   1HD1  ILE  34          HD13      ILE  34   0.661   0.509  -8.232
  232   2HD1  ILE  34          HD12      ILE  34   0.535   1.734  -6.969
  233   3HD1  ILE  34          HD11      ILE  34   0.680   2.221  -8.659
  234    H    CYS  35           HN       CYS  35   5.336  -1.730  -6.626
  235    HA   CYS  35           HA       CYS  35   4.799  -2.826  -4.007
  236   1HB   CYS  35           HB2      CYS  35   5.470  -4.263  -5.892
  237   2HB   CYS  35           HB1      CYS  35   7.017  -3.405  -6.026
  238    H    ASN  36           HN       ASN  36   8.016  -1.835  -5.294
  239    HA   ASN  36           HA       ASN  36   9.250  -1.431  -2.740
  240   1HB   ASN  36           HB2      ASN  36   9.628  -0.072  -5.452
  241   2HB   ASN  36           HB1      ASN  36  10.773   0.067  -4.111
  242   1HD2  ASN  36          HD22      ASN  36  12.138  -3.167  -4.585
  243   2HD2  ASN  36          HD21      ASN  36  12.105  -1.778  -3.610
  244    H    LYS  37           HN       LYS  37   7.738   1.020  -4.826
  245    HA   LYS  37           HA       LYS  37   8.031   3.274  -3.176
  246   1HB   LYS  37           HB2      LYS  37   7.499   3.026  -5.636
  247   2HB   LYS  37           HB1      LYS  37   5.834   2.712  -5.154
  248   1HG   LYS  37           HG2      LYS  37   7.307   5.185  -4.230
  249   2HG   LYS  37           HG1      LYS  37   6.441   5.147  -5.765
  250   1HD   LYS  37           HD2      LYS  37   4.524   4.133  -4.162
  251   2HD   LYS  37           HD1      LYS  37   5.376   5.130  -2.986
  252   1HE   LYS  37           HE2      LYS  37   4.869   6.442  -5.606
  253   2HE   LYS  37           HE1      LYS  37   3.429   6.111  -4.622
  254   1HZ   LYS  37           HZ2      LYS  37   4.649   7.050  -2.700
  255   2HZ   LYS  37           HZ1      LYS  37   5.894   7.523  -3.754
  256   3HZ   LYS  37           HZ3      LYS  37   4.343   8.192  -3.919
  257    H    ASN  38           HN       ASN  38   4.739   2.139  -3.929
  258    HA   ASN  38           HA       ASN  38   3.519   3.359  -1.767
  259   1HB   ASN  38           HB2      ASN  38   2.939   1.249  -3.723
  260   2HB   ASN  38           HB1      ASN  38   1.732   1.670  -2.504
  261   1HD2  ASN  38          HD22      ASN  38   2.400   4.101  -5.664
  262   2HD2  ASN  38          HD21      ASN  38   3.232   2.632  -5.455
  263    H    CYS  39           HN       CYS  39   4.906   0.193  -2.045
  264    HA   CYS  39           HA       CYS  39   3.626  -1.174   0.059
  265   1HB   CYS  39           HB2      CYS  39   6.516  -1.103  -0.777
  266   2HB   CYS  39           HB1      CYS  39   5.909  -2.254   0.417
  267    H    THR  40           HN       THR  40   6.008   1.413   0.346
  268    HA   THR  40           HA       THR  40   6.422   1.037   3.217
  269    HB   THR  40           HB       THR  40   7.480   3.385   2.876
  270    HG1  THR  40           HG1      THR  40   6.254   3.834   0.990
  271   1HG2  THR  40          HG23      THR  40   8.335   0.820   1.531
  272   2HG2  THR  40          HG22      THR  40   9.290   2.284   1.289
  273   3HG2  THR  40          HG21      THR  40   9.054   1.645   2.916
   
  No H/Q in entry =         273
  Start of MODEL   21
    1   1H    ASP   1           HT3      ASP   1  11.768   3.485   6.951
    2   2H    ASP   1           HT2      ASP   1  10.436   4.540   6.979
    3   3H    ASP   1           HT1      ASP   1  10.283   2.990   6.298
    4    HA   ASP   1           HA       ASP   1  10.456   4.537   4.497
    5   1HB   ASP   1           HB2      ASP   1  11.528   6.171   6.210
    6   2HB   ASP   1           HB1      ASP   1  13.060   5.441   5.731
    7    H    ASP   2           HN       ASP   2  11.211   1.790   4.994
    8    HA   ASP   2           HA       ASP   2  13.301   1.501   2.907
    9   1HB   ASP   2           HB2      ASP   2  13.552   0.741   5.850
   10   2HB   ASP   2           HB1      ASP   2  14.493  -0.110   4.616
   11    H    GLY   3           HN       GLY   3  13.418  -0.750   2.146
   12   1HA   GLY   3           HA2      GLY   3  12.067  -2.983   3.068
   13   2HA   GLY   3           HA1      GLY   3  10.838  -2.089   2.177
   14    H    LEU   4           HN       LEU   4  11.453  -4.529   1.211
   15    HA   LEU   4           HA       LEU   4  13.064  -3.935  -1.241
   16   1HB   LEU   4           HB2      LEU   4  12.952  -6.590   0.224
   17   2HB   LEU   4           HB1      LEU   4  14.053  -6.116  -1.067
   18    HG   LEU   4           HG       LEU   4  14.000  -4.613   1.552
   19   1HD1  LEU   4          HD11      LEU   4  15.045  -7.313   0.982
   20   2HD1  LEU   4          HD13      LEU   4  16.208  -6.214   1.724
   21   3HD1  LEU   4          HD12      LEU   4  14.674  -6.548   2.528
   22   1HD2  LEU   4          HD22      LEU   4  15.703  -4.756  -0.889
   23   2HD2  LEU   4          HD21      LEU   4  15.348  -3.377   0.153
   24   3HD2  LEU   4          HD23      LEU   4  16.547  -4.571   0.648
   25    H    CYS   5           HN       CYS   5  12.494  -5.920  -2.925
   26    HA   CYS   5           HA       CYS   5   9.601  -6.671  -2.641
   27   1HB   CYS   5           HB2      CYS   5   9.872  -4.436  -3.838
   28   2HB   CYS   5           HB1      CYS   5  10.690  -5.316  -5.127
   29    H    TYR   6           HN       TYR   6   8.997  -8.458  -3.912
   30    HA   TYR   6           HA       TYR   6  11.148  -9.777  -5.509
   31   1HB   TYR   6           HB2      TYR   6  10.999 -11.808  -4.260
   32   2HB   TYR   6           HB1      TYR   6  11.106 -10.525  -3.071
   33    HD1  TYR   6           HD2      TYR   6   9.202  -9.950  -1.678
   34    HD2  TYR   6           HD1      TYR   6   8.969 -13.059  -4.606
   35    HE1  TYR   6           HE2      TYR   6   7.110 -10.775  -0.619
   36    HE2  TYR   6           HE1      TYR   6   6.897 -13.911  -3.547
   37    HH   TYR   6           HH       TYR   6   5.165 -12.108  -1.195
   38    H    GLU   7           HN       GLU   7  10.171 -11.525  -6.937
   39    HA   GLU   7           HA       GLU   7   7.294 -10.855  -7.526
   40   1HB   GLU   7           HB2      GLU   7   7.915 -10.847  -9.816
   41   2HB   GLU   7           HB1      GLU   7   9.240 -10.022  -9.006
   42   1HG   GLU   7           HG2      GLU   7  10.356 -12.373  -8.968
   43   2HG   GLU   7           HG1      GLU   7   9.093 -12.772 -10.148
   44    H    GLY   8           HN       GLY   8   5.992 -12.519  -8.365
   45   1HA   GLY   8           HA2      GLY   8   6.491 -15.031  -9.178
   46   2HA   GLY   8           HA1      GLY   8   6.758 -15.226  -7.449
   47    H    THR   9           HN       THR   9   4.970 -15.997  -6.418
   48    HA   THR   9           HA       THR   9   2.277 -15.002  -7.149
   49    HB   THR   9           HB       THR   9   3.281 -17.833  -7.251
   50    HG1  THR   9           HG1      THR   9   2.298 -16.074  -9.241
   51   1HG2  THR   9          HG22      THR   9   0.504 -16.698  -7.329
   52   2HG2  THR   9          HG21      THR   9   0.873 -18.107  -8.322
   53   3HG2  THR   9          HG23      THR   9   1.083 -18.183  -6.573
   54    H    ASN  10           HN       ASN  10   4.299 -15.331  -4.632
   55    HA   ASN  10           HA       ASN  10   2.940 -17.150  -2.844
   56   1HB   ASN  10           HB2      ASN  10   5.329 -16.436  -2.834
   57   2HB   ASN  10           HB1      ASN  10   4.813 -14.873  -2.201
   58   1HD2  ASN  10          HD22      ASN  10   4.407 -16.141   1.130
   59   2HD2  ASN  10          HD21      ASN  10   4.359 -14.746   0.102
   60    H    CYS  11           HN       CYS  11   2.171 -14.006  -3.760
   61    HA   CYS  11           HA       CYS  11   0.314 -13.766  -1.419
   62   1HB   CYS  11           HB2      CYS  11   2.002 -11.741  -2.881
   63   2HB   CYS  11           HB1      CYS  11   0.577 -11.221  -1.969
   64    H    GLY  12           HN       GLY  12   0.112 -14.931  -4.165
   65   1HA   GLY  12           HA2      GLY  12  -1.729 -15.083  -5.641
   66   2HA   GLY  12           HA1      GLY  12  -2.518 -13.860  -4.635
   67    H    LYS  13           HN       LYS  13   0.620 -13.014  -5.668
   68    HA   LYS  13           HA       LYS  13  -0.455 -10.852  -7.283
   69   1HB   LYS  13           HB2      LYS  13   1.696  -9.932  -7.015
   70   2HB   LYS  13           HB1      LYS  13   1.318 -10.795  -5.538
   71   1HG   LYS  13           HG2      LYS  13   2.547 -12.800  -6.579
   72   2HG   LYS  13           HG1      LYS  13   3.170 -11.641  -7.746
   73   1HD   LYS  13           HD2      LYS  13   4.200 -10.343  -6.009
   74   2HD   LYS  13           HD1      LYS  13   3.414 -11.303  -4.760
   75   1HE   LYS  13           HE2      LYS  13   4.959 -12.937  -6.632
   76   2HE   LYS  13           HE1      LYS  13   5.954 -11.774  -5.738
   77   1HZ   LYS  13           HZ3      LYS  13   3.873 -13.450  -4.461
   78   2HZ   LYS  13           HZ2      LYS  13   5.503 -13.913  -4.545
   79   3HZ   LYS  13           HZ1      LYS  13   5.057 -12.512  -3.695
   80    H    VAL  14           HN       VAL  14  -1.052 -13.077  -8.563
   81    HA   VAL  14           HA       VAL  14   0.891 -14.006 -10.508
   82    HB   VAL  14           HB       VAL  14  -2.138 -13.972 -10.322
   83   1HG1  VAL  14          HG13      VAL  14  -1.453 -14.061 -12.708
   84   2HG1  VAL  14          HG12      VAL  14  -0.429 -15.453 -12.352
   85   3HG1  VAL  14          HG11      VAL  14  -2.180 -15.581 -12.184
   86   1HG2  VAL  14          HG22      VAL  14  -0.023 -15.705  -9.302
   87   2HG2  VAL  14          HG21      VAL  14  -1.737 -15.674  -8.895
   88   3HG2  VAL  14          HG23      VAL  14  -1.178 -16.604 -10.286
   89    H    GLY  15           HN       GLY  15   1.836 -12.463 -11.872
   90   1HA   GLY  15           HA2      GLY  15   1.558 -11.143 -13.931
   91   2HA   GLY  15           HA1      GLY  15  -0.077 -10.731 -13.406
   92    H    LYS  16           HN       LYS  16   1.118 -10.213 -10.572
   93    HA   LYS  16           HA       LYS  16   2.318  -7.544 -11.239
   94   1HB   LYS  16           HB2      LYS  16   0.505  -8.248  -8.939
   95   2HB   LYS  16           HB1      LYS  16   1.094  -6.650  -9.378
   96   1HG   LYS  16           HG2      LYS  16  -0.087  -6.790 -11.537
   97   2HG   LYS  16           HG1      LYS  16  -0.719  -8.373 -11.087
   98   1HD   LYS  16           HD2      LYS  16  -1.195  -6.308  -9.046
   99   2HD   LYS  16           HD1      LYS  16  -1.974  -5.961 -10.591
  100   1HE   LYS  16           HE2      LYS  16  -2.193  -8.749  -9.500
  101   2HE   LYS  16           HE1      LYS  16  -3.211  -7.477  -8.797
  102   1HZ   LYS  16           HZ2      LYS  16  -2.924  -7.964 -11.713
  103   2HZ   LYS  16           HZ1      LYS  16  -4.216  -8.549 -10.778
  104   3HZ   LYS  16           HZ3      LYS  16  -3.992  -6.878 -10.961
  105    H    TYR  17           HN       TYR  17   2.760  -7.168  -8.162
  106    HA   TYR  17           HA       TYR  17   4.735  -9.362  -7.710
  107   1HB   TYR  17           HB2      TYR  17   5.533  -6.442  -7.620
  108   2HB   TYR  17           HB1      TYR  17   6.552  -7.891  -7.571
  109    HD1  TYR  17           HD1      TYR  17   4.402  -5.838  -9.833
  110    HD2  TYR  17           HD2      TYR  17   7.152  -9.083  -9.458
  111    HE1  TYR  17           HE1      TYR  17   4.650  -5.923 -12.302
  112    HE2  TYR  17           HE2      TYR  17   7.418  -9.180 -11.896
  113    HH   TYR  17           HH       TYR  17   6.662  -6.816 -13.917
  114    H    CYS  18           HN       CYS  18   5.889  -8.829  -5.345
  115    HA   CYS  18           HA       CYS  18   3.819  -7.589  -3.565
  116   1HB   CYS  18           HB2      CYS  18   5.108 -10.341  -3.438
  117   2HB   CYS  18           HB1      CYS  18   4.204  -9.638  -2.093
  118    H    CYS  19           HN       CYS  19   4.719  -7.069  -1.413
  119    HA   CYS  19           HA       CYS  19   7.677  -6.914  -1.350
  120   1HB   CYS  19           HB2      CYS  19   7.201  -4.548  -0.341
  121   2HB   CYS  19           HB1      CYS  19   7.037  -4.777  -2.084
  122    H    SER  20           HN       SER  20   8.490  -7.678   0.543
  123    HA   SER  20           HA       SER  20   7.260  -7.181   3.138
  124   1HB   SER  20           HB2      SER  20   7.006  -9.747   3.541
  125   2HB   SER  20           HB1      SER  20   5.795  -8.986   2.510
  126    HG   SER  20           HG       SER  20   7.963 -10.635   1.827
  127    HA   PRO  21           HA       PRO  21  11.636  -7.763   3.554
  128   1HB   PRO  21           HB2      PRO  21  11.909  -6.915   6.146
  129   2HB   PRO  21           HB1      PRO  21  11.708  -5.811   4.769
  130   1HG   PRO  21           HG2      PRO  21   9.697  -6.651   6.805
  131   2HG   PRO  21           HG1      PRO  21   9.863  -5.117   5.924
  132   1HD   PRO  21           HD2      PRO  21   8.058  -7.185   5.355
  133   2HD   PRO  21           HD1      PRO  21   8.481  -5.844   4.263
  134    H    ILE  22           HN       ILE  22   9.214  -9.475   5.119
  135    HA   ILE  22           HA       ILE  22  11.001 -11.724   5.624
  136    HB   ILE  22           HB       ILE  22  11.290 -10.072   7.544
  137   1HG1  ILE  22          HG12      ILE  22  10.193 -12.838   8.209
  138   2HG1  ILE  22          HG11      ILE  22  11.888 -12.422   7.952
  139   1HG2  ILE  22          HG23      ILE  22   8.540  -9.996   7.351
  140   2HG2  ILE  22          HG22      ILE  22   8.813 -10.928   8.823
  141   3HG2  ILE  22          HG21      ILE  22   9.501  -9.314   8.662
  142   1HD1  ILE  22          HD12      ILE  22  10.884 -10.657   9.955
  143   2HD1  ILE  22          HD11      ILE  22  10.376 -12.290  10.386
  144   3HD1  ILE  22          HD13      ILE  22  12.085 -11.935  10.138
  145    H    GLY  23           HN       GLY  23   8.347 -10.778   4.504
  146   1HA   GLY  23           HA2      GLY  23   6.378 -11.950   3.823
  147   2HA   GLY  23           HA1      GLY  23   6.956 -13.301   4.788
  148    H    LYS  24           HN       LYS  24   7.001 -10.468   6.587
  149    HA   LYS  24           HA       LYS  24   4.650 -11.371   8.091
  150   1HB   LYS  24           HB2      LYS  24   5.487 -10.040   9.859
  151   2HB   LYS  24           HB1      LYS  24   6.893 -10.771   9.094
  152   1HG   LYS  24           HG2      LYS  24   7.158  -8.675   7.730
  153   2HG   LYS  24           HG1      LYS  24   5.852  -7.967   8.679
  154   1HD   LYS  24           HD2      LYS  24   8.067  -9.208  10.216
  155   2HD   LYS  24           HD1      LYS  24   8.443  -7.706   9.372
  156   1HE   LYS  24           HE2      LYS  24   7.199  -6.464  10.819
  157   2HE   LYS  24           HE1      LYS  24   5.861  -7.630  10.791
  158   1HZ   LYS  24           HZ3      LYS  24   8.442  -8.129  12.167
  159   2HZ   LYS  24           HZ2      LYS  24   7.070  -7.511  12.956
  160   3HZ   LYS  24           HZ1      LYS  24   7.029  -9.061  12.262
  161    H    TYR  25           HN       TYR  25   4.579  -9.843   5.405
  162    HA   TYR  25           HA       TYR  25   2.450  -7.950   6.232
  163   1HB   TYR  25           HB2      TYR  25   5.002  -7.288   4.767
  164   2HB   TYR  25           HB1      TYR  25   3.559  -6.293   4.582
  165    HD1  TYR  25           HD1      TYR  25   2.437  -5.448   6.811
  166    HD2  TYR  25           HD2      TYR  25   6.468  -6.884   6.501
  167    HE1  TYR  25           HE1      TYR  25   3.014  -4.266   8.916
  168    HE2  TYR  25           HE2      TYR  25   7.054  -5.698   8.611
  169    HH   TYR  25           HH       TYR  25   6.171  -3.710   9.900
  170    H    CYS  26           HN       CYS  26   4.237  -9.460   3.529
  171    HA   CYS  26           HA       CYS  26   3.495  -9.970   1.306
  172   1HB   CYS  26           HB2      CYS  26   2.555 -11.800   2.633
  173   2HB   CYS  26           HB1      CYS  26   1.200 -10.790   3.154
  174    H    VAL  27           HN       VAL  27   3.326  -7.445   0.977
  175    HA   VAL  27           HA       VAL  27   0.447  -6.674   0.507
  176    HB   VAL  27           HB       VAL  27   2.952  -5.000   0.921
  177   1HG1  VAL  27          HG11      VAL  27   0.624  -4.313  -0.392
  178   2HG1  VAL  27          HG13      VAL  27   0.312  -3.759   1.252
  179   3HG1  VAL  27          HG12      VAL  27   1.729  -3.174   0.378
  180   1HG2  VAL  27          HG21      VAL  27   0.926  -6.142   2.748
  181   2HG2  VAL  27          HG23      VAL  27   2.565  -5.589   3.088
  182   3HG2  VAL  27          HG22      VAL  27   1.246  -4.424   2.984
  183    H    CYS  28           HN       CYS  28  -0.025  -6.861  -1.671
  184    HA   CYS  28           HA       CYS  28   2.249  -6.473  -3.585
  185   1HB   CYS  28           HB2      CYS  28  -0.331  -8.005  -3.941
  186   2HB   CYS  28           HB1      CYS  28   1.122  -8.134  -4.930
  187    H    TYR  29           HN       TYR  29   1.752  -5.649  -5.690
  188    HA   TYR  29           HA       TYR  29  -0.705  -4.021  -5.987
  189   1HB   TYR  29           HB2      TYR  29   2.131  -3.039  -6.151
  190   2HB   TYR  29           HB1      TYR  29   0.706  -2.115  -6.575
  191    HD1  TYR  29           HD1      TYR  29   2.459  -3.809  -3.837
  192    HD2  TYR  29           HD2      TYR  29  -0.579  -1.028  -4.954
  193    HE1  TYR  29           HE1      TYR  29   2.306  -3.052  -1.491
  194    HE2  TYR  29           HE2      TYR  29  -0.760  -0.255  -2.614
  195    HH   TYR  29           HH       TYR  29  -0.166  -1.511  -0.213
  196    H    ASP  30           HN       ASP  30  -0.540  -2.990  -8.335
  197    HA   ASP  30           HA       ASP  30   0.254  -5.114 -10.165
  198   1HB   ASP  30           HB2      ASP  30  -0.998  -3.930 -11.735
  199   2HB   ASP  30           HB1      ASP  30  -1.836  -3.665 -10.210
  200    H    SER  31           HN       SER  31   1.322  -1.783  -9.521
  201    HA   SER  31           HA       SER  31   3.406  -1.939 -11.616
  202   1HB   SER  31           HB2      SER  31   3.214   0.085  -9.442
  203   2HB   SER  31           HB1      SER  31   3.809   0.295 -11.081
  204    HG   SER  31           HG       SER  31   1.823   0.464 -11.799
  205    H    LYS  32           HN       LYS  32   5.286  -3.250 -11.155
  206    HA   LYS  32           HA       LYS  32   5.960  -4.223  -8.582
  207   1HB   LYS  32           HB2      LYS  32   8.069  -4.830  -9.607
  208   2HB   LYS  32           HB1      LYS  32   6.938  -4.746 -10.964
  209   1HG   LYS  32           HG2      LYS  32   7.800  -2.676 -11.711
  210   2HG   LYS  32           HG1      LYS  32   8.610  -2.359 -10.177
  211   1HD   LYS  32           HD2      LYS  32  10.380  -3.071 -11.608
  212   2HD   LYS  32           HD1      LYS  32   9.967  -4.534 -10.701
  213   1HE   LYS  32           HE2      LYS  32   8.681  -5.429 -12.553
  214   2HE   LYS  32           HE1      LYS  32   8.729  -3.874 -13.413
  215   1HZ   LYS  32           HZ1      LYS  32  11.176  -4.042 -13.408
  216   2HZ   LYS  32           HZ3      LYS  32  11.060  -5.590 -12.728
  217   3HZ   LYS  32           HZ2      LYS  32  10.440  -5.299 -14.283
  218    H    ALA  33           HN       ALA  33   6.631  -1.107 -10.135
  219    HA   ALA  33           HA       ALA  33   8.362   0.051  -8.227
  220   1HB   ALA  33           HB3      ALA  33   7.657   0.900 -10.529
  221   2HB   ALA  33           HB2      ALA  33   6.105   1.338  -9.810
  222   3HB   ALA  33           HB1      ALA  33   7.586   2.128  -9.261
  223    H    ILE  34           HN       ILE  34   4.711  -0.022  -8.411
  224    HA   ILE  34           HA       ILE  34   4.280   1.500  -6.097
  225    HB   ILE  34           HB       ILE  34   2.887  -0.618  -7.607
  226   1HG1  ILE  34          HG12      ILE  34   2.671   2.365  -7.221
  227   2HG1  ILE  34          HG11      ILE  34   2.865   1.463  -8.719
  228   1HG2  ILE  34          HG22      ILE  34   2.268  -0.710  -5.120
  229   2HG2  ILE  34          HG21      ILE  34   1.669   0.935  -5.298
  230   3HG2  ILE  34          HG23      ILE  34   0.924  -0.375  -6.207
  231   1HD1  ILE  34          HD11      ILE  34   0.592   0.432  -8.227
  232   2HD1  ILE  34          HD13      ILE  34   0.424   1.653  -6.968
  233   3HD1  ILE  34          HD12      ILE  34   0.582   2.143  -8.656
  234    H    CYS  35           HN       CYS  35   5.319  -1.696  -6.556
  235    HA   CYS  35           HA       CYS  35   4.776  -2.808  -3.946
  236   1HB   CYS  35           HB2      CYS  35   5.554  -4.208  -5.834
  237   2HB   CYS  35           HB1      CYS  35   7.081  -3.306  -5.890
  238    H    ASN  36           HN       ASN  36   7.936  -1.605  -5.198
  239    HA   ASN  36           HA       ASN  36   9.132  -1.178  -2.619
  240   1HB   ASN  36           HB2      ASN  36  10.383  -1.129  -4.740
  241   2HB   ASN  36           HB1      ASN  36   9.463   0.279  -5.291
  242   1HD2  ASN  36          HD22      ASN  36  12.575   0.763  -2.695
  243   2HD2  ASN  36          HD21      ASN  36  12.051  -0.791  -3.135
  244    H    LYS  37           HN       LYS  37   7.524   1.242  -4.680
  245    HA   LYS  37           HA       LYS  37   7.644   3.448  -2.946
  246   1HB   LYS  37           HB2      LYS  37   7.191   3.272  -5.422
  247   2HB   LYS  37           HB1      LYS  37   5.537   2.834  -5.004
  248   1HG   LYS  37           HG2      LYS  37   6.820   5.354  -3.937
  249   2HG   LYS  37           HG1      LYS  37   6.000   5.327  -5.497
  250   1HD   LYS  37           HD2      LYS  37   4.069   4.177  -4.083
  251   2HD   LYS  37           HD1      LYS  37   4.855   5.012  -2.747
  252   1HE   LYS  37           HE2      LYS  37   4.074   6.436  -5.315
  253   2HE   LYS  37           HE1      LYS  37   3.006   6.345  -3.900
  254   1HZ   LYS  37           HZ1      LYS  37   5.827   7.267  -3.781
  255   2HZ   LYS  37           HZ3      LYS  37   4.502   8.319  -3.908
  256   3HZ   LYS  37           HZ2      LYS  37   4.672   7.331  -2.537
  257    H    ASN  38           HN       ASN  38   4.445   2.149  -3.826
  258    HA   ASN  38           HA       ASN  38   3.080   3.240  -1.686
  259   1HB   ASN  38           HB2      ASN  38   2.713   1.111  -3.675
  260   2HB   ASN  38           HB1      ASN  38   1.443   1.434  -2.490
  261   1HD2  ASN  38          HD22      ASN  38   2.020   3.925  -5.618
  262   2HD2  ASN  38          HD21      ASN  38   2.948   2.518  -5.392
  263    H    CYS  39           HN       CYS  39   4.674   0.170  -1.974
  264    HA   CYS  39           HA       CYS  39   3.434  -1.292   0.096
  265   1HB   CYS  39           HB2      CYS  39   6.332  -1.074  -0.692
  266   2HB   CYS  39           HB1      CYS  39   5.739  -2.299   0.436
  267    H    THR  40           HN       THR  40   5.546   1.488   0.443
  268    HA   THR  40           HA       THR  40   6.110   1.057   3.277
  269    HB   THR  40           HB       THR  40   6.873   3.503   3.039
  270    HG1  THR  40           HG1      THR  40   6.621   3.105   0.284
  271   1HG2  THR  40          HG23      THR  40   7.933   1.103   1.626
  272   2HG2  THR  40          HG22      THR  40   8.578   2.652   1.077
  273   3HG2  THR  40          HG21      THR  40   8.735   2.184   2.770
   
  No H/Q in entry =         273
  Start of MODEL   22
    1   1H    ASP   1           HT2      ASP   1   9.943   1.900   7.843
    2   2H    ASP   1           HT1      ASP   1  10.697   3.423   7.815
    3   3H    ASP   1           HT3      ASP   1   9.018   3.306   7.613
    4    HA   ASP   1           HA       ASP   1   9.213   2.361   5.473
    5   1HB   ASP   1           HB2      ASP   1   9.685   4.828   5.879
    6   2HB   ASP   1           HB1      ASP   1  11.401   4.431   5.782
    7    H    ASP   2           HN       ASP   2  10.160   0.185   5.760
    8    HA   ASP   2           HA       ASP   2  12.895   0.025   4.619
    9   1HB   ASP   2           HB2      ASP   2  12.044  -0.807   7.424
   10   2HB   ASP   2           HB1      ASP   2  13.417  -1.596   6.631
   11    H    GLY   3           HN       GLY   3  13.014  -1.734   3.274
   12   1HA   GLY   3           HA2      GLY   3  12.093  -4.318   3.632
   13   2HA   GLY   3           HA1      GLY   3  10.709  -3.475   2.938
   14    H    LEU   4           HN       LEU   4  11.407  -5.308   1.293
   15    HA   LEU   4           HA       LEU   4  13.107  -3.998  -0.794
   16   1HB   LEU   4           HB2      LEU   4  12.996  -6.979  -0.250
   17   2HB   LEU   4           HB1      LEU   4  14.153  -6.100  -1.244
   18    HG   LEU   4           HG       LEU   4  13.914  -5.551   1.717
   19   1HD1  LEU   4          HD11      LEU   4  15.206  -7.837   0.304
   20   2HD1  LEU   4          HD13      LEU   4  16.104  -7.085   1.622
   21   3HD1  LEU   4          HD12      LEU   4  14.505  -7.766   1.921
   22   1HD2  LEU   4          HD21      LEU   4  15.716  -4.822  -0.527
   23   2HD2  LEU   4          HD23      LEU   4  15.322  -3.919   0.936
   24   3HD2  LEU   4          HD22      LEU   4  16.516  -5.214   0.994
   25    H    CYS   5           HN       CYS   5  12.649  -5.403  -3.008
   26    HA   CYS   5           HA       CYS   5   9.721  -6.124  -3.090
   27   1HB   CYS   5           HB2      CYS   5  10.056  -3.734  -3.782
   28   2HB   CYS   5           HB1      CYS   5  11.116  -4.285  -5.078
   29    H    TYR   6           HN       TYR   6   9.320  -7.861  -4.300
   30    HA   TYR   6           HA       TYR   6  11.412  -8.854  -6.210
   31   1HB   TYR   6           HB2      TYR   6  11.159 -11.085  -5.184
   32   2HB   TYR   6           HB1      TYR   6  11.644  -9.912  -3.969
   33    HD1  TYR   6           HD1      TYR   6   8.747 -11.699  -5.410
   34    HD2  TYR   6           HD2      TYR   6  10.283  -9.491  -2.087
   35    HE1  TYR   6           HE1      TYR   6   6.730 -12.287  -4.105
   36    HE2  TYR   6           HE2      TYR   6   8.263 -10.073  -0.755
   37    HH   TYR   6           HH       TYR   6   6.519 -11.750  -0.718
   38    H    GLU   7           HN       GLU   7  10.355 -10.621  -7.666
   39    HA   GLU   7           HA       GLU   7   7.449  -9.947  -8.011
   40   1HB   GLU   7           HB2      GLU   7   7.861  -9.886 -10.345
   41   2HB   GLU   7           HB1      GLU   7   9.249  -9.065  -9.645
   42   1HG   GLU   7           HG2      GLU   7  10.376 -11.405  -9.745
   43   2HG   GLU   7           HG1      GLU   7   9.012 -11.798 -10.810
   44    H    GLY   8           HN       GLY   8   6.059 -11.617  -8.516
   45   1HA   GLY   8           HA2      GLY   8   6.429 -14.084  -9.505
   46   2HA   GLY   8           HA1      GLY   8   7.029 -14.327  -7.869
   47    H    THR   9           HN       THR   9   5.484 -15.083  -6.472
   48    HA   THR   9           HA       THR   9   2.693 -14.137  -6.662
   49    HB   THR   9           HB       THR   9   3.729 -16.923  -7.150
   50    HG1  THR   9           HG1      THR   9   3.126 -16.572  -9.176
   51   1HG2  THR   9          HG21      THR   9   0.920 -15.958  -6.626
   52   2HG2  THR   9          HG23      THR   9   1.216 -17.386  -7.613
   53   3HG2  THR   9          HG22      THR   9   1.751 -17.353  -5.939
   54    H    ASN  10           HN       ASN  10   4.945 -14.173  -4.534
   55    HA   ASN  10           HA       ASN  10   4.426 -16.303  -2.672
   56   1HB   ASN  10           HB2      ASN  10   6.456 -14.909  -2.850
   57   2HB   ASN  10           HB1      ASN  10   5.559 -13.549  -2.171
   58   1HD2  ASN  10          HD22      ASN  10   5.861 -14.769   1.184
   59   2HD2  ASN  10          HD21      ASN  10   5.293 -13.492   0.160
   60    H    CYS  11           HN       CYS  11   2.499 -13.689  -3.412
   61    HA   CYS  11           HA       CYS  11   1.019 -13.999  -0.829
   62   1HB   CYS  11           HB2      CYS  11   1.574 -11.600  -2.575
   63   2HB   CYS  11           HB1      CYS  11   0.202 -11.593  -1.459
   64    H    GLY  12           HN       GLY  12   0.968 -15.379  -3.476
   65   1HA   GLY  12           HA2      GLY  12  -0.803 -16.430  -4.618
   66   2HA   GLY  12           HA1      GLY  12  -1.908 -15.483  -3.619
   67    H    LYS  13           HN       LYS  13   0.318 -13.423  -4.988
   68    HA   LYS  13           HA       LYS  13  -1.646 -12.426  -6.898
   69   1HB   LYS  13           HB2      LYS  13  -0.439 -10.429  -6.721
   70   2HB   LYS  13           HB1      LYS  13  -0.566 -11.154  -5.134
   71   1HG   LYS  13           HG2      LYS  13   1.733 -12.020  -5.304
   72   2HG   LYS  13           HG1      LYS  13   1.861 -11.333  -6.921
   73   1HD   LYS  13           HD2      LYS  13   1.392  -9.809  -4.363
   74   2HD   LYS  13           HD1      LYS  13   2.876  -9.812  -5.320
   75   1HE   LYS  13           HE2      LYS  13   1.874  -7.907  -6.217
   76   2HE   LYS  13           HE1      LYS  13   1.142  -9.127  -7.255
   77   1HZ   LYS  13           HZ3      LYS  13  -0.313  -9.041  -4.865
   78   2HZ   LYS  13           HZ2      LYS  13  -0.131  -7.441  -5.405
   79   3HZ   LYS  13           HZ1      LYS  13  -0.836  -8.605  -6.419
   80    H    VAL  14           HN       VAL  14  -1.153 -14.346  -8.234
   81    HA   VAL  14           HA       VAL  14   1.301 -14.598  -9.737
   82    HB   VAL  14           HB       VAL  14  -1.604 -15.356 -10.173
   83   1HG1  VAL  14          HG12      VAL  14   0.645 -15.489 -12.087
   84   2HG1  VAL  14          HG11      VAL  14  -0.231 -17.004 -11.882
   85   3HG1  VAL  14          HG13      VAL  14  -1.091 -15.549 -12.384
   86   1HG2  VAL  14          HG22      VAL  14  -0.334 -16.539  -8.382
   87   2HG2  VAL  14          HG21      VAL  14  -0.841 -17.619  -9.680
   88   3HG2  VAL  14          HG23      VAL  14   0.833 -17.069  -9.595
   89    H    GLY  15           HN       GLY  15   2.093 -12.939 -11.078
   90   1HA   GLY  15           HA2      GLY  15   1.726 -11.769 -13.232
   91   2HA   GLY  15           HA1      GLY  15   0.034 -11.561 -12.785
   92    H    LYS  16           HN       LYS  16   0.939 -10.646  -9.920
   93    HA   LYS  16           HA       LYS  16   1.782  -7.913 -10.870
   94   1HB   LYS  16           HB2      LYS  16   0.265  -8.663  -8.386
   95   2HB   LYS  16           HB1      LYS  16   0.648  -7.031  -8.921
   96   1HG   LYS  16           HG2      LYS  16  -0.612  -7.510 -11.043
   97   2HG   LYS  16           HG1      LYS  16  -1.150  -9.027 -10.318
   98   1HD   LYS  16           HD2      LYS  16  -1.825  -7.370  -8.311
   99   2HD   LYS  16           HD1      LYS  16  -1.928  -6.226  -9.649
  100   1HE   LYS  16           HE2      LYS  16  -3.824  -7.188 -10.458
  101   2HE   LYS  16           HE1      LYS  16  -3.172  -8.826 -10.255
  102   1HZ   LYS  16           HZ3      LYS  16  -3.873  -7.208  -7.890
  103   2HZ   LYS  16           HZ2      LYS  16  -5.086  -8.056  -8.722
  104   3HZ   LYS  16           HZ1      LYS  16  -3.776  -8.895  -8.041
  105    H    TYR  17           HN       TYR  17   2.485  -7.214  -7.861
  106    HA   TYR  17           HA       TYR  17   4.890  -8.975  -7.602
  107   1HB   TYR  17           HB2      TYR  17   5.119  -5.966  -7.677
  108   2HB   TYR  17           HB1      TYR  17   6.385  -7.196  -7.792
  109    HD1  TYR  17           HD1      TYR  17   3.552  -5.650  -9.681
  110    HD2  TYR  17           HD2      TYR  17   6.891  -8.312  -9.758
  111    HE1  TYR  17           HE1      TYR  17   3.359  -5.833 -12.152
  112    HE2  TYR  17           HE2      TYR  17   6.736  -8.491 -12.199
  113    HH   TYR  17           HH       TYR  17   4.640  -6.420 -14.054
  114    H    CYS  18           HN       CYS  18   6.163  -8.364  -5.397
  115    HA   CYS  18           HA       CYS  18   4.199  -7.193  -3.441
  116   1HB   CYS  18           HB2      CYS  18   5.601  -9.878  -3.467
  117   2HB   CYS  18           HB1      CYS  18   4.995  -9.178  -1.965
  118    H    CYS  19           HN       CYS  19   5.170  -6.578  -1.400
  119    HA   CYS  19           HA       CYS  19   8.106  -6.188  -1.419
  120   1HB   CYS  19           HB2      CYS  19   7.488  -3.846  -0.446
  121   2HB   CYS  19           HB1      CYS  19   7.300  -4.108  -2.180
  122    H    SER  20           HN       SER  20   8.604  -7.558   0.283
  123    HA   SER  20           HA       SER  20   7.915  -6.779   2.986
  124   1HB   SER  20           HB2      SER  20   6.761  -9.111   3.399
  125   2HB   SER  20           HB1      SER  20   5.814  -7.836   2.624
  126    HG   SER  20           HG       SER  20   5.708  -9.043   0.915
  127    HA   PRO  21           HA       PRO  21  11.679  -9.073   3.215
  128   1HB   PRO  21           HB2      PRO  21  12.097  -8.996   5.923
  129   2HB   PRO  21           HB1      PRO  21  12.350  -7.597   4.863
  130   1HG   PRO  21           HG2      PRO  21  10.073  -8.163   6.702
  131   2HG   PRO  21           HG1      PRO  21  10.804  -6.615   6.228
  132   1HD   PRO  21           HD2      PRO  21   8.431  -7.708   5.227
  133   2HD   PRO  21           HD1      PRO  21   9.362  -6.386   4.480
  134    H    ILE  22           HN       ILE  22   8.739 -10.039   4.450
  135    HA   ILE  22           HA       ILE  22   9.371 -12.884   4.315
  136    HB   ILE  22           HB       ILE  22  10.243 -11.893   6.569
  137   1HG1  ILE  22          HG12      ILE  22   8.304 -14.246   6.637
  138   2HG1  ILE  22          HG11      ILE  22  10.020 -14.342   6.247
  139   1HG2  ILE  22          HG23      ILE  22   7.781 -10.818   6.688
  140   2HG2  ILE  22          HG22      ILE  22   7.525 -12.272   7.648
  141   3HG2  ILE  22          HG21      ILE  22   8.778 -11.119   8.109
  142   1HD1  ILE  22          HD12      ILE  22   9.569 -12.969   8.783
  143   2HD1  ILE  22          HD11      ILE  22   8.891 -14.598   8.786
  144   3HD1  ILE  22          HD13      ILE  22  10.601 -14.354   8.427
  145    H    GLY  23           HN       GLY  23   7.174 -13.913   5.566
  146   1HA   GLY  23           HA2      GLY  23   5.001 -12.895   3.860
  147   2HA   GLY  23           HA1      GLY  23   4.940 -14.352   4.844
  148    H    LYS  24           HN       LYS  24   6.028 -11.656   6.596
  149    HA   LYS  24           HA       LYS  24   3.539 -11.662   8.123
  150   1HB   LYS  24           HB2      LYS  24   4.743 -10.417   9.744
  151   2HB   LYS  24           HB1      LYS  24   5.880 -11.582   9.076
  152   1HG   LYS  24           HG2      LYS  24   6.654  -9.777   7.484
  153   2HG   LYS  24           HG1      LYS  24   5.649  -8.643   8.381
  154   1HD   LYS  24           HD2      LYS  24   7.840 -10.333   9.620
  155   2HD   LYS  24           HD1      LYS  24   8.024  -8.640   9.158
  156   1HE   LYS  24           HE2      LYS  24   6.114  -8.063  10.685
  157   2HE   LYS  24           HE1      LYS  24   6.098  -9.752  11.228
  158   1HZ   LYS  24           HZ2      LYS  24   8.567  -8.113  11.214
  159   2HZ   LYS  24           HZ1      LYS  24   7.536  -8.176  12.562
  160   3HZ   LYS  24           HZ3      LYS  24   8.294  -9.589  12.011
  161    H    TYR  25           HN       TYR  25   5.330  -9.292   6.153
  162    HA   TYR  25           HA       TYR  25   3.210  -7.281   6.468
  163   1HB   TYR  25           HB2      TYR  25   5.870  -7.453   5.066
  164   2HB   TYR  25           HB1      TYR  25   4.778  -6.099   4.778
  165    HD1  TYR  25           HD1      TYR  25   3.937  -4.782   6.846
  166    HD2  TYR  25           HD2      TYR  25   7.280  -7.466   6.930
  167    HE1  TYR  25           HE1      TYR  25   4.749  -3.696   8.928
  168    HE2  TYR  25           HE2      TYR  25   8.103  -6.383   9.022
  169    HH   TYR  25           HH       TYR  25   7.188  -5.054  10.875
  170    H    CYS  26           HN       CYS  26   4.668  -9.071   3.727
  171    HA   CYS  26           HA       CYS  26   3.841  -9.369   1.507
  172   1HB   CYS  26           HB2      CYS  26   2.662 -11.131   2.746
  173   2HB   CYS  26           HB1      CYS  26   1.445  -9.978   3.312
  174    H    VAL  27           HN       VAL  27   3.994  -6.854   1.171
  175    HA   VAL  27           HA       VAL  27   1.211  -5.705   0.929
  176    HB   VAL  27           HB       VAL  27   3.933  -4.356   1.060
  177   1HG1  VAL  27          HG11      VAL  27   1.742  -3.368  -0.115
  178   2HG1  VAL  27          HG13      VAL  27   1.338  -2.968   1.554
  179   3HG1  VAL  27          HG12      VAL  27   2.824  -2.345   0.835
  180   1HG2  VAL  27          HG23      VAL  27   1.845  -5.011   3.123
  181   2HG2  VAL  27          HG22      VAL  27   3.600  -5.133   3.242
  182   3HG2  VAL  27          HG21      VAL  27   2.821  -3.553   3.303
  183    H    CYS  28           HN       CYS  28   0.643  -6.265  -1.124
  184    HA   CYS  28           HA       CYS  28   2.689  -5.934  -3.287
  185   1HB   CYS  28           HB2      CYS  28   0.171  -7.606  -3.194
  186   2HB   CYS  28           HB1      CYS  28   1.493  -7.746  -4.338
  187    H    TYR  29           HN       TYR  29   1.898  -5.378  -5.407
  188    HA   TYR  29           HA       TYR  29  -0.652  -3.889  -5.582
  189   1HB   TYR  29           HB2      TYR  29   2.095  -2.815  -6.156
  190   2HB   TYR  29           HB1      TYR  29   0.587  -1.996  -6.499
  191    HD1  TYR  29           HD1      TYR  29   2.715  -3.342  -3.828
  192    HD2  TYR  29           HD2      TYR  29  -0.564  -0.803  -4.848
  193    HE1  TYR  29           HE1      TYR  29   2.786  -2.358  -1.562
  194    HE2  TYR  29           HE2      TYR  29  -0.523   0.191  -2.585
  195    HH   TYR  29           HH       TYR  29   0.294  -0.128  -0.440
  196    H    ASP  30           HN       ASP  30  -0.756  -3.077  -8.039
  197    HA   ASP  30           HA       ASP  30  -0.079  -5.368  -9.716
  198   1HB   ASP  30           HB2      ASP  30  -1.522  -4.380 -11.264
  199   2HB   ASP  30           HB1      ASP  30  -2.214  -3.985  -9.692
  200    H    SER  31           HN       SER  31   0.931  -1.954  -9.513
  201    HA   SER  31           HA       SER  31   2.800  -2.244 -11.790
  202   1HB   SER  31           HB2      SER  31   2.762  -0.041  -9.788
  203   2HB   SER  31           HB1      SER  31   3.178   0.038 -11.493
  204    HG   SER  31           HG       SER  31   1.108   0.019 -12.021
  205    H    LYS  32           HN       LYS  32   4.825  -3.361 -11.462
  206    HA   LYS  32           HA       LYS  32   5.754  -4.175  -8.924
  207   1HB   LYS  32           HB2      LYS  32   7.806  -4.720 -10.086
  208   2HB   LYS  32           HB1      LYS  32   6.577  -4.745 -11.356
  209   1HG   LYS  32           HG2      LYS  32   7.282  -2.671 -12.249
  210   2HG   LYS  32           HG1      LYS  32   8.166  -2.239 -10.785
  211   1HD   LYS  32           HD2      LYS  32   9.890  -2.924 -12.275
  212   2HD   LYS  32           HD1      LYS  32   9.599  -4.372 -11.298
  213   1HE   LYS  32           HE2      LYS  32   8.049  -5.239 -13.072
  214   2HE   LYS  32           HE1      LYS  32   8.428  -3.819 -14.069
  215   1HZ   LYS  32           HZ1      LYS  32  10.793  -4.390 -13.863
  216   2HZ   LYS  32           HZ3      LYS  32  10.382  -5.797 -13.011
  217   3HZ   LYS  32           HZ2      LYS  32   9.913  -5.621 -14.634
  218    H    ALA  33           HN       ALA  33   6.189  -1.126 -10.681
  219    HA   ALA  33           HA       ALA  33   8.003   0.178  -8.952
  220   1HB   ALA  33           HB3      ALA  33   7.082   0.834 -11.271
  221   2HB   ALA  33           HB2      ALA  33   5.630   1.377 -10.424
  222   3HB   ALA  33           HB1      ALA  33   7.185   2.150 -10.098
  223    H    ILE  34           HN       ILE  34   4.350  -0.004  -8.885
  224    HA   ILE  34           HA       ILE  34   4.060   1.689  -6.668
  225    HB   ILE  34           HB       ILE  34   2.595  -0.562  -7.893
  226   1HG1  ILE  34          HG12      ILE  34   2.348   2.441  -7.742
  227   2HG1  ILE  34          HG11      ILE  34   2.449   1.419  -9.172
  228   1HG2  ILE  34          HG22      ILE  34   2.183  -0.398  -5.349
  229   2HG2  ILE  34          HG21      ILE  34   1.500   1.190  -5.668
  230   3HG2  ILE  34          HG23      ILE  34   0.752  -0.243  -6.364
  231   1HD1  ILE  34          HD11      ILE  34   0.247   0.372  -8.274
  232   2HD1  ILE  34          HD13      ILE  34   0.141   1.844  -7.311
  233   3HD1  ILE  34          HD12      ILE  34   0.168   1.945  -9.074
  234    H    CYS  35           HN       CYS  35   5.111  -1.520  -6.968
  235    HA   CYS  35           HA       CYS  35   4.782  -2.440  -4.250
  236   1HB   CYS  35           HB2      CYS  35   5.391  -4.056  -5.940
  237   2HB   CYS  35           HB1      CYS  35   6.786  -3.091  -6.452
  238    H    ASN  36           HN       ASN  36   7.888  -1.472  -5.789
  239    HA   ASN  36           HA       ASN  36   9.239  -0.821  -3.341
  240   1HB   ASN  36           HB2      ASN  36  10.317  -1.051  -5.568
  241   2HB   ASN  36           HB1      ASN  36   9.469   0.392  -6.144
  242   1HD2  ASN  36          HD22      ASN  36  12.842   1.514  -5.089
  243   2HD2  ASN  36          HD21      ASN  36  12.197   0.521  -6.305
  244    H    LYS  37           HN       LYS  37   7.526   1.382  -5.538
  245    HA   LYS  37           HA       LYS  37   7.840   3.781  -4.116
  246   1HB   LYS  37           HB2      LYS  37   7.151   3.269  -6.506
  247   2HB   LYS  37           HB1      LYS  37   5.529   3.005  -5.873
  248   1HG   LYS  37           HG2      LYS  37   7.051   5.550  -5.302
  249   2HG   LYS  37           HG1      LYS  37   6.072   5.370  -6.757
  250   1HD   LYS  37           HD2      LYS  37   4.261   4.532  -4.980
  251   2HD   LYS  37           HD1      LYS  37   5.211   5.552  -3.903
  252   1HE   LYS  37           HE2      LYS  37   4.014   6.456  -6.556
  253   2HE   LYS  37           HE1      LYS  37   3.388   6.869  -4.947
  254   1HZ   LYS  37           HZ3      LYS  37   5.625   7.742  -4.405
  255   2HZ   LYS  37           HZ2      LYS  37   6.088   7.497  -6.021
  256   3HZ   LYS  37           HZ1      LYS  37   4.860   8.609  -5.647
  257    H    ASN  38           HN       ASN  38   4.537   2.508  -4.547
  258    HA   ASN  38           HA       ASN  38   3.445   3.861  -2.392
  259   1HB   ASN  38           HB2      ASN  38   2.772   1.608  -4.153
  260   2HB   ASN  38           HB1      ASN  38   1.647   2.098  -2.880
  261   1HD2  ASN  38          HD22      ASN  38   2.033   4.312  -6.242
  262   2HD2  ASN  38          HD21      ASN  38   2.911   2.875  -5.996
  263    H    CYS  39           HN       CYS  39   4.878   0.702  -2.552
  264    HA   CYS  39           HA       CYS  39   3.767  -0.521  -0.263
  265   1HB   CYS  39           HB2      CYS  39   6.582  -0.511  -1.325
  266   2HB   CYS  39           HB1      CYS  39   6.094  -1.550   0.016
  267    H    THR  40           HN       THR  40   6.139   2.087  -0.351
  268    HA   THR  40           HA       THR  40   6.769   1.935   2.501
  269    HB   THR  40           HB       THR  40   7.776   4.255   1.900
  270    HG1  THR  40           HG1      THR  40   6.736   4.835   0.117
  271   1HG2  THR  40          HG22      THR  40   8.595   1.673   0.511
  272   2HG2  THR  40          HG21      THR  40   9.573   3.140   0.449
  273   3HG2  THR  40          HG23      THR  40   9.256   2.357   1.998
   
  No H/Q in entry =         273
  Start of MODEL   23
    1   1H    ASP   1           HT3      ASP   1   9.121   1.768   7.032
    2   2H    ASP   1           HT2      ASP   1   8.384   1.248   8.472
    3   3H    ASP   1           HT1      ASP   1   9.674   0.364   7.808
    4    HA   ASP   1           HA       ASP   1   7.644  -0.801   7.314
    5   1HB   ASP   1           HB2      ASP   1   6.885   1.984   6.405
    6   2HB   ASP   1           HB1      ASP   1   5.940   0.559   5.972
    7    H    ASP   2           HN       ASP   2  10.216   0.540   5.871
    8    HA   ASP   2           HA       ASP   2   9.526   0.086   3.038
    9   1HB   ASP   2           HB2      ASP   2  12.213   0.604   4.453
   10   2HB   ASP   2           HB1      ASP   2  11.920   0.747   2.717
   11    H    GLY   3           HN       GLY   3  11.718  -1.212   2.032
   12   1HA   GLY   3           HA2      GLY   3  12.790  -3.451   3.257
   13   2HA   GLY   3           HA1      GLY   3  11.199  -3.987   2.729
   14    H    LEU   4           HN       LEU   4  11.645  -5.259   0.974
   15    HA   LEU   4           HA       LEU   4  13.164  -4.007  -1.280
   16   1HB   LEU   4           HB2      LEU   4  13.246  -6.950  -0.577
   17   2HB   LEU   4           HB1      LEU   4  14.339  -6.044  -1.619
   18    HG   LEU   4           HG       LEU   4  14.099  -5.395   1.323
   19   1HD1  LEU   4          HD13      LEU   4  14.846  -7.879   0.477
   20   2HD1  LEU   4          HD12      LEU   4  16.392  -7.031   0.442
   21   3HD1  LEU   4          HD11      LEU   4  15.461  -7.106   1.938
   22   1HD2  LEU   4          HD23      LEU   4  15.813  -4.632  -0.971
   23   2HD2  LEU   4          HD22      LEU   4  15.405  -3.715   0.481
   24   3HD2  LEU   4          HD21      LEU   4  16.672  -4.941   0.538
   25    H    CYS   5           HN       CYS   5  12.692  -5.587  -3.370
   26    HA   CYS   5           HA       CYS   5   9.775  -6.365  -3.260
   27   1HB   CYS   5           HB2      CYS   5  10.298  -4.079  -4.315
   28   2HB   CYS   5           HB1      CYS   5  11.057  -4.979  -5.627
   29    H    TYR   6           HN       TYR   6   9.260  -8.187  -4.364
   30    HA   TYR   6           HA       TYR   6  11.345  -9.479  -6.079
   31   1HB   TYR   6           HB2      TYR   6  11.169 -11.536  -4.826
   32   2HB   TYR   6           HB1      TYR   6  11.428 -10.248  -3.663
   33    HD1  TYR   6           HD1      TYR   6   8.983 -12.582  -5.096
   34    HD2  TYR   6           HD2      TYR   6   9.719  -9.631  -2.087
   35    HE1  TYR   6           HE1      TYR   6   6.918 -13.282  -3.918
   36    HE2  TYR   6           HE2      TYR   6   7.641 -10.307  -0.900
   37    HH   TYR   6           HH       TYR   6   5.240 -11.887  -2.174
   38    H    GLU   7           HN       GLU   7  10.288 -11.262  -7.437
   39    HA   GLU   7           HA       GLU   7   7.386 -10.598  -7.871
   40   1HB   GLU   7           HB2      GLU   7   7.856 -10.639 -10.197
   41   2HB   GLU   7           HB1      GLU   7   9.232  -9.799  -9.499
   42   1HG   GLU   7           HG2      GLU   7  10.346 -12.149  -9.473
   43   2HG   GLU   7           HG1      GLU   7   9.005 -12.577 -10.554
   44    H    GLY   8           HN       GLY   8   6.017 -12.293  -8.450
   45   1HA   GLY   8           HA2      GLY   8   6.460 -14.815  -9.271
   46   2HA   GLY   8           HA1      GLY   8   6.925 -14.969  -7.583
   47    H    THR   9           HN       THR   9   5.273 -15.703  -6.302
   48    HA   THR   9           HA       THR   9   2.493 -14.804  -6.796
   49    HB   THR   9           HB       THR   9   3.531 -17.621  -6.859
   50    HG1  THR   9           HG1      THR   9   3.075 -17.514  -9.021
   51   1HG2  THR   9          HG21      THR   9   0.874 -16.602  -6.356
   52   2HG2  THR   9          HG23      THR   9   0.895 -17.496  -7.877
   53   3HG2  THR   9          HG22      THR   9   1.427 -18.276  -6.387
   54    H    ASN  10           HN       ASN  10   4.718 -14.917  -4.457
   55    HA   ASN  10           HA       ASN  10   3.636 -16.768  -2.510
   56   1HB   ASN  10           HB2      ASN  10   5.961 -15.890  -2.711
   57   2HB   ASN  10           HB1      ASN  10   5.384 -14.351  -2.071
   58   1HD2  ASN  10          HD22      ASN  10   5.314 -15.561   1.307
   59   2HD2  ASN  10          HD21      ASN  10   5.083 -14.200   0.258
   60    H    CYS  11           HN       CYS  11   2.567 -13.720  -3.438
   61    HA   CYS  11           HA       CYS  11   0.895 -13.537  -0.956
   62   1HB   CYS  11           HB2      CYS  11   2.305 -11.445  -2.603
   63   2HB   CYS  11           HB1      CYS  11   0.922 -10.999  -1.594
   64    H    GLY  12           HN       GLY  12   0.533 -14.811  -3.627
   65   1HA   GLY  12           HA2      GLY  12  -1.409 -15.111  -4.952
   66   2HA   GLY  12           HA1      GLY  12  -2.188 -13.903  -3.919
   67    H    LYS  13           HN       LYS  13   0.802 -12.931  -5.185
   68    HA   LYS  13           HA       LYS  13  -0.450 -10.853  -6.780
   69   1HB   LYS  13           HB2      LYS  13   1.684  -9.855  -6.634
   70   2HB   LYS  13           HB1      LYS  13   1.408 -10.700  -5.124
   71   1HG   LYS  13           HG2      LYS  13   2.634 -12.690  -6.208
   72   2HG   LYS  13           HG1      LYS  13   3.169 -11.530  -7.411
   73   1HD   LYS  13           HD2      LYS  13   4.175 -10.156  -5.646
   74   2HD   LYS  13           HD1      LYS  13   3.614 -11.302  -4.431
   75   1HE   LYS  13           HE2      LYS  13   5.334 -12.722  -4.842
   76   2HE   LYS  13           HE1      LYS  13   5.117 -12.591  -6.597
   77   1HZ   LYS  13           HZ2      LYS  13   6.087 -10.329  -6.439
   78   2HZ   LYS  13           HZ1      LYS  13   6.472 -10.644  -4.816
   79   3HZ   LYS  13           HZ3      LYS  13   7.180 -11.567  -6.045
   80    H    VAL  14           HN       VAL  14  -1.015 -13.145  -7.970
   81    HA   VAL  14           HA       VAL  14   0.871 -14.039  -9.986
   82    HB   VAL  14           HB       VAL  14  -2.136 -14.170  -9.613
   83   1HG1  VAL  14          HG11      VAL  14  -0.483 -15.515 -11.779
   84   2HG1  VAL  14          HG13      VAL  14  -2.192 -15.818 -11.462
   85   3HG1  VAL  14          HG12      VAL  14  -1.668 -14.234 -12.036
   86   1HG2  VAL  14          HG22      VAL  14   0.072 -16.246  -9.393
   87   2HG2  VAL  14          HG21      VAL  14  -0.825 -15.529  -8.053
   88   3HG2  VAL  14          HG23      VAL  14  -1.648 -16.582  -9.203
   89    H    GLY  15           HN       GLY  15   1.663 -12.524 -11.464
   90   1HA   GLY  15           HA2      GLY  15   1.199 -11.282 -13.540
   91   2HA   GLY  15           HA1      GLY  15  -0.407 -10.898 -12.913
   92    H    LYS  16           HN       LYS  16   0.941 -10.253 -10.183
   93    HA   LYS  16           HA       LYS  16   2.013  -7.576 -11.012
   94   1HB   LYS  16           HB2      LYS  16   0.449  -8.278  -8.536
   95   2HB   LYS  16           HB1      LYS  16   0.943  -6.676  -9.064
   96   1HG   LYS  16           HG2      LYS  16  -0.421  -6.954 -11.128
   97   2HG   LYS  16           HG1      LYS  16  -1.009  -8.493 -10.498
   98   1HD   LYS  16           HD2      LYS  16  -1.256  -6.270  -8.582
   99   2HD   LYS  16           HD1      LYS  16  -2.203  -6.045 -10.053
  100   1HE   LYS  16           HE2      LYS  16  -2.995  -8.492  -9.683
  101   2HE   LYS  16           HE1      LYS  16  -2.391  -8.277  -8.028
  102   1HZ   LYS  16           HZ2      LYS  16  -4.162  -6.310  -9.365
  103   2HZ   LYS  16           HZ1      LYS  16  -4.763  -7.573  -8.401
  104   3HZ   LYS  16           HZ3      LYS  16  -3.756  -6.392  -7.718
  105    H    TYR  17           HN       TYR  17   2.738  -7.098  -8.015
  106    HA   TYR  17           HA       TYR  17   4.808  -9.221  -7.676
  107   1HB   TYR  17           HB2      TYR  17   5.540  -6.285  -7.755
  108   2HB   TYR  17           HB1      TYR  17   6.589  -7.713  -7.790
  109    HD1  TYR  17           HD1      TYR  17   4.131  -5.776  -9.841
  110    HD2  TYR  17           HD2      TYR  17   7.040  -8.899  -9.717
  111    HE1  TYR  17           HE1      TYR  17   4.102  -5.915 -12.321
  112    HE2  TYR  17           HE2      TYR  17   7.036  -9.045 -12.165
  113    HH   TYR  17           HH       TYR  17   4.998  -8.304 -14.039
  114    H    CYS  18           HN       CYS  18   6.142  -8.583  -5.442
  115    HA   CYS  18           HA       CYS  18   4.195  -7.292  -3.559
  116   1HB   CYS  18           HB2      CYS  18   5.552 -10.006  -3.406
  117   2HB   CYS  18           HB1      CYS  18   4.787  -9.245  -2.011
  118    H    CYS  19           HN       CYS  19   5.210  -6.671  -1.502
  119    HA   CYS  19           HA       CYS  19   8.156  -6.365  -1.607
  120   1HB   CYS  19           HB2      CYS  19   7.615  -3.976  -0.704
  121   2HB   CYS  19           HB1      CYS  19   7.365  -4.301  -2.422
  122    H    SER  20           HN       SER  20   8.799  -7.530   0.174
  123    HA   SER  20           HA       SER  20   8.118  -6.634   2.835
  124   1HB   SER  20           HB2      SER  20   7.102  -9.009   3.404
  125   2HB   SER  20           HB1      SER  20   6.071  -7.801   2.630
  126    HG   SER  20           HG       SER  20   7.384 -10.034   1.497
  127    HA   PRO  21           HA       PRO  21  12.017  -8.689   3.056
  128   1HB   PRO  21           HB2      PRO  21  12.560  -8.301   5.715
  129   2HB   PRO  21           HB1      PRO  21  12.705  -7.017   4.498
  130   1HG   PRO  21           HG2      PRO  21  10.536  -7.465   6.496
  131   2HG   PRO  21           HG1      PRO  21  11.186  -5.952   5.831
  132   1HD   PRO  21           HD2      PRO  21   8.814  -7.205   5.062
  133   2HD   PRO  21           HD1      PRO  21   9.675  -5.962   4.122
  134    H    ILE  22           HN       ILE  22   9.195  -9.573   4.667
  135    HA   ILE  22           HA       ILE  22   9.896 -12.405   4.727
  136    HB   ILE  22           HB       ILE  22  10.998 -11.188   6.746
  137   1HG1  ILE  22          HG12      ILE  22   9.141 -13.545   7.274
  138   2HG1  ILE  22          HG11      ILE  22  10.812 -13.650   6.722
  139   1HG2  ILE  22          HG23      ILE  22   8.510 -10.164   7.051
  140   2HG2  ILE  22          HG22      ILE  22   8.487 -11.469   8.234
  141   3HG2  ILE  22          HG21      ILE  22   9.729 -10.217   8.320
  142   1HD1  ILE  22          HD12      ILE  22  11.381 -12.301   8.867
  143   2HD1  ILE  22          HD11      ILE  22   9.773 -12.777   9.414
  144   3HD1  ILE  22          HD13      ILE  22  10.980 -14.009   9.044
  145    H    GLY  23           HN       GLY  23   7.872 -13.295   6.378
  146   1HA   GLY  23           HA2      GLY  23   5.522 -12.565   4.772
  147   2HA   GLY  23           HA1      GLY  23   5.582 -13.847   5.973
  148    H    LYS  24           HN       LYS  24   6.808 -11.006   7.293
  149    HA   LYS  24           HA       LYS  24   4.328 -10.699   8.821
  150   1HB   LYS  24           HB2      LYS  24   5.614  -9.520  10.410
  151   2HB   LYS  24           HB1      LYS  24   6.625 -10.835   9.831
  152   1HG   LYS  24           HG2      LYS  24   7.558  -9.124   8.144
  153   2HG   LYS  24           HG1      LYS  24   6.799  -7.905   9.165
  154   1HD   LYS  24           HD2      LYS  24   7.999  -8.955  11.140
  155   2HD   LYS  24           HD1      LYS  24   8.924  -9.899   9.977
  156   1HE   LYS  24           HE2      LYS  24   9.501  -7.631   8.866
  157   2HE   LYS  24           HE1      LYS  24   8.925  -6.905  10.381
  158   1HZ   LYS  24           HZ2      LYS  24  10.382  -8.499  11.574
  159   2HZ   LYS  24           HZ1      LYS  24  11.043  -8.965  10.081
  160   3HZ   LYS  24           HZ3      LYS  24  11.240  -7.374  10.634
  161    H    TYR  25           HN       TYR  25   4.831  -9.649   5.934
  162    HA   TYR  25           HA       TYR  25   3.348  -7.138   6.352
  163   1HB   TYR  25           HB2      TYR  25   6.097  -7.337   5.132
  164   2HB   TYR  25           HB1      TYR  25   4.995  -6.038   4.677
  165    HD1  TYR  25           HD2      TYR  25   3.910  -4.697   6.692
  166    HD2  TYR  25           HD1      TYR  25   7.471  -7.070   6.958
  167    HE1  TYR  25           HE2      TYR  25   4.576  -3.459   8.735
  168    HE2  TYR  25           HE1      TYR  25   8.150  -5.825   9.001
  169    HH   TYR  25           HH       TYR  25   6.136  -3.182  10.299
  170    H    CYS  26           HN       CYS  26   5.029  -9.021   3.791
  171    HA   CYS  26           HA       CYS  26   4.284  -9.442   1.531
  172   1HB   CYS  26           HB2      CYS  26   3.330 -11.292   2.774
  173   2HB   CYS  26           HB1      CYS  26   2.047 -10.273   3.439
  174    H    VAL  27           HN       VAL  27   4.118  -6.931   1.080
  175    HA   VAL  27           HA       VAL  27   1.215  -6.141   0.801
  176    HB   VAL  27           HB       VAL  27   3.758  -4.479   0.924
  177   1HG1  VAL  27          HG11      VAL  27   1.356  -3.811  -0.219
  178   2HG1  VAL  27          HG13      VAL  27   1.126  -3.250   1.437
  179   3HG1  VAL  27          HG12      VAL  27   2.483  -2.649   0.482
  180   1HG2  VAL  27          HG22      VAL  27   1.669  -5.238   2.971
  181   2HG2  VAL  27          HG21      VAL  27   3.426  -5.344   3.105
  182   3HG2  VAL  27          HG23      VAL  27   2.631  -3.770   3.148
  183    H    CYS  28           HN       CYS  28   0.569  -6.476  -1.317
  184    HA   CYS  28           HA       CYS  28   2.648  -6.144  -3.452
  185   1HB   CYS  28           HB2      CYS  28   0.076  -7.727  -3.489
  186   2HB   CYS  28           HB1      CYS  28   1.435  -7.891  -4.599
  187    H    TYR  29           HN       TYR  29   1.950  -5.445  -5.541
  188    HA   TYR  29           HA       TYR  29  -0.561  -3.881  -5.722
  189   1HB   TYR  29           HB2      TYR  29   2.235  -2.865  -6.138
  190   2HB   TYR  29           HB1      TYR  29   0.776  -2.001  -6.570
  191    HD1  TYR  29           HD1      TYR  29   2.640  -3.480  -3.775
  192    HD2  TYR  29           HD2      TYR  29  -0.417  -0.762  -4.997
  193    HE1  TYR  29           HE1      TYR  29   2.574  -2.539  -1.490
  194    HE2  TYR  29           HE2      TYR  29  -0.509   0.193  -2.721
  195    HH   TYR  29           HH       TYR  29   1.263   0.330  -0.710
  196    H    ASP  30           HN       ASP  30  -0.573  -2.959  -8.142
  197    HA   ASP  30           HA       ASP  30   0.079  -5.186  -9.904
  198   1HB   ASP  30           HB2      ASP  30  -1.295  -4.095 -11.437
  199   2HB   ASP  30           HB1      ASP  30  -2.013  -3.742  -9.869
  200    H    SER  31           HN       SER  31   1.170  -1.815  -9.569
  201    HA   SER  31           HA       SER  31   3.098  -2.111 -11.793
  202   1HB   SER  31           HB2      SER  31   3.050   0.063  -9.760
  203   2HB   SER  31           HB1      SER  31   3.519   0.156 -11.450
  204    HG   SER  31           HG       SER  31   1.252   0.838 -10.591
  205    H    LYS  32           HN       LYS  32   5.056  -3.311 -11.410
  206    HA   LYS  32           HA       LYS  32   5.910  -4.169  -8.851
  207   1HB   LYS  32           HB2      LYS  32   7.962  -4.773  -9.987
  208   2HB   LYS  32           HB1      LYS  32   6.746  -4.762 -11.270
  209   1HG   LYS  32           HG2      LYS  32   7.496  -2.666 -12.113
  210   2HG   LYS  32           HG1      LYS  32   8.453  -2.342 -10.667
  211   1HD   LYS  32           HD2      LYS  32  10.041  -3.070 -12.323
  212   2HD   LYS  32           HD1      LYS  32   9.787  -4.476 -11.276
  213   1HE   LYS  32           HE2      LYS  32   8.185  -5.442 -12.884
  214   2HE   LYS  32           HE1      LYS  32   8.309  -3.997 -13.912
  215   1HZ   LYS  32           HZ1      LYS  32  10.710  -4.383 -14.064
  216   2HZ   LYS  32           HZ3      LYS  32  10.545  -5.809 -13.160
  217   3HZ   LYS  32           HZ2      LYS  32   9.826  -5.690 -14.694
  218    H    ALA  33           HN       ALA  33   6.435  -1.110 -10.569
  219    HA   ALA  33           HA       ALA  33   8.247   0.143  -8.793
  220   1HB   ALA  33           HB3      ALA  33   7.429   0.874 -11.105
  221   2HB   ALA  33           HB2      ALA  33   5.917   1.354 -10.330
  222   3HB   ALA  33           HB1      ALA  33   7.426   2.162  -9.896
  223    H    ILE  34           HN       ILE  34   4.590   0.035  -8.810
  224    HA   ILE  34           HA       ILE  34   4.260   1.674  -6.559
  225    HB   ILE  34           HB       ILE  34   2.808  -0.523  -7.888
  226   1HG1  ILE  34          HG12      ILE  34   2.599   2.476  -7.659
  227   2HG1  ILE  34          HG11      ILE  34   2.724   1.493  -9.112
  228   1HG2  ILE  34          HG22      ILE  34   2.310  -0.459  -5.365
  229   2HG2  ILE  34          HG21      ILE  34   1.675   1.160  -5.629
  230   3HG2  ILE  34          HG23      ILE  34   0.915  -0.221  -6.414
  231   1HD1  ILE  34          HD11      ILE  34   0.482   0.486  -8.445
  232   2HD1  ILE  34          HD13      ILE  34   0.369   1.788  -7.262
  233   3HD1  ILE  34          HD12      ILE  34   0.445   2.166  -8.985
  234    H    CYS  35           HN       CYS  35   5.276  -1.541  -6.907
  235    HA   CYS  35           HA       CYS  35   4.871  -2.532  -4.230
  236   1HB   CYS  35           HB2      CYS  35   5.535  -4.106  -5.930
  237   2HB   CYS  35           HB1      CYS  35   6.920  -3.110  -6.408
  238    H    ASN  36           HN       ASN  36   7.994  -1.434  -5.664
  239    HA   ASN  36           HA       ASN  36   9.281  -0.868  -3.165
  240   1HB   ASN  36           HB2      ASN  36   9.506   0.347  -5.957
  241   2HB   ASN  36           HB1      ASN  36  10.643   0.711  -4.652
  242   1HD2  ASN  36          HD22      ASN  36  12.265  -2.448  -4.793
  243   2HD2  ASN  36          HD21      ASN  36  12.048  -1.028  -3.888
  244    H    LYS  37           HN       LYS  37   7.598   1.435  -5.293
  245    HA   LYS  37           HA       LYS  37   7.807   3.750  -3.717
  246   1HB   LYS  37           HB2      LYS  37   7.243   3.410  -6.155
  247   2HB   LYS  37           HB1      LYS  37   5.607   3.013  -5.635
  248   1HG   LYS  37           HG2      LYS  37   6.944   5.593  -4.804
  249   2HG   LYS  37           HG1      LYS  37   6.060   5.462  -6.323
  250   1HD   LYS  37           HD2      LYS  37   4.229   4.383  -4.665
  251   2HD   LYS  37           HD1      LYS  37   5.035   5.459  -3.528
  252   1HE   LYS  37           HE2      LYS  37   4.390   6.643  -6.187
  253   2HE   LYS  37           HE1      LYS  37   3.010   6.296  -5.125
  254   1HZ   LYS  37           HZ2      LYS  37   5.477   7.679  -4.219
  255   2HZ   LYS  37           HZ1      LYS  37   4.075   8.499  -4.719
  256   3HZ   LYS  37           HZ3      LYS  37   4.026   7.491  -3.355
  257    H    ASN  38           HN       ASN  38   4.562   2.435  -4.362
  258    HA   ASN  38           HA       ASN  38   3.317   3.659  -2.219
  259   1HB   ASN  38           HB2      ASN  38   2.826   1.438  -4.076
  260   2HB   ASN  38           HB1      ASN  38   1.619   1.841  -2.850
  261   1HD2  ASN  38          HD22      ASN  38   2.080   4.162  -6.125
  262   2HD2  ASN  38          HD21      ASN  38   2.998   2.753  -5.872
  263    H    CYS  39           HN       CYS  39   4.877   0.567  -2.418
  264    HA   CYS  39           HA       CYS  39   3.727  -0.797  -0.234
  265   1HB   CYS  39           HB2      CYS  39   6.592  -0.594  -1.139
  266   2HB   CYS  39           HB1      CYS  39   6.062  -1.758   0.079
  267    H    THR  40           HN       THR  40   5.857   1.994  -0.104
  268    HA   THR  40           HA       THR  40   6.509   1.721   2.731
  269    HB   THR  40           HB       THR  40   7.265   4.152   2.320
  270    HG1  THR  40           HG1      THR  40   6.979   4.963   0.367
  271   1HG2  THR  40          HG22      THR  40   8.278   1.659   1.058
  272   2HG2  THR  40          HG21      THR  40   8.882   3.153   0.336
  273   3HG2  THR  40          HG23      THR  40   9.129   2.842   2.055
   
  No H/Q in entry =         273
  Start of MODEL   24
    1   1H    ASP   1           HT1      ASP   1  12.178   4.827   3.301
    2   2H    ASP   1           HT3      ASP   1  10.676   5.596   3.128
    3   3H    ASP   1           HT2      ASP   1  10.983   4.631   4.492
    4    HA   ASP   1           HA       ASP   1   9.613   3.347   3.047
    5   1HB   ASP   1           HB2      ASP   1  10.337   3.088   0.675
    6   2HB   ASP   1           HB1      ASP   1  10.026   4.768   1.103
    7    H    ASP   2           HN       ASP   2  10.830   2.189   4.872
    8    HA   ASP   2           HA       ASP   2  13.260   0.702   4.096
    9   1HB   ASP   2           HB2      ASP   2  11.406   0.535   6.550
   10   2HB   ASP   2           HB1      ASP   2  13.007  -0.208   6.427
   11    H    GLY   3           HN       GLY   3  12.981  -1.003   2.704
   12   1HA   GLY   3           HA2      GLY   3  11.721  -3.387   3.334
   13   2HA   GLY   3           HA1      GLY   3  10.478  -2.468   2.491
   14    H    LEU   4           HN       LEU   4  11.314  -4.793   1.366
   15    HA   LEU   4           HA       LEU   4  12.912  -3.884  -0.996
   16   1HB   LEU   4           HB2      LEU   4  12.952  -6.637   0.283
   17   2HB   LEU   4           HB1      LEU   4  14.004  -6.038  -0.996
   18    HG   LEU   4           HG       LEU   4  13.917  -4.679   1.698
   19   1HD1  LEU   4          HD11      LEU   4  15.083  -7.292   0.977
   20   2HD1  LEU   4          HD13      LEU   4  16.213  -6.173   1.742
   21   3HD1  LEU   4          HD12      LEU   4  14.719  -6.619   2.566
   22   1HD2  LEU   4          HD21      LEU   4  15.585  -4.607  -0.770
   23   2HD2  LEU   4          HD23      LEU   4  15.179  -3.304   0.351
   24   3HD2  LEU   4          HD22      LEU   4  16.445  -4.460   0.763
   25    H    CYS   5           HN       CYS   5  12.492  -5.768  -2.849
   26    HA   CYS   5           HA       CYS   5   9.601  -6.601  -2.683
   27   1HB   CYS   5           HB2      CYS   5   9.956  -4.348  -3.850
   28   2HB   CYS   5           HB1      CYS   5  10.788  -5.242  -5.120
   29    H    TYR   6           HN       TYR   6   9.073  -8.384  -3.928
   30    HA   TYR   6           HA       TYR   6  11.291  -9.747  -5.414
   31   1HB   TYR   6           HB2      TYR   6  10.883 -11.797  -4.206
   32   2HB   TYR   6           HB1      TYR   6  11.054 -10.525  -3.011
   33    HD1  TYR   6           HD1      TYR   6   8.669 -12.711  -4.777
   34    HD2  TYR   6           HD2      TYR   6   9.223  -9.897  -1.601
   35    HE1  TYR   6           HE1      TYR   6   6.460 -13.341  -3.847
   36    HE2  TYR   6           HE2      TYR   6   7.003 -10.512  -0.663
   37    HH   TYR   6           HH       TYR   6   4.697 -12.187  -2.364
   38    H    GLU   7           HN       GLU   7  10.328 -11.517  -6.875
   39    HA   GLU   7           HA       GLU   7   7.542 -10.711  -7.684
   40   1HB   GLU   7           HB2      GLU   7   8.302 -10.842  -9.928
   41   2HB   GLU   7           HB1      GLU   7   9.628 -10.064  -9.076
   42   1HG   GLU   7           HG2      GLU   7  10.583 -12.473  -8.860
   43   2HG   GLU   7           HG1      GLU   7   9.369 -12.853 -10.095
   44    H    GLY   8           HN       GLY   8   6.180 -12.337  -8.408
   45   1HA   GLY   8           HA2      GLY   8   6.504 -14.903  -9.112
   46   2HA   GLY   8           HA1      GLY   8   6.793 -15.037  -7.378
   47    H    THR   9           HN       THR   9   4.979 -15.739  -6.345
   48    HA   THR   9           HA       THR   9   2.345 -14.543  -6.962
   49    HB   THR   9           HB       THR   9   3.132 -17.434  -7.191
   50    HG1  THR   9           HG1      THR   9   3.388 -16.947  -9.199
   51   1HG2  THR   9          HG23      THR   9   0.512 -16.172  -6.823
   52   2HG2  THR   9          HG22      THR   9   0.589 -17.169  -8.276
   53   3HG2  THR   9          HG21      THR   9   0.965 -17.873  -6.703
   54    H    ASN  10           HN       ASN  10   4.341 -14.917  -4.521
   55    HA   ASN  10           HA       ASN  10   3.077 -16.826  -2.753
   56   1HB   ASN  10           HB2      ASN  10   5.441 -16.018  -2.783
   57   2HB   ASN  10           HB1      ASN  10   4.878 -14.506  -2.068
   58   1HD2  ASN  10          HD22      ASN  10   4.600 -15.940   1.210
   59   2HD2  ASN  10          HD21      ASN  10   4.465 -14.503   0.249
   60    H    CYS  11           HN       CYS  11   2.048 -13.788  -3.632
   61    HA   CYS  11           HA       CYS  11   0.302 -13.643  -1.205
   62   1HB   CYS  11           HB2      CYS  11   1.855 -11.523  -2.675
   63   2HB   CYS  11           HB1      CYS  11   0.448 -11.080  -1.696
   64    H    GLY  12           HN       GLY  12  -0.009 -14.808  -3.905
   65   1HA   GLY  12           HA2      GLY  12  -1.908 -14.991  -5.312
   66   2HA   GLY  12           HA1      GLY  12  -2.666 -13.749  -4.305
   67    H    LYS  13           HN       LYS  13   0.398 -12.877  -5.362
   68    HA   LYS  13           HA       LYS  13  -0.635 -10.765  -7.055
   69   1HB   LYS  13           HB2      LYS  13   1.631  -9.952  -6.830
   70   2HB   LYS  13           HB1      LYS  13   1.014 -10.531  -5.294
   71   1HG   LYS  13           HG2      LYS  13   2.270 -12.571  -5.426
   72   2HG   LYS  13           HG1      LYS  13   2.669 -12.269  -7.111
   73   1HD   LYS  13           HD2      LYS  13   3.556 -10.023  -5.703
   74   2HD   LYS  13           HD1      LYS  13   4.007 -11.407  -4.717
   75   1HE   LYS  13           HE2      LYS  13   5.725 -10.706  -6.493
   76   2HE   LYS  13           HE1      LYS  13   5.237 -12.409  -6.532
   77   1HZ   LYS  13           HZ3      LYS  13   3.542 -10.565  -8.017
   78   2HZ   LYS  13           HZ2      LYS  13   5.094 -10.809  -8.661
   79   3HZ   LYS  13           HZ1      LYS  13   4.056 -12.130  -8.422
   80    H    VAL  14           HN       VAL  14  -1.171 -13.021  -8.323
   81    HA   VAL  14           HA       VAL  14   0.872 -13.998 -10.133
   82    HB   VAL  14           HB       VAL  14  -2.159 -13.970 -10.111
   83   1HG1  VAL  14          HG11      VAL  14  -1.233 -14.109 -12.465
   84   2HG1  VAL  14          HG13      VAL  14  -0.406 -15.591 -11.983
   85   3HG1  VAL  14          HG12      VAL  14  -2.168 -15.518 -11.969
   86   1HG2  VAL  14          HG22      VAL  14  -0.476 -15.400  -8.549
   87   2HG2  VAL  14          HG21      VAL  14  -2.039 -16.015  -9.083
   88   3HG2  VAL  14          HG23      VAL  14  -0.570 -16.478  -9.941
   89    H    GLY  15           HN       GLY  15   1.898 -12.530 -11.517
   90   1HA   GLY  15           HA2      GLY  15   1.717 -11.308 -13.648
   91   2HA   GLY  15           HA1      GLY  15   0.077 -10.836 -13.200
   92    H    LYS  16           HN       LYS  16   1.232 -10.187 -10.352
   93    HA   LYS  16           HA       LYS  16   2.418  -7.551 -11.173
   94   1HB   LYS  16           HB2      LYS  16   0.693  -8.185  -8.786
   95   2HB   LYS  16           HB1      LYS  16   1.263  -6.600  -9.291
   96   1HG   LYS  16           HG2      LYS  16   0.031  -6.851 -11.433
   97   2HG   LYS  16           HG1      LYS  16  -0.627  -8.378 -10.849
   98   1HD   LYS  16           HD2      LYS  16  -1.016  -6.305  -8.860
   99   2HD   LYS  16           HD1      LYS  16  -1.674  -5.790 -10.413
  100   1HE   LYS  16           HE2      LYS  16  -2.542  -8.394 -10.312
  101   2HE   LYS  16           HE1      LYS  16  -2.619  -7.922  -8.602
  102   1HZ   LYS  16           HZ1      LYS  16  -3.681  -6.295 -10.852
  103   2HZ   LYS  16           HZ3      LYS  16  -4.633  -7.283  -9.855
  104   3HZ   LYS  16           HZ2      LYS  16  -3.822  -5.945  -9.195
  105    H    TYR  17           HN       TYR  17   2.911  -7.103  -8.080
  106    HA   TYR  17           HA       TYR  17   5.010  -9.179  -7.673
  107   1HB   TYR  17           HB2      TYR  17   5.630  -6.222  -7.587
  108   2HB   TYR  17           HB1      TYR  17   6.735  -7.606  -7.518
  109    HD1  TYR  17           HD1      TYR  17   4.455  -5.738  -9.815
  110    HD2  TYR  17           HD2      TYR  17   7.444  -8.761  -9.384
  111    HE1  TYR  17           HE1      TYR  17   4.710  -5.849 -12.284
  112    HE2  TYR  17           HE2      TYR  17   7.716  -8.882 -11.819
  113    HH   TYR  17           HH       TYR  17   6.172  -8.331 -13.867
  114    H    CYS  18           HN       CYS  18   6.101  -8.707  -5.309
  115    HA   CYS  18           HA       CYS  18   3.994  -7.525  -3.522
  116   1HB   CYS  18           HB2      CYS  18   5.342 -10.249  -3.451
  117   2HB   CYS  18           HB1      CYS  18   4.469  -9.588  -2.067
  118    H    CYS  19           HN       CYS  19   4.849  -7.065  -1.333
  119    HA   CYS  19           HA       CYS  19   7.797  -6.748  -1.237
  120   1HB   CYS  19           HB2      CYS  19   7.171  -4.467  -0.118
  121   2HB   CYS  19           HB1      CYS  19   7.036  -4.621  -1.872
  122    H    SER  20           HN       SER  20   8.589  -7.711   0.576
  123    HA   SER  20           HA       SER  20   7.380  -7.356   3.206
  124   1HB   SER  20           HB2      SER  20   7.020  -9.894   3.480
  125   2HB   SER  20           HB1      SER  20   5.893  -9.095   2.380
  126    HG   SER  20           HG       SER  20   8.101 -10.741   1.810
  127    HA   PRO  21           HA       PRO  21  11.755  -8.088   3.591
  128   1HB   PRO  21           HB2      PRO  21  12.042  -7.300   6.200
  129   2HB   PRO  21           HB1      PRO  21  11.885  -6.160   4.848
  130   1HG   PRO  21           HG2      PRO  21   9.843  -6.962   6.863
  131   2HG   PRO  21           HG1      PRO  21  10.059  -5.424   6.001
  132   1HD   PRO  21           HD2      PRO  21   8.195  -7.440   5.406
  133   2HD   PRO  21           HD1      PRO  21   8.640  -6.081   4.346
  134    H    ILE  22           HN       ILE  22   9.279  -9.800   4.952
  135    HA   ILE  22           HA       ILE  22  10.997 -12.065   5.582
  136    HB   ILE  22           HB       ILE  22  11.066 -10.435   7.555
  137   1HG1  ILE  22          HG12      ILE  22  10.010 -13.259   7.997
  138   2HG1  ILE  22          HG11      ILE  22  11.700 -12.748   8.002
  139   1HG2  ILE  22          HG23      ILE  22   8.349 -10.407   7.094
  140   2HG2  ILE  22          HG22      ILE  22   8.491 -11.386   8.553
  141   3HG2  ILE  22          HG21      ILE  22   9.154  -9.752   8.520
  142   1HD1  ILE  22          HD13      ILE  22  10.857 -11.124   9.928
  143   2HD1  ILE  22          HD12      ILE  22   9.591 -12.341  10.091
  144   3HD1  ILE  22          HD11      ILE  22  11.283 -12.800  10.282
  145    H    GLY  23           HN       GLY  23   8.418 -11.046   4.266
  146   1HA   GLY  23           HA2      GLY  23   6.524 -12.194   3.363
  147   2HA   GLY  23           HA1      GLY  23   7.039 -13.592   4.296
  148    H    LYS  24           HN       LYS  24   6.864 -10.824   6.207
  149    HA   LYS  24           HA       LYS  24   4.487 -11.873   7.555
  150   1HB   LYS  24           HB2      LYS  24   5.106 -10.410   9.335
  151   2HB   LYS  24           HB1      LYS  24   6.584 -11.124   8.702
  152   1HG   LYS  24           HG2      LYS  24   6.939  -9.083   7.310
  153   2HG   LYS  24           HG1      LYS  24   5.497  -8.375   8.035
  154   1HD   LYS  24           HD2      LYS  24   7.702  -9.412   9.790
  155   2HD   LYS  24           HD1      LYS  24   7.831  -7.810   9.063
  156   1HE   LYS  24           HE2      LYS  24   5.984  -6.978  10.250
  157   2HE   LYS  24           HE1      LYS  24   5.311  -8.598  10.520
  158   1HZ   LYS  24           HZ2      LYS  24   7.384  -9.087  11.808
  159   2HZ   LYS  24           HZ1      LYS  24   7.750  -7.429  11.740
  160   3HZ   LYS  24           HZ3      LYS  24   6.348  -7.955  12.537
  161    H    TYR  25           HN       TYR  25   5.393  -9.000   5.699
  162    HA   TYR  25           HA       TYR  25   2.831  -7.664   6.205
  163   1HB   TYR  25           HB2      TYR  25   5.315  -7.111   4.599
  164   2HB   TYR  25           HB1      TYR  25   3.882  -6.095   4.434
  165    HD1  TYR  25           HD1      TYR  25   2.968  -4.891   6.418
  166    HD2  TYR  25           HD2      TYR  25   6.713  -6.974   6.544
  167    HE1  TYR  25           HE1      TYR  25   3.578  -3.656   8.490
  168    HE2  TYR  25           HE2      TYR  25   7.336  -5.738   8.622
  169    HH   TYR  25           HH       TYR  25   6.310  -4.538  10.411
  170    H    CYS  26           HN       CYS  26   4.371  -9.384   3.481
  171    HA   CYS  26           HA       CYS  26   3.469  -9.989   1.347
  172   1HB   CYS  26           HB2      CYS  26   2.513 -11.642   2.920
  173   2HB   CYS  26           HB1      CYS  26   1.192 -10.538   3.318
  174    H    VAL  27           HN       VAL  27   3.418  -7.391   1.067
  175    HA   VAL  27           HA       VAL  27   0.561  -6.576   0.551
  176    HB   VAL  27           HB       VAL  27   3.074  -4.934   1.020
  177   1HG1  VAL  27          HG12      VAL  27   0.755  -4.224  -0.313
  178   2HG1  VAL  27          HG11      VAL  27   0.449  -3.667   1.332
  179   3HG1  VAL  27          HG13      VAL  27   1.873  -3.099   0.460
  180   1HG2  VAL  27          HG22      VAL  27   2.186  -6.208   3.007
  181   2HG2  VAL  27          HG21      VAL  27   2.135  -4.456   3.205
  182   3HG2  VAL  27          HG23      VAL  27   0.662  -5.343   2.813
  183    H    CYS  28           HN       CYS  28   0.138  -6.811  -1.629
  184    HA   CYS  28           HA       CYS  28   2.426  -6.381  -3.519
  185   1HB   CYS  28           HB2      CYS  28  -0.115  -7.976  -3.885
  186   2HB   CYS  28           HB1      CYS  28   1.344  -8.073  -4.869
  187    H    TYR  29           HN       TYR  29   1.925  -5.571  -5.638
  188    HA   TYR  29           HA       TYR  29  -0.565  -3.996  -5.964
  189   1HB   TYR  29           HB2      TYR  29   2.255  -2.969  -6.092
  190   2HB   TYR  29           HB1      TYR  29   0.830  -2.078  -6.577
  191    HD1  TYR  29           HD1      TYR  29   2.499  -3.717  -3.749
  192    HD2  TYR  29           HD2      TYR  29  -0.492  -0.950  -5.022
  193    HE1  TYR  29           HE1      TYR  29   2.260  -2.921  -1.423
  194    HE2  TYR  29           HE2      TYR  29  -0.758  -0.139  -2.703
  195    HH   TYR  29           HH       TYR  29  -0.334  -1.150  -0.341
  196    H    ASP  30           HN       ASP  30  -0.392  -2.963  -8.320
  197    HA   ASP  30           HA       ASP  30   0.437  -5.088 -10.135
  198   1HB   ASP  30           HB2      ASP  30  -0.834  -3.944 -11.713
  199   2HB   ASP  30           HB1      ASP  30  -1.673  -3.661 -10.191
  200    H    SER  31           HN       SER  31   1.455  -1.735  -9.527
  201    HA   SER  31           HA       SER  31   3.548  -1.883 -11.614
  202   1HB   SER  31           HB2      SER  31   3.339   0.149  -9.447
  203   2HB   SER  31           HB1      SER  31   3.931   0.357 -11.088
  204    HG   SER  31           HG       SER  31   1.976   0.899 -11.573
  205    H    LYS  32           HN       LYS  32   5.461  -3.141 -11.155
  206    HA   LYS  32           HA       LYS  32   6.116  -4.139  -8.594
  207   1HB   LYS  32           HB2      LYS  32   8.250  -4.696  -9.593
  208   2HB   LYS  32           HB1      LYS  32   7.139  -4.607 -10.965
  209   1HG   LYS  32           HG2      LYS  32   7.979  -2.510 -11.666
  210   2HG   LYS  32           HG1      LYS  32   8.760  -2.208 -10.114
  211   1HD   LYS  32           HD2      LYS  32  10.553  -2.868 -11.549
  212   2HD   LYS  32           HD1      LYS  32  10.168  -4.336 -10.636
  213   1HE   LYS  32           HE2      LYS  32   9.830  -5.389 -12.656
  214   2HE   LYS  32           HE1      LYS  32   8.420  -4.332 -12.896
  215   1HZ   LYS  32           HZ3      LYS  32  11.218  -3.508 -13.458
  216   2HZ   LYS  32           HZ2      LYS  32  10.155  -4.102 -14.642
  217   3HZ   LYS  32           HZ1      LYS  32   9.803  -2.650 -13.833
  218    H    ALA  33           HN       ALA  33   6.780  -0.992 -10.080
  219    HA   ALA  33           HA       ALA  33   8.455   0.141  -8.104
  220   1HB   ALA  33           HB3      ALA  33   7.818   1.019 -10.415
  221   2HB   ALA  33           HB2      ALA  33   6.244   1.445  -9.738
  222   3HB   ALA  33           HB1      ALA  33   7.706   2.230  -9.134
  223    H    ILE  34           HN       ILE  34   4.812   0.056  -8.394
  224    HA   ILE  34           HA       ILE  34   4.317   1.555  -6.073
  225    HB   ILE  34           HB       ILE  34   2.962  -0.546  -7.641
  226   1HG1  ILE  34          HG12      ILE  34   2.742   2.435  -7.248
  227   2HG1  ILE  34          HG11      ILE  34   2.979   1.541  -8.745
  228   1HG2  ILE  34          HG22      ILE  34   2.281  -0.606  -5.151
  229   2HG2  ILE  34          HG21      ILE  34   1.649   1.017  -5.397
  230   3HG2  ILE  34          HG23      ILE  34   0.973  -0.336  -6.299
  231   1HD1  ILE  34          HD11      ILE  34   0.691   0.501  -8.301
  232   2HD1  ILE  34          HD13      ILE  34   0.489   1.745  -7.068
  233   3HD1  ILE  34          HD12      ILE  34   0.697   2.205  -8.761
  234    H    CYS  35           HN       CYS  35   5.343  -1.644  -6.545
  235    HA   CYS  35           HA       CYS  35   4.718  -2.808  -3.982
  236   1HB   CYS  35           HB2      CYS  35   5.536  -4.212  -5.809
  237   2HB   CYS  35           HB1      CYS  35   7.026  -3.258  -5.929
  238    H    ASN  36           HN       ASN  36   7.918  -1.588  -5.100
  239    HA   ASN  36           HA       ASN  36   9.022  -1.229  -2.467
  240   1HB   ASN  36           HB2      ASN  36  10.355  -1.171  -4.536
  241   2HB   ASN  36           HB1      ASN  36   9.480   0.259  -5.103
  242   1HD2  ASN  36          HD22      ASN  36  12.485   0.658  -2.369
  243   2HD2  ASN  36          HD21      ASN  36  11.953  -0.883  -2.844
  244    H    LYS  37           HN       LYS  37   7.529   1.231  -4.558
  245    HA   LYS  37           HA       LYS  37   7.608   3.426  -2.809
  246   1HB   LYS  37           HB2      LYS  37   7.257   3.249  -5.304
  247   2HB   LYS  37           HB1      LYS  37   5.578   2.856  -4.952
  248   1HG   LYS  37           HG2      LYS  37   6.885   5.344  -3.842
  249   2HG   LYS  37           HG1      LYS  37   6.130   5.334  -5.435
  250   1HD   LYS  37           HD2      LYS  37   4.145   4.193  -4.009
  251   2HD   LYS  37           HD1      LYS  37   4.873   5.177  -2.742
  252   1HE   LYS  37           HE2      LYS  37   4.038   6.251  -5.466
  253   2HE   LYS  37           HE1      LYS  37   3.082   6.420  -3.978
  254   1HZ   LYS  37           HZ1      LYS  37   5.104   7.385  -2.930
  255   2HZ   LYS  37           HZ3      LYS  37   5.843   7.407  -4.457
  256   3HZ   LYS  37           HZ2      LYS  37   4.454   8.343  -4.173
  257    H    ASN  38           HN       ASN  38   4.430   2.189  -3.825
  258    HA   ASN  38           HA       ASN  38   3.001   3.294  -1.731
  259   1HB   ASN  38           HB2      ASN  38   2.665   1.210  -3.770
  260   2HB   ASN  38           HB1      ASN  38   1.353   1.549  -2.637
  261   1HD2  ASN  38          HD22      ASN  38   2.144   4.082  -5.686
  262   2HD2  ASN  38          HD21      ASN  38   3.025   2.648  -5.444
  263    H    CYS  39           HN       CYS  39   4.558   0.208  -1.970
  264    HA   CYS  39           HA       CYS  39   3.177  -1.281  -0.022
  265   1HB   CYS  39           HB2      CYS  39   6.110  -1.041  -0.629
  266   2HB   CYS  39           HB1      CYS  39   5.502  -2.213   0.542
  267    H    THR  40           HN       THR  40   5.414   1.390   0.544
  268    HA   THR  40           HA       THR  40   5.551   0.969   3.436
  269    HB   THR  40           HB       THR  40   6.564   3.351   3.237
  270    HG1  THR  40           HG1      THR  40   5.880   4.132   1.378
  271   1HG2  THR  40          HG22      THR  40   7.601   0.808   2.012
  272   2HG2  THR  40          HG21      THR  40   8.518   2.290   1.739
  273   3HG2  THR  40          HG23      THR  40   8.226   1.726   3.385
   
  No H/Q in entry =         273
  Start of MODEL   25
    1   1H    ASP   1           HT2      ASP   1  10.529   2.083   7.775
    2   2H    ASP   1           HT1      ASP   1   8.900   2.517   7.990
    3   3H    ASP   1           HT3      ASP   1   9.293   1.043   7.248
    4    HA   ASP   1           HA       ASP   1   8.629   2.576   5.537
    5   1HB   ASP   1           HB2      ASP   1   9.199   4.482   7.175
    6   2HB   ASP   1           HB1      ASP   1  10.850   4.351   6.567
    7    H    ASP   2           HN       ASP   2  10.337   0.288   5.723
    8    HA   ASP   2           HA       ASP   2  12.149   0.836   3.438
    9   1HB   ASP   2           HB2      ASP   2  12.973   0.085   6.276
   10   2HB   ASP   2           HB1      ASP   2  14.004  -0.334   4.898
   11    H    GLY   3           HN       GLY   3  12.930  -1.201   2.486
   12   1HA   GLY   3           HA2      GLY   3  12.526  -3.799   3.355
   13   2HA   GLY   3           HA1      GLY   3  10.976  -3.347   2.652
   14    H    LEU   4           HN       LEU   4  11.609  -5.167   1.150
   15    HA   LEU   4           HA       LEU   4  13.206  -4.092  -1.141
   16   1HB   LEU   4           HB2      LEU   4  13.153  -6.989  -0.254
   17   2HB   LEU   4           HB1      LEU   4  14.267  -6.219  -1.378
   18    HG   LEU   4           HG       LEU   4  14.113  -5.333   1.505
   19   1HD1  LEU   4          HD11      LEU   4  14.766  -7.912   0.786
   20   2HD1  LEU   4          HD13      LEU   4  16.336  -7.110   0.781
   21   3HD1  LEU   4          HD12      LEU   4  15.338  -7.088   2.237
   22   1HD2  LEU   4          HD23      LEU   4  15.863  -4.883  -0.861
   23   2HD2  LEU   4          HD22      LEU   4  15.452  -3.784   0.457
   24   3HD2  LEU   4          HD21      LEU   4  16.676  -5.030   0.697
   25    H    CYS   5           HN       CYS   5  12.683  -5.748  -3.159
   26    HA   CYS   5           HA       CYS   5   9.765  -6.492  -3.041
   27   1HB   CYS   5           HB2      CYS   5  10.177  -4.172  -4.023
   28   2HB   CYS   5           HB1      CYS   5  11.012  -4.971  -5.353
   29    H    TYR   6           HN       TYR   6   9.263  -8.301  -4.195
   30    HA   TYR   6           HA       TYR   6  11.359  -9.488  -5.973
   31   1HB   TYR   6           HB2      TYR   6  11.221 -11.599  -4.784
   32   2HB   TYR   6           HB1      TYR   6  11.531 -10.334  -3.608
   33    HD1  TYR   6           HD1      TYR   6   9.021 -12.640  -4.979
   34    HD2  TYR   6           HD2      TYR   6   9.903  -9.758  -1.944
   35    HE1  TYR   6           HE1      TYR   6   7.019 -13.374  -3.715
   36    HE2  TYR   6           HE2      TYR   6   7.889 -10.467  -0.670
   37    HH   TYR   6           HH       TYR   6   5.468 -11.812  -1.669
   38    H    GLU   7           HN       GLU   7  10.329 -11.322  -7.318
   39    HA   GLU   7           HA       GLU   7   7.432 -10.654  -7.797
   40   1HB   GLU   7           HB2      GLU   7   7.947 -10.718 -10.112
   41   2HB   GLU   7           HB1      GLU   7   9.316  -9.882  -9.392
   42   1HG   GLU   7           HG2      GLU   7  10.414 -12.239  -9.332
   43   2HG   GLU   7           HG1      GLU   7   9.093 -12.666 -10.436
   44    H    GLY   8           HN       GLY   8   6.092 -12.342  -8.501
   45   1HA   GLY   8           HA2      GLY   8   6.539 -14.884  -9.242
   46   2HA   GLY   8           HA1      GLY   8   6.903 -15.011  -7.524
   47    H    THR   9           HN       THR   9   5.179 -15.747  -6.372
   48    HA   THR   9           HA       THR   9   2.454 -14.752  -6.953
   49    HB   THR   9           HB       THR   9   3.432 -17.589  -7.082
   50    HG1  THR   9           HG1      THR   9   2.603 -17.324  -9.270
   51   1HG2  THR   9          HG21      THR   9   0.695 -16.454  -6.841
   52   2HG2  THR   9          HG23      THR   9   0.903 -17.723  -8.047
   53   3HG2  THR   9          HG22      THR   9   1.303 -18.037  -6.360
   54    H    ASN  10           HN       ASN  10   4.587 -14.966  -4.556
   55    HA   ASN  10           HA       ASN  10   3.412 -16.820  -2.670
   56   1HB   ASN  10           HB2      ASN  10   5.758 -15.997  -2.786
   57   2HB   ASN  10           HB1      ASN  10   5.199 -14.445  -2.163
   58   1HD2  ASN  10          HD22      ASN  10   4.992 -15.646   1.209
   59   2HD2  ASN  10          HD21      ASN  10   4.825 -14.283   0.153
   60    H    CYS  11           HN       CYS  11   2.451 -13.721  -3.573
   61    HA   CYS  11           HA       CYS  11   0.714 -13.549  -1.135
   62   1HB   CYS  11           HB2      CYS  11   2.214 -11.460  -2.705
   63   2HB   CYS  11           HB1      CYS  11   0.822 -11.001  -1.715
   64    H    GLY  12           HN       GLY  12   0.395 -14.781  -3.816
   65   1HA   GLY  12           HA2      GLY  12  -1.525 -15.054  -5.172
   66   2HA   GLY  12           HA1      GLY  12  -2.297 -13.815  -4.172
   67    H    LYS  13           HN       LYS  13   0.732 -12.885  -5.374
   68    HA   LYS  13           HA       LYS  13  -0.489 -10.861  -7.065
   69   1HB   LYS  13           HB2      LYS  13   1.619  -9.821  -6.883
   70   2HB   LYS  13           HB1      LYS  13   1.307 -10.624  -5.356
   71   1HG   LYS  13           HG2      LYS  13   2.610 -12.620  -6.321
   72   2HG   LYS  13           HG1      LYS  13   3.156 -11.498  -7.557
   73   1HD   LYS  13           HD2      LYS  13   3.674 -10.016  -5.392
   74   2HD   LYS  13           HD1      LYS  13   3.824 -11.613  -4.668
   75   1HE   LYS  13           HE2      LYS  13   5.153 -11.351  -7.293
   76   2HE   LYS  13           HE1      LYS  13   5.865 -10.367  -6.005
   77   1HZ   LYS  13           HZ1      LYS  13   5.562 -12.465  -4.588
   78   2HZ   LYS  13           HZ3      LYS  13   5.439 -13.285  -6.065
   79   3HZ   LYS  13           HZ2      LYS  13   6.854 -12.426  -5.690
   80    H    VAL  14           HN       VAL  14  -1.006 -13.157  -8.236
   81    HA   VAL  14           HA       VAL  14   0.963 -14.117 -10.137
   82    HB   VAL  14           HB       VAL  14  -2.058 -14.189  -9.919
   83   1HG1  VAL  14          HG12      VAL  14  -0.322 -15.613 -11.966
   84   2HG1  VAL  14          HG11      VAL  14  -2.052 -15.871 -11.735
   85   3HG1  VAL  14          HG13      VAL  14  -1.462 -14.312 -12.314
   86   1HG2  VAL  14          HG22      VAL  14  -0.214 -15.551  -8.481
   87   2HG2  VAL  14          HG21      VAL  14  -1.791 -16.224  -8.896
   88   3HG2  VAL  14          HG23      VAL  14  -0.374 -16.641  -9.860
   89    H    GLY  15           HN       GLY  15   1.863 -12.623 -11.575
   90   1HA   GLY  15           HA2      GLY  15   1.561 -11.415 -13.698
   91   2HA   GLY  15           HA1      GLY  15  -0.088 -11.020 -13.201
   92    H    LYS  16           HN       LYS  16   1.058 -10.334 -10.394
   93    HA   LYS  16           HA       LYS  16   2.132  -7.643 -11.173
   94   1HB   LYS  16           HB2      LYS  16   0.504  -8.403  -8.753
   95   2HB   LYS  16           HB1      LYS  16   0.987  -6.784  -9.244
   96   1HG   LYS  16           HG2      LYS  16  -0.352  -6.923 -11.264
   97   2HG   LYS  16           HG1      LYS  16  -0.790  -8.592 -10.901
   98   1HD   LYS  16           HD2      LYS  16  -1.396  -6.324  -8.993
   99   2HD   LYS  16           HD1      LYS  16  -2.515  -6.801 -10.271
  100   1HE   LYS  16           HE2      LYS  16  -2.854  -8.954  -9.335
  101   2HE   LYS  16           HE1      LYS  16  -1.408  -8.829  -8.315
  102   1HZ   LYS  16           HZ3      LYS  16  -2.474  -6.870  -7.248
  103   2HZ   LYS  16           HZ2      LYS  16  -3.902  -7.232  -8.095
  104   3HZ   LYS  16           HZ1      LYS  16  -3.286  -8.331  -6.956
  105    H    TYR  17           HN       TYR  17   2.741  -7.196  -8.124
  106    HA   TYR  17           HA       TYR  17   4.868  -9.263  -7.774
  107   1HB   TYR  17           HB2      TYR  17   5.492  -6.301  -7.772
  108   2HB   TYR  17           HB1      TYR  17   6.599  -7.683  -7.751
  109    HD1  TYR  17           HD1      TYR  17   4.160  -5.866  -9.929
  110    HD2  TYR  17           HD2      TYR  17   7.228  -8.824  -9.648
  111    HE1  TYR  17           HE1      TYR  17   4.271  -5.998 -12.407
  112    HE2  TYR  17           HE2      TYR  17   7.363  -8.960 -12.094
  113    HH   TYR  17           HH       TYR  17   5.532  -8.406 -14.064
  114    H    CYS  18           HN       CYS  18   6.127  -8.636  -5.486
  115    HA   CYS  18           HA       CYS  18   4.093  -7.486  -3.605
  116   1HB   CYS  18           HB2      CYS  18   5.524 -10.166  -3.552
  117   2HB   CYS  18           HB1      CYS  18   4.781  -9.473  -2.110
  118    H    CYS  19           HN       CYS  19   5.064  -6.839  -1.538
  119    HA   CYS  19           HA       CYS  19   8.006  -6.527  -1.584
  120   1HB   CYS  19           HB2      CYS  19   7.466  -4.136  -0.697
  121   2HB   CYS  19           HB1      CYS  19   7.258  -4.462  -2.419
  122    H    SER  20           HN       SER  20   8.670  -7.602   0.229
  123    HA   SER  20           HA       SER  20   7.879  -6.722   2.862
  124   1HB   SER  20           HB2      SER  20   6.945  -9.131   3.420
  125   2HB   SER  20           HB1      SER  20   5.888  -7.977   2.603
  126    HG   SER  20           HG       SER  20   6.333  -8.975   0.662
  127    HA   PRO  21           HA       PRO  21  11.851  -8.614   3.210
  128   1HB   PRO  21           HB2      PRO  21  12.289  -8.223   5.890
  129   2HB   PRO  21           HB1      PRO  21  12.421  -6.925   4.684
  130   1HG   PRO  21           HG2      PRO  21  10.202  -7.481   6.603
  131   2HG   PRO  21           HG1      PRO  21  10.814  -5.936   5.976
  132   1HD   PRO  21           HD2      PRO  21   8.522  -7.272   5.111
  133   2HD   PRO  21           HD1      PRO  21   9.370  -5.992   4.208
  134    H    ILE  22           HN       ILE  22   9.027  -9.588   4.780
  135    HA   ILE  22           HA       ILE  22   9.779 -12.408   4.797
  136    HB   ILE  22           HB       ILE  22  10.844 -11.199   6.850
  137   1HG1  ILE  22          HG12      ILE  22   9.031 -13.600   7.337
  138   2HG1  ILE  22          HG11      ILE  22  10.698 -13.670   6.768
  139   1HG2  ILE  22          HG22      ILE  22   8.451 -10.125   7.185
  140   2HG2  ILE  22          HG21      ILE  22   8.217 -11.558   8.182
  141   3HG2  ILE  22          HG23      ILE  22   9.528 -10.436   8.545
  142   1HD1  ILE  22          HD12      ILE  22  11.439 -12.572   8.873
  143   2HD1  ILE  22          HD11      ILE  22   9.771 -12.584   9.445
  144   3HD1  ILE  22          HD13      ILE  22  10.621 -14.105   9.177
  145    H    GLY  23           HN       GLY  23   7.751 -13.345   6.428
  146   1HA   GLY  23           HA2      GLY  23   5.398 -12.628   4.819
  147   2HA   GLY  23           HA1      GLY  23   5.458 -13.901   6.034
  148    H    LYS  24           HN       LYS  24   6.686 -10.970   7.197
  149    HA   LYS  24           HA       LYS  24   4.316 -10.659   8.881
  150   1HB   LYS  24           HB2      LYS  24   5.688  -9.360  10.291
  151   2HB   LYS  24           HB1      LYS  24   6.723 -10.642   9.675
  152   1HG   LYS  24           HG2      LYS  24   7.363  -8.973   7.815
  153   2HG   LYS  24           HG1      LYS  24   6.627  -7.752   8.849
  154   1HD   LYS  24           HD2      LYS  24   8.581  -9.617  10.113
  155   2HD   LYS  24           HD1      LYS  24   9.220  -8.357   9.057
  156   1HE   LYS  24           HE2      LYS  24   7.980  -6.645  10.379
  157   2HE   LYS  24           HE1      LYS  24   7.427  -7.928  11.475
  158   1HZ   LYS  24           HZ1      LYS  24  10.283  -7.469  10.815
  159   2HZ   LYS  24           HZ3      LYS  24   9.531  -6.791  12.176
  160   3HZ   LYS  24           HZ2      LYS  24   9.649  -8.479  12.026
  161    H    TYR  25           HN       TYR  25   4.716  -9.700   5.872
  162    HA   TYR  25           HA       TYR  25   3.125  -7.237   6.254
  163   1HB   TYR  25           HB2      TYR  25   5.844  -7.392   4.959
  164   2HB   TYR  25           HB1      TYR  25   4.693  -6.135   4.512
  165    HD1  TYR  25           HD2      TYR  25   3.618  -4.816   6.593
  166    HD2  TYR  25           HD1      TYR  25   7.315  -6.991   6.662
  167    HE1  TYR  25           HE2      TYR  25   4.345  -3.511   8.574
  168    HE2  TYR  25           HE1      TYR  25   8.056  -5.676   8.641
  169    HH   TYR  25           HH       TYR  25   6.995  -4.391  10.486
  170    H    CYS  26           HN       CYS  26   4.811  -9.156   3.724
  171    HA   CYS  26           HA       CYS  26   4.077  -9.624   1.476
  172   1HB   CYS  26           HB2      CYS  26   3.127 -11.472   2.733
  173   2HB   CYS  26           HB1      CYS  26   1.829 -10.456   3.373
  174    H    VAL  27           HN       VAL  27   3.903  -7.125   1.024
  175    HA   VAL  27           HA       VAL  27   1.002  -6.356   0.693
  176    HB   VAL  27           HB       VAL  27   3.525  -4.672   0.881
  177   1HG1  VAL  27          HG13      VAL  27   1.127  -4.035  -0.309
  178   2HG1  VAL  27          HG12      VAL  27   0.883  -3.455   1.338
  179   3HG1  VAL  27          HG11      VAL  27   2.245  -2.861   0.387
  180   1HG2  VAL  27          HG23      VAL  27   1.301  -5.212   2.878
  181   2HG2  VAL  27          HG22      VAL  27   2.977  -5.746   3.018
  182   3HG2  VAL  27          HG21      VAL  27   2.588  -4.028   3.101
  183    H    CYS  28           HN       CYS  28   0.422  -6.735  -1.426
  184    HA   CYS  28           HA       CYS  28   2.531  -6.341  -3.521
  185   1HB   CYS  28           HB2      CYS  28   0.014  -8.011  -3.600
  186   2HB   CYS  28           HB1      CYS  28   1.393  -8.128  -4.689
  187    H    TYR  29           HN       TYR  29   1.846  -5.637  -5.617
  188    HA   TYR  29           HA       TYR  29  -0.717  -4.161  -5.806
  189   1HB   TYR  29           HB2      TYR  29   2.036  -3.021  -6.187
  190   2HB   TYR  29           HB1      TYR  29   0.532  -2.197  -6.541
  191    HD1  TYR  29           HD1      TYR  29   2.568  -3.688  -3.883
  192    HD2  TYR  29           HD2      TYR  29  -0.711  -1.138  -4.867
  193    HE1  TYR  29           HE1      TYR  29   2.528  -2.861  -1.557
  194    HE2  TYR  29           HE2      TYR  29  -0.783  -0.300  -2.542
  195    HH   TYR  29           HH       TYR  29   0.634  -0.131  -0.600
  196    H    ASP  30           HN       ASP  30  -0.735  -3.171  -8.186
  197    HA   ASP  30           HA       ASP  30   0.029  -5.307 -10.014
  198   1HB   ASP  30           HB2      ASP  30  -1.361  -4.207 -11.531
  199   2HB   ASP  30           HB1      ASP  30  -2.118  -3.947  -9.963
  200    H    SER  31           HN       SER  31   0.999  -1.917  -9.515
  201    HA   SER  31           HA       SER  31   2.957  -2.041 -11.730
  202   1HB   SER  31           HB2      SER  31   2.814   0.028  -9.594
  203   2HB   SER  31           HB1      SER  31   3.297   0.221 -11.272
  204    HG   SER  31           HG       SER  31   1.158  -0.161 -11.875
  205    H    LYS  32           HN       LYS  32   4.908  -3.272 -11.351
  206    HA   LYS  32           HA       LYS  32   5.764  -4.145  -8.799
  207   1HB   LYS  32           HB2      LYS  32   7.818  -4.730  -9.918
  208   2HB   LYS  32           HB1      LYS  32   6.628  -4.700 -11.224
  209   1HG   LYS  32           HG2      LYS  32   7.384  -2.567 -12.006
  210   2HG   LYS  32           HG1      LYS  32   8.334  -2.293 -10.549
  211   1HD   LYS  32           HD2      LYS  32   8.916  -4.148 -12.876
  212   2HD   LYS  32           HD1      LYS  32   9.976  -2.950 -12.136
  213   1HE   LYS  32           HE2      LYS  32   9.966  -4.414 -10.017
  214   2HE   LYS  32           HE1      LYS  32   9.193  -5.676 -11.005
  215   1HZ   LYS  32           HZ1      LYS  32  11.002  -5.355 -12.646
  216   2HZ   LYS  32           HZ3      LYS  32  11.777  -4.308 -11.560
  217   3HZ   LYS  32           HZ2      LYS  32  11.557  -5.943 -11.152
  218    H    ALA  33           HN       ALA  33   6.235  -1.061 -10.481
  219    HA   ALA  33           HA       ALA  33   8.036   0.218  -8.721
  220   1HB   ALA  33           HB1      ALA  33   7.133   0.955 -11.002
  221   2HB   ALA  33           HB3      ALA  33   5.636   1.390 -10.174
  222   3HB   ALA  33           HB2      ALA  33   7.140   2.224  -9.775
  223    H    ILE  34           HN       ILE  34   4.384  -0.002  -8.662
  224    HA   ILE  34           HA       ILE  34   4.041   1.576  -6.372
  225    HB   ILE  34           HB       ILE  34   2.645  -0.647  -7.719
  226   1HG1  ILE  34          HG12      ILE  34   2.323   2.335  -7.403
  227   2HG1  ILE  34          HG11      ILE  34   2.457   1.397  -8.885
  228   1HG2  ILE  34          HG22      ILE  34   2.197  -0.690  -5.194
  229   2HG2  ILE  34          HG21      ILE  34   1.518   0.923  -5.376
  230   3HG2  ILE  34          HG23      ILE  34   0.771  -0.442  -6.197
  231   1HD1  ILE  34          HD12      ILE  34   0.271   0.285  -8.209
  232   2HD1  ILE  34          HD11      ILE  34   0.131   1.541  -6.979
  233   3HD1  ILE  34          HD13      ILE  34   0.155   1.980  -8.688
  234    H    CYS  35           HN       CYS  35   5.190  -1.587  -6.799
  235    HA   CYS  35           HA       CYS  35   4.883  -2.630  -4.122
  236   1HB   CYS  35           HB2      CYS  35   5.601  -4.090  -5.964
  237   2HB   CYS  35           HB1      CYS  35   7.034  -3.083  -6.245
  238    H    ASN  36           HN       ASN  36   7.897  -1.342  -5.626
  239    HA   ASN  36           HA       ASN  36   9.233  -0.750  -3.159
  240   1HB   ASN  36           HB2      ASN  36   9.299   0.529  -5.928
  241   2HB   ASN  36           HB1      ASN  36  10.457   0.929  -4.652
  242   1HD2  ASN  36          HD22      ASN  36  10.790  -2.611  -6.638
  243   2HD2  ASN  36          HD21      ASN  36   9.481  -1.572  -6.934
  244    H    LYS  37           HN       LYS  37   7.380   1.517  -5.187
  245    HA   LYS  37           HA       LYS  37   7.518   3.796  -3.551
  246   1HB   LYS  37           HB2      LYS  37   6.898   3.497  -5.980
  247   2HB   LYS  37           HB1      LYS  37   5.301   3.002  -5.424
  248   1HG   LYS  37           HG2      LYS  37   6.535   5.623  -4.556
  249   2HG   LYS  37           HG1      LYS  37   5.608   5.491  -6.050
  250   1HD   LYS  37           HD2      LYS  37   3.878   4.283  -4.383
  251   2HD   LYS  37           HD1      LYS  37   4.677   5.341  -3.223
  252   1HE   LYS  37           HE2      LYS  37   3.511   6.317  -5.860
  253   2HE   LYS  37           HE1      LYS  37   2.662   6.409  -4.304
  254   1HZ   LYS  37           HZ3      LYS  37   4.535   7.620  -3.383
  255   2HZ   LYS  37           HZ2      LYS  37   5.354   7.538  -4.870
  256   3HZ   LYS  37           HZ1      LYS  37   3.920   8.438  -4.735
  257    H    ASN  38           HN       ASN  38   4.331   2.321  -4.145
  258    HA   ASN  38           HA       ASN  38   3.082   3.439  -1.946
  259   1HB   ASN  38           HB2      ASN  38   2.653   1.238  -3.843
  260   2HB   ASN  38           HB1      ASN  38   1.457   1.556  -2.581
  261   1HD2  ASN  38          HD22      ASN  38   1.727   3.965  -5.814
  262   2HD2  ASN  38          HD21      ASN  38   2.718   2.597  -5.614
  263    H    CYS  39           HN       CYS  39   4.753   0.417  -2.264
  264    HA   CYS  39           HA       CYS  39   3.707  -1.016  -0.070
  265   1HB   CYS  39           HB2      CYS  39   6.539  -0.740  -1.054
  266   2HB   CYS  39           HB1      CYS  39   6.039  -1.975   0.109
  267    H    THR  40           HN       THR  40   5.895   1.755   0.041
  268    HA   THR  40           HA       THR  40   6.532   1.429   2.879
  269    HB   THR  40           HB       THR  40   7.365   3.855   2.473
  270    HG1  THR  40           HG1      THR  40   7.510   4.350   0.245
  271   1HG2  THR  40          HG21      THR  40   8.362   1.408   0.981
  272   2HG2  THR  40          HG23      THR  40   9.208   2.955   0.867
  273   3HG2  THR  40          HG22      THR  40   9.030   2.162   2.434
   
  No H/Q in entry =         273
  Start of MODEL   26
    1   1H    ASP   1           HT3      ASP   1   8.351   0.403   6.821
    2   2H    ASP   1           HT2      ASP   1   9.173   1.801   7.326
    3   3H    ASP   1           HT1      ASP   1   7.489   1.835   7.111
    4    HA   ASP   1           HA       ASP   1   7.680   1.646   4.760
    5   1HB   ASP   1           HB2      ASP   1   9.660   3.548   6.049
    6   2HB   ASP   1           HB1      ASP   1   9.088   3.702   4.388
    7    H    ASP   2           HN       ASP   2  10.340   0.382   6.478
    8    HA   ASP   2           HA       ASP   2  12.199   0.283   4.194
    9   1HB   ASP   2           HB2      ASP   2  12.201  -1.109   6.940
   10   2HB   ASP   2           HB1      ASP   2  13.583  -1.008   5.843
   11    H    GLY   3           HN       GLY   3  12.652  -1.583   2.972
   12   1HA   GLY   3           HA2      GLY   3  11.933  -4.221   3.415
   13   2HA   GLY   3           HA1      GLY   3  10.495  -3.511   2.687
   14    H    LEU   4           HN       LEU   4  11.359  -5.362   1.141
   15    HA   LEU   4           HA       LEU   4  12.980  -4.033  -0.995
   16   1HB   LEU   4           HB2      LEU   4  13.042  -6.980  -0.282
   17   2HB   LEU   4           HB1      LEU   4  14.138  -6.104  -1.348
   18    HG   LEU   4           HG       LEU   4  13.888  -5.364   1.570
   19   1HD1  LEU   4          HD11      LEU   4  14.681  -7.873   0.745
   20   2HD1  LEU   4          HD13      LEU   4  16.209  -6.997   0.814
   21   3HD1  LEU   4          HD12      LEU   4  15.183  -7.092   2.245
   22   1HD2  LEU   4          HD22      LEU   4  15.634  -4.698  -0.741
   23   2HD2  LEU   4          HD21      LEU   4  15.189  -3.710   0.653
   24   3HD2  LEU   4          HD23      LEU   4  16.460  -4.923   0.801
   25    H    CYS   5           HN       CYS   5  12.624  -5.561  -3.153
   26    HA   CYS   5           HA       CYS   5   9.708  -6.354  -3.214
   27   1HB   CYS   5           HB2      CYS   5  10.226  -4.026  -4.138
   28   2HB   CYS   5           HB1      CYS   5  11.102  -4.834  -5.436
   29    H    TYR   6           HN       TYR   6   9.309  -8.200  -4.269
   30    HA   TYR   6           HA       TYR   6  11.395  -9.351  -6.078
   31   1HB   TYR   6           HB2      TYR   6  11.314 -11.460  -4.872
   32   2HB   TYR   6           HB1      TYR   6  11.644 -10.182  -3.717
   33    HD1  TYR   6           HD1      TYR   6   9.107 -12.506  -5.010
   34    HD2  TYR   6           HD2      TYR   6  10.071  -9.624  -1.999
   35    HE1  TYR   6           HE1      TYR   6   7.151 -13.250  -3.687
   36    HE2  TYR   6           HE2      TYR   6   8.101 -10.348  -0.663
   37    HH   TYR   6           HH       TYR   6   5.787 -11.523  -1.301
   38    H    GLU   7           HN       GLU   7  10.359 -11.196  -7.407
   39    HA   GLU   7           HA       GLU   7   7.433 -10.582  -7.778
   40   1HB   GLU   7           HB2      GLU   7   7.865 -10.614 -10.110
   41   2HB   GLU   7           HB1      GLU   7   9.240  -9.756  -9.433
   42   1HG   GLU   7           HG2      GLU   7  10.388 -12.092  -9.436
   43   2HG   GLU   7           HG1      GLU   7   9.037 -12.534 -10.497
   44    H    GLY   8           HN       GLY   8   6.093 -12.285  -8.428
   45   1HA   GLY   8           HA2      GLY   8   6.558 -14.809  -9.224
   46   2HA   GLY   8           HA1      GLY   8   6.994 -14.950  -7.524
   47    H    THR   9           HN       THR   9   5.326 -15.699  -6.285
   48    HA   THR   9           HA       THR   9   2.562 -14.770  -6.787
   49    HB   THR   9           HB       THR   9   3.587 -17.590  -6.912
   50    HG1  THR   9           HG1      THR   9   3.792 -17.103  -8.925
   51   1HG2  THR   9          HG22      THR   9   0.814 -16.473  -6.757
   52   2HG2  THR   9          HG21      THR   9   1.089 -17.865  -7.803
   53   3HG2  THR   9          HG23      THR   9   1.458 -17.969  -6.083
   54    H    ASN  10           HN       ASN  10   4.751 -14.888  -4.446
   55    HA   ASN  10           HA       ASN  10   3.704 -16.775  -2.521
   56   1HB   ASN  10           HB2      ASN  10   6.005 -15.843  -2.700
   57   2HB   ASN  10           HB1      ASN  10   5.390 -14.318  -2.060
   58   1HD2  ASN  10          HD22      ASN  10   5.337 -15.532   1.315
   59   2HD2  ASN  10          HD21      ASN  10   5.078 -14.177   0.267
   60    H    CYS  11           HN       CYS  11   2.603 -13.715  -3.410
   61    HA   CYS  11           HA       CYS  11   0.877 -13.619  -0.959
   62   1HB   CYS  11           HB2      CYS  11   2.264 -11.464  -2.543
   63   2HB   CYS  11           HB1      CYS  11   0.849 -11.070  -1.559
   64    H    GLY  12           HN       GLY  12   0.601 -14.867  -3.644
   65   1HA   GLY  12           HA2      GLY  12  -1.309 -15.221  -4.997
   66   2HA   GLY  12           HA1      GLY  12  -2.138 -14.034  -3.980
   67    H    LYS  13           HN       LYS  13   0.840 -12.955  -5.196
   68    HA   LYS  13           HA       LYS  13  -0.480 -10.957  -6.841
   69   1HB   LYS  13           HB2      LYS  13   1.590  -9.841  -6.668
   70   2HB   LYS  13           HB1      LYS  13   1.330 -10.680  -5.151
   71   1HG   LYS  13           HG2      LYS  13   2.699 -12.608  -6.167
   72   2HG   LYS  13           HG1      LYS  13   3.187 -11.440  -7.386
   73   1HD   LYS  13           HD2      LYS  13   3.725  -9.951  -5.284
   74   2HD   LYS  13           HD1      LYS  13   3.810 -11.507  -4.467
   75   1HE   LYS  13           HE2      LYS  13   5.241 -11.312  -7.070
   76   2HE   LYS  13           HE1      LYS  13   5.954 -10.443  -5.699
   77   1HZ   LYS  13           HZ2      LYS  13   5.541 -12.515  -4.374
   78   2HZ   LYS  13           HZ1      LYS  13   5.217 -13.308  -5.838
   79   3HZ   LYS  13           HZ3      LYS  13   6.752 -12.649  -5.559
   80    H    VAL  14           HN       VAL  14  -0.931 -13.247  -8.035
   81    HA   VAL  14           HA       VAL  14   1.037 -14.111  -9.982
   82    HB   VAL  14           HB       VAL  14  -1.972 -14.308  -9.688
   83   1HG1  VAL  14          HG11      VAL  14  -0.265 -15.035 -12.017
   84   2HG1  VAL  14          HG13      VAL  14  -1.459 -16.231 -11.515
   85   3HG1  VAL  14          HG12      VAL  14  -1.974 -14.606 -11.966
   86   1HG2  VAL  14          HG22      VAL  14   0.261 -16.355  -9.471
   87   2HG2  VAL  14          HG21      VAL  14  -0.633 -15.649  -8.124
   88   3HG2  VAL  14          HG23      VAL  14  -1.455 -16.702  -9.275
   89    H    GLY  15           HN       GLY  15   1.854 -12.571 -11.427
   90   1HA   GLY  15           HA2      GLY  15   1.447 -11.355 -13.529
   91   2HA   GLY  15           HA1      GLY  15  -0.195 -11.010 -12.974
   92    H    LYS  16           HN       LYS  16   1.009 -10.321 -10.196
   93    HA   LYS  16           HA       LYS  16   2.008  -7.603 -10.981
   94   1HB   LYS  16           HB2      LYS  16   0.474  -8.408  -8.516
   95   2HB   LYS  16           HB1      LYS  16   0.907  -6.778  -9.013
   96   1HG   LYS  16           HG2      LYS  16  -0.445  -7.074 -11.085
   97   2HG   LYS  16           HG1      LYS  16  -0.983  -8.639 -10.476
   98   1HD   LYS  16           HD2      LYS  16  -1.335  -6.601  -8.441
   99   2HD   LYS  16           HD1      LYS  16  -2.131  -6.116  -9.938
  100   1HE   LYS  16           HE2      LYS  16  -2.829  -8.782  -9.773
  101   2HE   LYS  16           HE1      LYS  16  -2.844  -8.277  -8.071
  102   1HZ   LYS  16           HZ3      LYS  16  -4.080  -6.693 -10.255
  103   2HZ   LYS  16           HZ2      LYS  16  -4.949  -7.805  -9.311
  104   3HZ   LYS  16           HZ1      LYS  16  -4.237  -6.443  -8.586
  105    H    TYR  17           HN       TYR  17   2.729  -7.134  -7.987
  106    HA   TYR  17           HA       TYR  17   4.864  -9.194  -7.674
  107   1HB   TYR  17           HB2      TYR  17   5.495  -6.230  -7.752
  108   2HB   TYR  17           HB1      TYR  17   6.598  -7.619  -7.756
  109    HD1  TYR  17           HD1      TYR  17   4.112  -5.786  -9.859
  110    HD2  TYR  17           HD2      TYR  17   7.094  -8.838  -9.659
  111    HE1  TYR  17           HE1      TYR  17   4.114  -5.960 -12.336
  112    HE2  TYR  17           HE2      TYR  17   7.116  -9.019 -12.107
  113    HH   TYR  17           HH       TYR  17   4.800  -7.223 -14.097
  114    H    CYS  18           HN       CYS  18   6.181  -8.565  -5.426
  115    HA   CYS  18           HA       CYS  18   4.203  -7.364  -3.510
  116   1HB   CYS  18           HB2      CYS  18   5.603 -10.059  -3.462
  117   2HB   CYS  18           HB1      CYS  18   4.893  -9.347  -2.013
  118    H    CYS  19           HN       CYS  19   5.205  -6.731  -1.455
  119    HA   CYS  19           HA       CYS  19   8.152  -6.465  -1.508
  120   1HB   CYS  19           HB2      CYS  19   7.655  -4.045  -0.662
  121   2HB   CYS  19           HB1      CYS  19   7.449  -4.398  -2.378
  122    H    SER  20           HN       SER  20   8.779  -7.545   0.320
  123    HA   SER  20           HA       SER  20   8.003  -6.621   2.946
  124   1HB   SER  20           HB2      SER  20   7.007  -9.001   3.523
  125   2HB   SER  20           HB1      SER  20   5.983  -7.826   2.693
  126    HG   SER  20           HG       SER  20   6.169  -8.934   0.861
  127    HA   PRO  21           HA       PRO  21  11.908  -8.643   3.373
  128   1HB   PRO  21           HB2      PRO  21  12.303  -8.290   6.062
  129   2HB   PRO  21           HB1      PRO  21  12.487  -6.982   4.873
  130   1HG   PRO  21           HG2      PRO  21  10.231  -7.497   6.755
  131   2HG   PRO  21           HG1      PRO  21  10.878  -5.963   6.136
  132   1HD   PRO  21           HD2      PRO  21   8.575  -7.275   5.243
  133   2HD   PRO  21           HD1      PRO  21   9.435  -5.984   4.371
  134    H    ILE  22           HN       ILE  22   9.016  -9.662   4.659
  135    HA   ILE  22           HA       ILE  22   9.835 -12.458   4.849
  136    HB   ILE  22           HB       ILE  22  10.571 -11.164   6.992
  137   1HG1  ILE  22          HG12      ILE  22   8.772 -13.601   7.318
  138   2HG1  ILE  22          HG11      ILE  22  10.495 -13.650   6.947
  139   1HG2  ILE  22          HG22      ILE  22   8.031 -10.259   6.928
  140   2HG2  ILE  22          HG21      ILE  22   7.865 -11.593   8.067
  141   3HG2  ILE  22          HG23      ILE  22   9.022 -10.300   8.386
  142   1HD1  ILE  22          HD13      ILE  22  10.476 -12.055   9.174
  143   2HD1  ILE  22          HD12      ILE  22   9.135 -13.148   9.520
  144   3HD1  ILE  22          HD11      ILE  22  10.742 -13.800   9.203
  145    H    GLY  23           HN       GLY  23   7.687 -13.511   6.121
  146   1HA   GLY  23           HA2      GLY  23   5.490 -12.810   4.284
  147   2HA   GLY  23           HA1      GLY  23   5.514 -14.181   5.386
  148    H    LYS  24           HN       LYS  24   6.351 -11.279   6.926
  149    HA   LYS  24           HA       LYS  24   3.835 -11.366   8.401
  150   1HB   LYS  24           HB2      LYS  24   4.891  -9.903   9.944
  151   2HB   LYS  24           HB1      LYS  24   6.122 -11.038   9.407
  152   1HG   LYS  24           HG2      LYS  24   6.747  -9.280   7.644
  153   2HG   LYS  24           HG1      LYS  24   5.745  -8.163   8.566
  154   1HD   LYS  24           HD2      LYS  24   7.886  -9.781   9.933
  155   2HD   LYS  24           HD1      LYS  24   8.285  -8.270   9.117
  156   1HE   LYS  24           HE2      LYS  24   7.823  -7.571  11.331
  157   2HE   LYS  24           HE1      LYS  24   6.279  -7.289  10.503
  158   1HZ   LYS  24           HZ1      LYS  24   6.613  -9.999  11.422
  159   2HZ   LYS  24           HZ3      LYS  24   6.607  -8.868  12.686
  160   3HZ   LYS  24           HZ2      LYS  24   5.295  -8.945  11.611
  161    H    TYR  25           HN       TYR  25   5.483  -8.991   6.302
  162    HA   TYR  25           HA       TYR  25   3.163  -7.185   6.422
  163   1HB   TYR  25           HB2      TYR  25   5.888  -7.144   5.142
  164   2HB   TYR  25           HB1      TYR  25   4.672  -5.936   4.725
  165    HD1  TYR  25           HD1      TYR  25   3.586  -4.610   6.670
  166    HD2  TYR  25           HD2      TYR  25   7.194  -6.897   7.067
  167    HE1  TYR  25           HE1      TYR  25   4.160  -3.339   8.725
  168    HE2  TYR  25           HE2      TYR  25   7.778  -5.622   9.131
  169    HH   TYR  25           HH       TYR  25   7.201  -3.322  10.080
  170    H    CYS  26           HN       CYS  26   4.895  -8.977   3.836
  171    HA   CYS  26           HA       CYS  26   4.161  -9.481   1.605
  172   1HB   CYS  26           HB2      CYS  26   3.172 -11.306   2.869
  173   2HB   CYS  26           HB1      CYS  26   1.880 -10.266   3.481
  174    H    VAL  27           HN       VAL  27   4.042  -6.986   1.135
  175    HA   VAL  27           HA       VAL  27   1.160  -6.143   0.812
  176    HB   VAL  27           HB       VAL  27   3.733  -4.531   0.967
  177   1HG1  VAL  27          HG11      VAL  27   1.309  -3.846  -0.182
  178   2HG1  VAL  27          HG13      VAL  27   1.167  -3.198   1.452
  179   3HG1  VAL  27          HG12      VAL  27   2.512  -2.704   0.423
  180   1HG2  VAL  27          HG22      VAL  27   1.642  -5.318   2.983
  181   2HG2  VAL  27          HG21      VAL  27   3.396  -5.296   3.157
  182   3HG2  VAL  27          HG23      VAL  27   2.492  -3.783   3.159
  183    H    CYS  28           HN       CYS  28   0.568  -6.559  -1.283
  184    HA   CYS  28           HA       CYS  28   2.648  -6.202  -3.413
  185   1HB   CYS  28           HB2      CYS  28   0.116  -7.854  -3.431
  186   2HB   CYS  28           HB1      CYS  28   1.476  -7.993  -4.543
  187    H    TYR  29           HN       TYR  29   1.918  -5.526  -5.507
  188    HA   TYR  29           HA       TYR  29  -0.636  -4.032  -5.654
  189   1HB   TYR  29           HB2      TYR  29   2.113  -2.922  -6.137
  190   2HB   TYR  29           HB1      TYR  29   0.604  -2.092  -6.450
  191    HD1  TYR  29           HD1      TYR  29   2.726  -3.554  -3.841
  192    HD2  TYR  29           HD2      TYR  29  -0.583  -1.013  -4.746
  193    HE1  TYR  29           HE1      TYR  29   2.764  -2.698  -1.526
  194    HE2  TYR  29           HE2      TYR  29  -0.574  -0.144  -2.432
  195    HH   TYR  29           HH       TYR  29   1.042   0.068  -0.551
  196    H    ASP  30           HN       ASP  30  -0.767  -3.140  -8.048
  197    HA   ASP  30           HA       ASP  30  -0.014  -5.306  -9.842
  198   1HB   ASP  30           HB2      ASP  30  -1.480  -4.282 -11.339
  199   2HB   ASP  30           HB1      ASP  30  -2.187  -3.991  -9.753
  200    H    SER  31           HN       SER  31   0.915  -1.898  -9.448
  201    HA   SER  31           HA       SER  31   2.776  -2.033 -11.744
  202   1HB   SER  31           HB2      SER  31   2.696   0.069  -9.637
  203   2HB   SER  31           HB1      SER  31   3.105   0.241 -11.336
  204    HG   SER  31           HG       SER  31   1.085   0.809 -11.484
  205    H    LYS  32           HN       LYS  32   4.761  -3.230 -11.434
  206    HA   LYS  32           HA       LYS  32   5.747  -4.052  -8.908
  207   1HB   LYS  32           HB2      LYS  32   7.765  -4.606 -10.122
  208   2HB   LYS  32           HB1      LYS  32   6.500  -4.634 -11.357
  209   1HG   LYS  32           HG2      LYS  32   7.185  -2.574 -12.283
  210   2HG   LYS  32           HG1      LYS  32   8.109  -2.133 -10.847
  211   1HD   LYS  32           HD2      LYS  32   9.783  -2.832 -12.397
  212   2HD   LYS  32           HD1      LYS  32   9.535  -4.257 -11.377
  213   1HE   LYS  32           HE2      LYS  32   7.877  -5.129 -13.083
  214   2HE   LYS  32           HE1      LYS  32   8.322  -3.771 -14.140
  215   1HZ   LYS  32           HZ2      LYS  32  10.690  -4.469 -13.789
  216   2HZ   LYS  32           HZ1      LYS  32  10.103  -5.893 -13.070
  217   3HZ   LYS  32           HZ3      LYS  32   9.754  -5.559 -14.696
  218    H    ALA  33           HN       ALA  33   6.081  -0.984 -10.652
  219    HA   ALA  33           HA       ALA  33   7.940   0.347  -8.993
  220   1HB   ALA  33           HB3      ALA  33   6.937   1.041 -11.241
  221   2HB   ALA  33           HB2      ALA  33   5.461   1.455 -10.364
  222   3HB   ALA  33           HB1      ALA  33   6.959   2.327 -10.031
  223    H    ILE  34           HN       ILE  34   4.299   0.080  -8.772
  224    HA   ILE  34           HA       ILE  34   4.037   1.688  -6.490
  225    HB   ILE  34           HB       ILE  34   2.605  -0.565  -7.748
  226   1HG1  ILE  34          HG12      ILE  34   2.271   2.419  -7.464
  227   2HG1  ILE  34          HG11      ILE  34   2.355   1.461  -8.937
  228   1HG2  ILE  34          HG22      ILE  34   2.260  -0.575  -5.211
  229   2HG2  ILE  34          HG21      ILE  34   1.579   1.038  -5.377
  230   3HG2  ILE  34          HG23      ILE  34   0.789  -0.332  -6.149
  231   1HD1  ILE  34          HD11      ILE  34   0.208   0.341  -8.160
  232   2HD1  ILE  34          HD13      ILE  34   0.106   1.609  -6.941
  233   3HD1  ILE  34          HD12      ILE  34   0.058   2.028  -8.656
  234    H    CYS  35           HN       CYS  35   5.199  -1.467  -6.930
  235    HA   CYS  35           HA       CYS  35   5.003  -2.478  -4.229
  236   1HB   CYS  35           HB2      CYS  35   5.638  -3.938  -6.118
  237   2HB   CYS  35           HB1      CYS  35   7.088  -2.957  -6.411
  238    H    ASN  36           HN       ASN  36   7.947  -1.203  -5.875
  239    HA   ASN  36           HA       ASN  36   9.391  -0.583  -3.470
  240   1HB   ASN  36           HB2      ASN  36  10.388  -0.591  -5.726
  241   2HB   ASN  36           HB1      ASN  36   9.354   0.757  -6.222
  242   1HD2  ASN  36          HD22      ASN  36  11.948   2.949  -5.253
  243   2HD2  ASN  36          HD21      ASN  36  10.891   2.441  -6.478
  244    H    LYS  37           HN       LYS  37   7.441   1.646  -5.451
  245    HA   LYS  37           HA       LYS  37   7.635   3.949  -3.858
  246   1HB   LYS  37           HB2      LYS  37   6.903   3.609  -6.251
  247   2HB   LYS  37           HB1      LYS  37   5.340   3.106  -5.614
  248   1HG   LYS  37           HG2      LYS  37   6.578   5.754  -4.843
  249   2HG   LYS  37           HG1      LYS  37   5.587   5.587  -6.291
  250   1HD   LYS  37           HD2      LYS  37   3.962   4.373  -4.513
  251   2HD   LYS  37           HD1      LYS  37   4.787   5.488  -3.427
  252   1HE   LYS  37           HE2      LYS  37   4.029   6.841  -5.897
  253   2HE   LYS  37           HE1      LYS  37   2.618   6.114  -5.104
  254   1HZ   LYS  37           HZ1      LYS  37   3.339   7.082  -3.009
  255   2HZ   LYS  37           HZ3      LYS  37   4.674   7.797  -3.772
  256   3HZ   LYS  37           HZ2      LYS  37   3.101   8.296  -4.174
  257    H    ASN  38           HN       ASN  38   4.438   2.435  -4.276
  258    HA   ASN  38           HA       ASN  38   3.292   3.560  -2.027
  259   1HB   ASN  38           HB2      ASN  38   2.788   1.337  -3.880
  260   2HB   ASN  38           HB1      ASN  38   1.657   1.654  -2.560
  261   1HD2  ASN  38          HD22      ASN  38   1.729   4.033  -5.825
  262   2HD2  ASN  38          HD21      ASN  38   2.743   2.677  -5.664
  263    H    CYS  39           HN       CYS  39   4.965   0.534  -2.401
  264    HA   CYS  39           HA       CYS  39   4.052  -0.854  -0.115
  265   1HB   CYS  39           HB2      CYS  39   6.819  -0.621  -1.281
  266   2HB   CYS  39           HB1      CYS  39   6.394  -1.811  -0.048
  267    H    THR  40           HN       THR  40   6.293   1.876  -0.218
  268    HA   THR  40           HA       THR  40   7.080   1.637   2.591
  269    HB   THR  40           HB       THR  40   7.947   4.023   2.046
  270    HG1  THR  40           HG1      THR  40   7.614   4.748   0.085
  271   1HG2  THR  40          HG23      THR  40   8.791   1.408   0.887
  272   2HG2  THR  40          HG22      THR  40   9.492   2.840   0.129
  273   3HG2  THR  40          HG21      THR  40   9.713   2.562   1.856
   
  No H/Q in entry =         273
  Start of MODEL   27
    1   1H    ASP   1           HT1      ASP   1  10.812   4.665   3.349
    2   2H    ASP   1           HT3      ASP   1   9.536   5.117   2.326
    3   3H    ASP   1           HT2      ASP   1   9.459   3.651   3.180
    4    HA   ASP   1           HA       ASP   1  10.017   3.204   0.878
    5   1HB   ASP   1           HB2      ASP   1  11.982   4.304  -0.074
    6   2HB   ASP   1           HB1      ASP   1  10.893   5.524   0.581
    7    H    ASP   2           HN       ASP   2  11.015   2.696   3.920
    8    HA   ASP   2           HA       ASP   2  13.503   1.195   3.412
    9   1HB   ASP   2           HB2      ASP   2  11.655   1.394   5.867
   10   2HB   ASP   2           HB1      ASP   2  13.289   0.717   5.871
   11    H    GLY   3           HN       GLY   3  13.216  -0.682   2.248
   12   1HA   GLY   3           HA2      GLY   3  12.165  -3.019   3.293
   13   2HA   GLY   3           HA1      GLY   3  10.810  -2.304   2.424
   14    H    LEU   4           HN       LEU   4  11.446  -4.600   1.383
   15    HA   LEU   4           HA       LEU   4  13.074  -3.974  -1.050
   16   1HB   LEU   4           HB2      LEU   4  12.960  -6.653   0.365
   17   2HB   LEU   4           HB1      LEU   4  14.077  -6.145  -0.898
   18    HG   LEU   4           HG       LEU   4  13.978  -4.704   1.755
   19   1HD1  LEU   4          HD12      LEU   4  15.090  -7.373   1.112
   20   2HD1  LEU   4          HD11      LEU   4  16.174  -6.279   1.972
   21   3HD1  LEU   4          HD13      LEU   4  14.608  -6.696   2.668
   22   1HD2  LEU   4          HD21      LEU   4  15.706  -4.772  -0.666
   23   2HD2  LEU   4          HD23      LEU   4  15.351  -3.430   0.424
   24   3HD2  LEU   4          HD22      LEU   4  16.542  -4.648   0.882
   25    H    CYS   5           HN       CYS   5  12.514  -5.937  -2.763
   26    HA   CYS   5           HA       CYS   5   9.628  -6.711  -2.489
   27   1HB   CYS   5           HB2      CYS   5   9.881  -4.447  -3.645
   28   2HB   CYS   5           HB1      CYS   5  10.686  -5.302  -4.959
   29    H    TYR   6           HN       TYR   6   9.022  -8.449  -3.825
   30    HA   TYR   6           HA       TYR   6  11.208  -9.772  -5.385
   31   1HB   TYR   6           HB2      TYR   6  10.885 -11.845  -4.213
   32   2HB   TYR   6           HB1      TYR   6  11.030 -10.601  -2.985
   33    HD1  TYR   6           HD1      TYR   6   8.734 -12.859  -4.748
   34    HD2  TYR   6           HD2      TYR   6   9.166 -10.021  -1.576
   35    HE1  TYR   6           HE1      TYR   6   6.555 -13.582  -3.818
   36    HE2  TYR   6           HE2      TYR   6   6.974 -10.724  -0.637
   37    HH   TYR   6           HH       TYR   6   5.539 -12.835  -0.728
   38    H    GLU   7           HN       GLU   7  10.245 -11.461  -6.903
   39    HA   GLU   7           HA       GLU   7   7.412 -10.710  -7.588
   40   1HB   GLU   7           HB2      GLU   7   8.110 -10.671  -9.856
   41   2HB   GLU   7           HB1      GLU   7   9.427  -9.894  -8.990
   42   1HG   GLU   7           HG2      GLU   7  10.483 -12.271  -8.955
   43   2HG   GLU   7           HG1      GLU   7   9.249 -12.621 -10.182
   44    H    GLY   8           HN       GLY   8   6.070 -12.343  -8.372
   45   1HA   GLY   8           HA2      GLY   8   6.521 -14.843  -9.255
   46   2HA   GLY   8           HA1      GLY   8   6.821 -15.078  -7.536
   47    H    THR   9           HN       THR   9   5.038 -15.829  -6.463
   48    HA   THR   9           HA       THR   9   2.341 -14.813  -7.149
   49    HB   THR   9           HB       THR   9   3.306 -17.654  -7.275
   50    HG1  THR   9           HG1      THR   9   3.860 -16.851  -9.157
   51   1HG2  THR   9          HG22      THR   9   0.637 -16.585  -6.935
   52   2HG2  THR   9          HG21      THR   9   0.764 -17.424  -8.481
   53   3HG2  THR   9          HG23      THR   9   1.157 -18.269  -6.983
   54    H    ASN  10           HN       ASN  10   4.353 -15.113  -4.645
   55    HA   ASN  10           HA       ASN  10   3.046 -17.007  -2.885
   56   1HB   ASN  10           HB2      ASN  10   5.417 -16.221  -2.876
   57   2HB   ASN  10           HB1      ASN  10   4.854 -14.702  -2.180
   58   1HD2  ASN  10          HD22      ASN  10   4.500 -16.112   1.099
   59   2HD2  ASN  10          HD21      ASN  10   4.395 -14.681   0.126
   60    H    CYS  11           HN       CYS  11   2.159 -13.891  -3.752
   61    HA   CYS  11           HA       CYS  11   0.328 -13.742  -1.383
   62   1HB   CYS  11           HB2      CYS  11   1.950 -11.645  -2.813
   63   2HB   CYS  11           HB1      CYS  11   0.521 -11.180  -1.880
   64    H    GLY  12           HN       GLY  12   0.090 -14.875  -4.124
   65   1HA   GLY  12           HA2      GLY  12  -1.770 -15.018  -5.586
   66   2HA   GLY  12           HA1      GLY  12  -2.554 -13.810  -4.557
   67    H    LYS  13           HN       LYS  13   0.559 -12.948  -5.573
   68    HA   LYS  13           HA       LYS  13  -0.475 -10.758  -7.176
   69   1HB   LYS  13           HB2      LYS  13   1.685  -9.867  -6.832
   70   2HB   LYS  13           HB1      LYS  13   1.250 -10.746  -5.379
   71   1HG   LYS  13           HG2      LYS  13   2.467 -12.756  -6.432
   72   2HG   LYS  13           HG1      LYS  13   3.150 -11.586  -7.548
   73   1HD   LYS  13           HD2      LYS  13   4.036 -10.306  -5.636
   74   2HD   LYS  13           HD1      LYS  13   3.374 -11.512  -4.536
   75   1HE   LYS  13           HE2      LYS  13   5.078 -12.959  -4.933
   76   2HE   LYS  13           HE1      LYS  13   5.023 -12.665  -6.681
   77   1HZ   LYS  13           HZ3      LYS  13   6.030 -10.472  -6.255
   78   2HZ   LYS  13           HZ2      LYS  13   6.217 -10.892  -4.622
   79   3HZ   LYS  13           HZ1      LYS  13   7.049 -11.754  -5.820
   80    H    VAL  14           HN       VAL  14  -1.045 -12.992  -8.477
   81    HA   VAL  14           HA       VAL  14   0.938 -13.919 -10.376
   82    HB   VAL  14           HB       VAL  14  -2.088 -13.906 -10.213
   83   1HG1  VAL  14          HG12      VAL  14  -0.385 -14.528 -12.526
   84   2HG1  VAL  14          HG11      VAL  14  -1.448 -15.859 -12.071
   85   3HG1  VAL  14          HG13      VAL  14  -2.128 -14.278 -12.451
   86   1HG2  VAL  14          HG22      VAL  14  -0.425 -15.379  -8.763
   87   2HG2  VAL  14          HG21      VAL  14  -1.904 -16.080  -9.419
   88   3HG2  VAL  14          HG23      VAL  14  -0.362 -16.359 -10.229
   89    H    GLY  15           HN       GLY  15   1.922 -12.376 -11.715
   90   1HA   GLY  15           HA2      GLY  15   1.689 -11.074 -13.793
   91   2HA   GLY  15           HA1      GLY  15   0.048 -10.644 -13.299
   92    H    LYS  16           HN       LYS  16   1.182 -10.112 -10.445
   93    HA   LYS  16           HA       LYS  16   2.415  -7.459 -11.115
   94   1HB   LYS  16           HB2      LYS  16   0.610  -8.153  -8.805
   95   2HB   LYS  16           HB1      LYS  16   1.208  -6.559  -9.246
   96   1HG   LYS  16           HG2      LYS  16  -0.013  -6.620 -11.353
   97   2HG   LYS  16           HG1      LYS  16  -0.581  -8.253 -11.006
   98   1HD   LYS  16           HD2      LYS  16  -1.120  -6.009  -9.067
   99   2HD   LYS  16           HD1      LYS  16  -2.164  -6.253 -10.468
  100   1HE   LYS  16           HE2      LYS  16  -3.245  -7.898  -9.352
  101   2HE   LYS  16           HE1      LYS  16  -1.728  -8.812  -9.246
  102   1HZ   LYS  16           HZ1      LYS  16  -1.093  -7.386  -7.360
  103   2HZ   LYS  16           HZ3      LYS  16  -2.620  -6.649  -7.413
  104   3HZ   LYS  16           HZ2      LYS  16  -2.488  -8.301  -7.036
  105    H    TYR  17           HN       TYR  17   2.857  -7.098  -8.031
  106    HA   TYR  17           HA       TYR  17   4.841  -9.286  -7.593
  107   1HB   TYR  17           HB2      TYR  17   5.632  -6.368  -7.466
  108   2HB   TYR  17           HB1      TYR  17   6.653  -7.816  -7.460
  109    HD1  TYR  17           HD1      TYR  17   4.455  -5.734  -9.655
  110    HD2  TYR  17           HD2      TYR  17   7.261  -8.942  -9.384
  111    HE1  TYR  17           HE1      TYR  17   4.669  -5.768 -12.128
  112    HE2  TYR  17           HE2      TYR  17   7.496  -8.984 -11.826
  113    HH   TYR  17           HH       TYR  17   5.337  -7.474 -13.893
  114    H    CYS  18           HN       CYS  18   5.962  -8.797  -5.211
  115    HA   CYS  18           HA       CYS  18   3.884  -7.527  -3.457
  116   1HB   CYS  18           HB2      CYS  18   5.138 -10.292  -3.287
  117   2HB   CYS  18           HB1      CYS  18   4.215  -9.571  -1.971
  118    H    CYS  19           HN       CYS  19   4.752  -7.034  -1.283
  119    HA   CYS  19           HA       CYS  19   7.711  -6.858  -1.184
  120   1HB   CYS  19           HB2      CYS  19   7.190  -4.513  -0.146
  121   2HB   CYS  19           HB1      CYS  19   7.045  -4.719  -1.894
  122    H    SER  20           HN       SER  20   8.509  -7.647   0.715
  123    HA   SER  20           HA       SER  20   7.240  -7.186   3.297
  124   1HB   SER  20           HB2      SER  20   6.922  -9.722   3.685
  125   2HB   SER  20           HB1      SER  20   5.788  -8.981   2.554
  126    HG   SER  20           HG       SER  20   8.214 -10.259   1.818
  127    HA   PRO  21           HA       PRO  21  11.607  -7.842   3.795
  128   1HB   PRO  21           HB2      PRO  21  11.848  -6.976   6.384
  129   2HB   PRO  21           HB1      PRO  21  11.691  -5.880   4.997
  130   1HG   PRO  21           HG2      PRO  21   9.640  -6.650   7.014
  131   2HG   PRO  21           HG1      PRO  21   9.833  -5.143   6.097
  132   1HD   PRO  21           HD2      PRO  21   8.021  -7.228   5.560
  133   2HD   PRO  21           HD1      PRO  21   8.431  -5.886   4.466
  134    H    ILE  22           HN       ILE  22   9.176  -9.634   5.048
  135    HA   ILE  22           HA       ILE  22  10.959 -11.791   5.836
  136    HB   ILE  22           HB       ILE  22  10.822 -10.167   7.793
  137   1HG1  ILE  22          HG12      ILE  22   9.792 -13.006   8.200
  138   2HG1  ILE  22          HG11      ILE  22  11.471 -12.471   8.302
  139   1HG2  ILE  22          HG21      ILE  22   8.133 -10.262   7.130
  140   2HG2  ILE  22          HG23      ILE  22   8.226 -11.149   8.649
  141   3HG2  ILE  22          HG22      ILE  22   8.829  -9.494   8.555
  142   1HD1  ILE  22          HD11      ILE  22  10.268 -10.799  10.112
  143   2HD1  ILE  22          HD13      ILE  22   9.306 -12.265  10.301
  144   3HD1  ILE  22          HD12      ILE  22  11.053 -12.321  10.535
  145    H    GLY  23           HN       GLY  23   8.346 -10.856   4.420
  146   1HA   GLY  23           HA2      GLY  23   6.586 -12.094   3.384
  147   2HA   GLY  23           HA1      GLY  23   7.177 -13.497   4.260
  148    H    LYS  24           HN       LYS  24   6.705 -10.892   6.340
  149    HA   LYS  24           HA       LYS  24   4.350 -12.213   7.471
  150   1HB   LYS  24           HB2      LYS  24   4.758 -10.870   9.392
  151   2HB   LYS  24           HB1      LYS  24   6.323 -11.404   8.791
  152   1HG   LYS  24           HG2      LYS  24   6.590  -9.229   7.611
  153   2HG   LYS  24           HG1      LYS  24   5.043  -8.702   8.271
  154   1HD   LYS  24           HD2      LYS  24   7.468  -9.500   9.905
  155   2HD   LYS  24           HD1      LYS  24   6.918  -7.849   9.633
  156   1HE   LYS  24           HE2      LYS  24   5.374 -10.038  11.076
  157   2HE   LYS  24           HE1      LYS  24   6.091  -8.592  11.811
  158   1HZ   LYS  24           HZ3      LYS  24   4.740  -7.305  10.117
  159   2HZ   LYS  24           HZ2      LYS  24   3.871  -8.742   9.855
  160   3HZ   LYS  24           HZ1      LYS  24   3.871  -8.013  11.390
  161    H    TYR  25           HN       TYR  25   5.116  -9.157   5.865
  162    HA   TYR  25           HA       TYR  25   2.432  -8.068   6.339
  163   1HB   TYR  25           HB2      TYR  25   4.926  -7.196   4.896
  164   2HB   TYR  25           HB1      TYR  25   3.420  -6.290   4.734
  165    HD1  TYR  25           HD2      TYR  25   2.265  -5.462   6.868
  166    HD2  TYR  25           HD1      TYR  25   6.296  -6.927   6.790
  167    HE1  TYR  25           HE2      TYR  25   2.707  -4.344   9.042
  168    HE2  TYR  25           HE1      TYR  25   6.751  -5.800   8.971
  169    HH   TYR  25           HH       TYR  25   5.856  -3.945  10.288
  170    H    CYS  26           HN       CYS  26   4.235  -9.415   3.566
  171    HA   CYS  26           HA       CYS  26   3.473  -9.972   1.369
  172   1HB   CYS  26           HB2      CYS  26   2.525 -11.790   2.713
  173   2HB   CYS  26           HB1      CYS  26   1.174 -10.772   3.224
  174    H    VAL  27           HN       VAL  27   3.326  -7.434   1.086
  175    HA   VAL  27           HA       VAL  27   0.456  -6.642   0.595
  176    HB   VAL  27           HB       VAL  27   2.966  -4.994   1.078
  177   1HG1  VAL  27          HG11      VAL  27   0.704  -4.254  -0.301
  178   2HG1  VAL  27          HG13      VAL  27   0.313  -3.748   1.341
  179   3HG1  VAL  27          HG12      VAL  27   1.770  -3.138   0.555
  180   1HG2  VAL  27          HG21      VAL  27   1.626  -6.399   2.952
  181   2HG2  VAL  27          HG23      VAL  27   2.345  -4.824   3.285
  182   3HG2  VAL  27          HG22      VAL  27   0.625  -4.948   2.916
  183    H    CYS  28           HN       CYS  28   0.010  -6.800  -1.593
  184    HA   CYS  28           HA       CYS  28   2.313  -6.404  -3.472
  185   1HB   CYS  28           HB2      CYS  28  -0.269  -7.915  -3.885
  186   2HB   CYS  28           HB1      CYS  28   1.200  -8.046  -4.848
  187    H    TYR  29           HN       TYR  29   1.851  -5.558  -5.573
  188    HA   TYR  29           HA       TYR  29  -0.588  -3.907  -5.894
  189   1HB   TYR  29           HB2      TYR  29   2.261  -2.960  -6.001
  190   2HB   TYR  29           HB1      TYR  29   0.862  -2.021  -6.472
  191    HD1  TYR  29           HD1      TYR  29   2.497  -3.733  -3.671
  192    HD2  TYR  29           HD2      TYR  29  -0.439  -0.890  -4.898
  193    HE1  TYR  29           HE1      TYR  29   2.284  -2.961  -1.334
  194    HE2  TYR  29           HE2      TYR  29  -0.679  -0.101  -2.569
  195    HH   TYR  29           HH       TYR  29  -0.278  -0.897  -0.305
  196    H    ASP  30           HN       ASP  30  -0.380  -2.872  -8.242
  197    HA   ASP  30           HA       ASP  30   0.409  -5.007 -10.060
  198   1HB   ASP  30           HB2      ASP  30  -0.801  -3.803 -11.650
  199   2HB   ASP  30           HB1      ASP  30  -1.657  -3.526 -10.136
  200    H    SER  31           HN       SER  31   1.516  -1.687  -9.407
  201    HA   SER  31           HA       SER  31   3.637  -1.880 -11.462
  202   1HB   SER  31           HB2      SER  31   3.435   0.154  -9.298
  203   2HB   SER  31           HB1      SER  31   4.062   0.350 -10.926
  204    HG   SER  31           HG       SER  31   2.118   1.078 -11.279
  205    H    LYS  32           HN       LYS  32   5.511  -3.183 -10.971
  206    HA   LYS  32           HA       LYS  32   6.104  -4.190  -8.392
  207   1HB   LYS  32           HB2      LYS  32   8.230  -4.813  -9.368
  208   2HB   LYS  32           HB1      LYS  32   7.136  -4.700 -10.752
  209   1HG   LYS  32           HG2      LYS  32   8.043  -2.631 -11.454
  210   2HG   LYS  32           HG1      LYS  32   8.822  -2.345  -9.898
  211   1HD   LYS  32           HD2      LYS  32  10.600  -3.069 -11.334
  212   2HD   LYS  32           HD1      LYS  32  10.176  -4.508 -10.394
  213   1HE   LYS  32           HE2      LYS  32   8.656  -5.242 -12.276
  214   2HE   LYS  32           HE1      LYS  32   9.246  -3.867 -13.235
  215   1HZ   LYS  32           HZ2      LYS  32  11.534  -4.666 -12.782
  216   2HZ   LYS  32           HZ1      LYS  32  10.879  -6.058 -12.060
  217   3HZ   LYS  32           HZ3      LYS  32  10.617  -5.756 -13.708
  218    H    ALA  33           HN       ALA  33   6.859  -1.069  -9.895
  219    HA   ALA  33           HA       ALA  33   8.546   0.042  -7.914
  220   1HB   ALA  33           HB1      ALA  33   7.929   0.913 -10.241
  221   2HB   ALA  33           HB3      ALA  33   6.373   1.393  -9.559
  222   3HB   ALA  33           HB2      ALA  33   7.862   2.135  -8.968
  223    H    ILE  34           HN       ILE  34   4.902   0.029  -8.227
  224    HA   ILE  34           HA       ILE  34   4.424   1.551  -5.920
  225    HB   ILE  34           HB       ILE  34   3.040  -0.534  -7.482
  226   1HG1  ILE  34          HG12      ILE  34   2.868   2.452  -7.098
  227   2HG1  ILE  34          HG11      ILE  34   3.094   1.549  -8.591
  228   1HG2  ILE  34          HG23      ILE  34   2.346  -0.594  -5.003
  229   2HG2  ILE  34          HG22      ILE  34   1.758   1.049  -5.232
  230   3HG2  ILE  34          HG21      ILE  34   1.044  -0.276  -6.146
  231   1HD1  ILE  34          HD11      ILE  34   0.789   0.556  -8.174
  232   2HD1  ILE  34          HD13      ILE  34   0.602   1.781  -6.920
  233   3HD1  ILE  34          HD12      ILE  34   0.822   2.269  -8.603
  234    H    CYS  35           HN       CYS  35   5.405  -1.663  -6.365
  235    HA   CYS  35           HA       CYS  35   4.754  -2.787  -3.787
  236   1HB   CYS  35           HB2      CYS  35   5.546  -4.209  -5.629
  237   2HB   CYS  35           HB1      CYS  35   7.074  -3.309  -5.704
  238    H    ASN  36           HN       ASN  36   8.003  -1.694  -4.908
  239    HA   ASN  36           HA       ASN  36   9.109  -1.304  -2.294
  240   1HB   ASN  36           HB2      ASN  36   9.562   0.093  -4.973
  241   2HB   ASN  36           HB1      ASN  36  10.625   0.300  -3.573
  242   1HD2  ASN  36          HD22      ASN  36  12.196  -2.849  -3.958
  243   2HD2  ASN  36          HD21      ASN  36  12.038  -1.455  -3.002
  244    H    LYS  37           HN       LYS  37   7.638   1.157  -4.400
  245    HA   LYS  37           HA       LYS  37   7.776   3.369  -2.673
  246   1HB   LYS  37           HB2      LYS  37   7.401   3.175  -5.166
  247   2HB   LYS  37           HB1      LYS  37   5.716   2.821  -4.796
  248   1HG   LYS  37           HG2      LYS  37   7.089   5.290  -3.721
  249   2HG   LYS  37           HG1      LYS  37   6.316   5.281  -5.304
  250   1HD   LYS  37           HD2      LYS  37   4.322   4.198  -3.849
  251   2HD   LYS  37           HD1      LYS  37   5.087   5.171  -2.595
  252   1HE   LYS  37           HE2      LYS  37   4.144   6.205  -5.302
  253   2HE   LYS  37           HE1      LYS  37   3.356   6.507  -3.739
  254   1HZ   LYS  37           HZ3      LYS  37   5.543   7.378  -2.955
  255   2HZ   LYS  37           HZ2      LYS  37   6.096   7.304  -4.560
  256   3HZ   LYS  37           HZ1      LYS  37   4.804   8.328  -4.149
  257    H    ASN  38           HN       ASN  38   4.566   2.193  -3.659
  258    HA   ASN  38           HA       ASN  38   3.175   3.324  -1.554
  259   1HB   ASN  38           HB2      ASN  38   2.783   1.251  -3.595
  260   2HB   ASN  38           HB1      ASN  38   1.486   1.616  -2.453
  261   1HD2  ASN  38          HD22      ASN  38   2.308   4.132  -5.507
  262   2HD2  ASN  38          HD21      ASN  38   3.157   2.676  -5.274
  263    H    CYS  39           HN       CYS  39   4.666   0.207  -1.811
  264    HA   CYS  39           HA       CYS  39   3.271  -1.281   0.124
  265   1HB   CYS  39           HB2      CYS  39   6.218  -1.058  -0.441
  266   2HB   CYS  39           HB1      CYS  39   5.559  -2.277   0.655
  267    H    THR  40           HN       THR  40   5.459   1.413   0.718
  268    HA   THR  40           HA       THR  40   5.667   0.940   3.597
  269    HB   THR  40           HB       THR  40   6.586   3.364   3.428
  270    HG1  THR  40           HG1      THR  40   6.360   4.285   1.577
  271   1HG2  THR  40          HG22      THR  40   7.699   0.887   2.132
  272   2HG2  THR  40          HG21      THR  40   8.557   2.410   1.890
  273   3HG2  THR  40          HG23      THR  40   8.302   1.792   3.523
   
  No H/Q in entry =         273
  Start of MODEL   28
    1   1H    ASP   1           HT2      ASP   1  10.593   3.222   7.005
    2   2H    ASP   1           HT1      ASP   1  11.019   3.211   8.650
    3   3H    ASP   1           HT3      ASP   1  12.038   2.483   7.507
    4    HA   ASP   1           HA       ASP   1  10.886   0.716   8.578
    5   1HB   ASP   1           HB2      ASP   1   8.579   2.612   8.107
    6   2HB   ASP   1           HB1      ASP   1   8.321   0.923   8.542
    7    H    ASP   2           HN       ASP   2  11.585   1.682   5.745
    8    HA   ASP   2           HA       ASP   2   9.596   0.352   4.020
    9   1HB   ASP   2           HB2      ASP   2  12.429   1.409   3.432
   10   2HB   ASP   2           HB1      ASP   2  11.172   1.084   2.232
   11    H    GLY   3           HN       GLY   3  11.337  -0.972   2.201
   12   1HA   GLY   3           HA2      GLY   3  13.101  -2.793   3.570
   13   2HA   GLY   3           HA1      GLY   3  11.548  -3.552   3.265
   14    H    LEU   4           HN       LEU   4  11.776  -4.880   1.559
   15    HA   LEU   4           HA       LEU   4  13.171  -3.867  -0.891
   16   1HB   LEU   4           HB2      LEU   4  13.234  -6.716   0.138
   17   2HB   LEU   4           HB1      LEU   4  14.264  -5.982  -1.085
   18    HG   LEU   4           HG       LEU   4  14.258  -4.945   1.754
   19   1HD1  LEU   4          HD12      LEU   4  15.304  -7.493   0.750
   20   2HD1  LEU   4          HD11      LEU   4  16.540  -6.485   1.502
   21   3HD1  LEU   4          HD13      LEU   4  15.097  -6.935   2.412
   22   1HD2  LEU   4          HD21      LEU   4  15.874  -4.615  -0.728
   23   2HD2  LEU   4          HD23      LEU   4  15.500  -3.439   0.533
   24   3HD2  LEU   4          HD22      LEU   4  16.762  -4.642   0.794
   25    H    CYS   5           HN       CYS   5  12.568  -5.627  -2.799
   26    HA   CYS   5           HA       CYS   5   9.685  -6.431  -2.473
   27   1HB   CYS   5           HB2      CYS   5   9.878  -4.165  -3.568
   28   2HB   CYS   5           HB1      CYS   5  10.788  -4.922  -4.873
   29    H    TYR   6           HN       TYR   6   9.031  -8.154  -3.795
   30    HA   TYR   6           HA       TYR   6  11.174  -9.500  -5.404
   31   1HB   TYR   6           HB2      TYR   6  10.778 -11.578  -4.233
   32   2HB   TYR   6           HB1      TYR   6  11.034 -10.337  -3.017
   33    HD1  TYR   6           HD1      TYR   6   8.511 -12.379  -4.760
   34    HD2  TYR   6           HD2      TYR   6   9.295  -9.725  -1.498
   35    HE1  TYR   6           HE1      TYR   6   6.311 -12.952  -3.779
   36    HE2  TYR   6           HE2      TYR   6   7.084 -10.279  -0.505
   37    HH   TYR   6           HH       TYR   6   4.643 -11.554  -2.064
   38    H    GLU   7           HN       GLU   7  10.188 -11.155  -6.912
   39    HA   GLU   7           HA       GLU   7   7.329 -10.455  -7.531
   40   1HB   GLU   7           HB2      GLU   7   7.969 -10.420  -9.819
   41   2HB   GLU   7           HB1      GLU   7   9.290  -9.603  -8.995
   42   1HG   GLU   7           HG2      GLU   7  10.397 -11.960  -8.965
   43   2HG   GLU   7           HG1      GLU   7   9.140 -12.344 -10.158
   44    H    GLY   8           HN       GLY   8   6.006 -12.129  -8.261
   45   1HA   GLY   8           HA2      GLY   8   6.495 -14.608  -9.163
   46   2HA   GLY   8           HA1      GLY   8   6.874 -14.836  -7.459
   47    H    THR   9           HN       THR   9   5.178 -15.679  -6.356
   48    HA   THR   9           HA       THR   9   2.437 -14.694  -6.834
   49    HB   THR   9           HB       THR   9   3.443 -17.505  -7.180
   50    HG1  THR   9           HG1      THR   9   3.800 -16.677  -9.081
   51   1HG2  THR   9          HG22      THR   9   0.681 -16.381  -6.958
   52   2HG2  THR   9          HG21      THR   9   0.951 -17.666  -8.136
   53   3HG2  THR   9          HG23      THR   9   1.301 -17.946  -6.431
   54    H    ASN  10           HN       ASN  10   4.508 -14.871  -4.490
   55    HA   ASN  10           HA       ASN  10   3.646 -16.976  -2.720
   56   1HB   ASN  10           HB2      ASN  10   5.814 -15.749  -2.762
   57   2HB   ASN  10           HB1      ASN  10   4.992 -14.365  -2.041
   58   1HD2  ASN  10          HD22      ASN  10   5.008 -15.818   1.239
   59   2HD2  ASN  10          HD21      ASN  10   4.603 -14.434   0.278
   60    H    CYS  11           HN       CYS  11   2.151 -14.062  -3.487
   61    HA   CYS  11           HA       CYS  11   0.441 -14.271  -1.033
   62   1HB   CYS  11           HB2      CYS  11   1.383 -11.921  -2.682
   63   2HB   CYS  11           HB1      CYS  11  -0.046 -11.776  -1.652
   64    H    GLY  12           HN       GLY  12   0.419 -15.543  -3.765
   65   1HA   GLY  12           HA2      GLY  12  -1.376 -16.297  -5.103
   66   2HA   GLY  12           HA1      GLY  12  -2.435 -15.330  -4.069
   67    H    LYS  13           HN       LYS  13   0.185 -13.564  -5.267
   68    HA   LYS  13           HA       LYS  13  -1.587 -11.975  -6.953
   69   1HB   LYS  13           HB2      LYS  13   0.023 -10.328  -6.659
   70   2HB   LYS  13           HB1      LYS  13  -0.043 -11.233  -5.160
   71   1HG   LYS  13           HG2      LYS  13   1.883 -12.646  -6.118
   72   2HG   LYS  13           HG1      LYS  13   2.057 -11.370  -7.307
   73   1HD   LYS  13           HD2      LYS  13   2.682 -11.369  -4.417
   74   2HD   LYS  13           HD1      LYS  13   3.501 -10.552  -5.747
   75   1HE   LYS  13           HE2      LYS  13   0.915  -9.703  -4.401
   76   2HE   LYS  13           HE1      LYS  13   2.464  -8.849  -4.390
   77   1HZ   LYS  13           HZ3      LYS  13   1.850  -9.358  -7.053
   78   2HZ   LYS  13           HZ2      LYS  13   0.428  -8.761  -6.346
   79   3HZ   LYS  13           HZ1      LYS  13   1.855  -7.858  -6.265
   80    H    VAL  14           HN       VAL  14  -1.412 -14.090  -8.363
   81    HA   VAL  14           HA       VAL  14   0.890 -14.397 -10.084
   82    HB   VAL  14           HB       VAL  14  -2.068 -15.032 -10.272
   83   1HG1  VAL  14          HG11      VAL  14  -1.218 -14.665 -12.576
   84   2HG1  VAL  14          HG13      VAL  14   0.076 -15.825 -12.273
   85   3HG1  VAL  14          HG12      VAL  14  -1.604 -16.362 -12.290
   86   1HG2  VAL  14          HG22      VAL  14  -0.538 -16.312  -8.696
   87   2HG2  VAL  14          HG21      VAL  14  -1.388 -17.304  -9.881
   88   3HG2  VAL  14          HG23      VAL  14   0.312 -16.904 -10.125
   89    H    GLY  15           HN       GLY  15   1.649 -12.733 -11.429
   90   1HA   GLY  15           HA2      GLY  15   1.153 -11.396 -13.463
   91   2HA   GLY  15           HA1      GLY  15  -0.464 -11.107 -12.824
   92    H    LYS  16           HN       LYS  16   0.862 -10.476 -10.020
   93    HA   LYS  16           HA       LYS  16   1.905  -7.774 -10.859
   94   1HB   LYS  16           HB2      LYS  16   0.310  -8.432  -8.396
   95   2HB   LYS  16           HB1      LYS  16   0.794  -6.835  -8.961
   96   1HG   LYS  16           HG2      LYS  16  -0.505  -7.304 -11.089
   97   2HG   LYS  16           HG1      LYS  16  -1.184  -8.711 -10.268
   98   1HD   LYS  16           HD2      LYS  16  -1.272  -6.118  -8.796
   99   2HD   LYS  16           HD1      LYS  16  -2.358  -6.293 -10.175
  100   1HE   LYS  16           HE2      LYS  16  -2.268  -8.634  -8.354
  101   2HE   LYS  16           HE1      LYS  16  -2.997  -7.163  -7.677
  102   1HZ   LYS  16           HZ3      LYS  16  -4.238  -6.966  -9.827
  103   2HZ   LYS  16           HZ2      LYS  16  -3.711  -8.535 -10.210
  104   3HZ   LYS  16           HZ1      LYS  16  -4.706  -8.276  -8.856
  105    H    TYR  17           HN       TYR  17   2.588  -7.151  -7.900
  106    HA   TYR  17           HA       TYR  17   4.702  -9.211  -7.417
  107   1HB   TYR  17           HB2      TYR  17   5.342  -6.264  -7.572
  108   2HB   TYR  17           HB1      TYR  17   6.436  -7.653  -7.537
  109    HD1  TYR  17           HD1      TYR  17   3.965  -5.866  -9.705
  110    HD2  TYR  17           HD2      TYR  17   6.989  -8.860  -9.418
  111    HE1  TYR  17           HE1      TYR  17   3.992  -6.087 -12.180
  112    HE2  TYR  17           HE2      TYR  17   7.054  -9.083 -11.859
  113    HH   TYR  17           HH       TYR  17   5.370  -8.634 -13.783
  114    H    CYS  18           HN       CYS  18   5.869  -8.638  -5.132
  115    HA   CYS  18           HA       CYS  18   3.903  -7.157  -3.389
  116   1HB   CYS  18           HB2      CYS  18   5.120  -9.927  -3.111
  117   2HB   CYS  18           HB1      CYS  18   4.450  -9.071  -1.725
  118    H    CYS  19           HN       CYS  19   4.868  -6.529  -1.299
  119    HA   CYS  19           HA       CYS  19   7.812  -6.312  -1.356
  120   1HB   CYS  19           HB2      CYS  19   7.328  -3.926  -0.401
  121   2HB   CYS  19           HB1      CYS  19   7.105  -4.212  -2.128
  122    H    SER  20           HN       SER  20   8.593  -7.287   0.435
  123    HA   SER  20           HA       SER  20   7.671  -6.621   3.116
  124   1HB   SER  20           HB2      SER  20   7.110  -9.129   3.585
  125   2HB   SER  20           HB1      SER  20   5.922  -8.220   2.643
  126    HG   SER  20           HG       SER  20   8.012  -9.812   1.559
  127    HA   PRO  21           HA       PRO  21  11.913  -7.781   3.359
  128   1HB   PRO  21           HB2      PRO  21  12.315  -7.575   6.063
  129   2HB   PRO  21           HB1      PRO  21  12.183  -6.172   4.978
  130   1HG   PRO  21           HG2      PRO  21  10.151  -7.290   6.855
  131   2HG   PRO  21           HG1      PRO  21  10.427  -5.616   6.333
  132   1HD   PRO  21           HD2      PRO  21   8.436  -7.352   5.393
  133   2HD   PRO  21           HD1      PRO  21   8.951  -5.838   4.610
  134    H    ILE  22           HN       ILE  22   9.424  -9.677   4.431
  135    HA   ILE  22           HA       ILE  22  11.098 -12.056   4.496
  136    HB   ILE  22           HB       ILE  22  11.305 -10.881   6.758
  137   1HG1  ILE  22          HG12      ILE  22  10.166 -13.708   6.690
  138   2HG1  ILE  22          HG11      ILE  22  11.874 -13.267   6.636
  139   1HG2  ILE  22          HG21      ILE  22   8.588 -10.671   6.461
  140   2HG2  ILE  22          HG23      ILE  22   8.734 -11.984   7.627
  141   3HG2  ILE  22          HG22      ILE  22   9.464 -10.417   7.971
  142   1HD1  ILE  22          HD13      ILE  22   9.999 -12.702   8.958
  143   2HD1  ILE  22          HD12      ILE  22  11.195 -13.998   8.905
  144   3HD1  ILE  22          HD11      ILE  22  11.720 -12.314   8.898
  145    H    GLY  23           HN       GLY  23   8.475 -10.739   3.570
  146   1HA   GLY  23           HA2      GLY  23   6.510 -11.648   2.554
  147   2HA   GLY  23           HA1      GLY  23   7.051 -13.220   3.125
  148    H    LYS  24           HN       LYS  24   7.045 -10.942   5.601
  149    HA   LYS  24           HA       LYS  24   4.758 -12.256   6.859
  150   1HB   LYS  24           HB2      LYS  24   5.469 -11.116   8.842
  151   2HB   LYS  24           HB1      LYS  24   6.904 -11.702   8.011
  152   1HG   LYS  24           HG2      LYS  24   7.162  -9.434   6.965
  153   2HG   LYS  24           HG1      LYS  24   5.798  -8.881   7.936
  154   1HD   LYS  24           HD2      LYS  24   7.976 -10.268   9.403
  155   2HD   LYS  24           HD1      LYS  24   8.359  -8.668   8.764
  156   1HE   LYS  24           HE2      LYS  24   7.312  -7.811  10.590
  157   2HE   LYS  24           HE1      LYS  24   5.789  -8.400   9.893
  158   1HZ   LYS  24           HZ3      LYS  24   7.653 -10.041  11.527
  159   2HZ   LYS  24           HZ2      LYS  24   6.220  -9.340  12.112
  160   3HZ   LYS  24           HZ1      LYS  24   6.155 -10.539  10.909
  161    H    TYR  25           HN       TYR  25   5.539  -9.024   5.622
  162    HA   TYR  25           HA       TYR  25   2.954  -7.914   6.460
  163   1HB   TYR  25           HB2      TYR  25   5.377  -6.948   4.954
  164   2HB   TYR  25           HB1      TYR  25   3.917  -5.964   5.056
  165    HD1  TYR  25           HD1      TYR  25   3.010  -5.340   7.338
  166    HD2  TYR  25           HD2      TYR  25   6.885  -7.097   6.777
  167    HE1  TYR  25           HE1      TYR  25   3.682  -4.565   9.602
  168    HE2  TYR  25           HE2      TYR  25   7.567  -6.318   9.049
  169    HH   TYR  25           HH       TYR  25   6.522  -5.674  11.150
  170    H    CYS  26           HN       CYS  26   4.449  -9.116   3.495
  171    HA   CYS  26           HA       CYS  26   3.604  -9.304   1.284
  172   1HB   CYS  26           HB2      CYS  26   2.535 -11.192   2.444
  173   2HB   CYS  26           HB1      CYS  26   1.251 -10.138   3.054
  174    H    VAL  27           HN       VAL  27   3.642  -6.808   1.097
  175    HA   VAL  27           HA       VAL  27   0.835  -5.716   0.884
  176    HB   VAL  27           HB       VAL  27   3.543  -4.345   1.148
  177   1HG1  VAL  27          HG13      VAL  27   1.043  -3.427   0.129
  178   2HG1  VAL  27          HG12      VAL  27   1.296  -2.651   1.694
  179   3HG1  VAL  27          HG11      VAL  27   2.507  -2.485   0.423
  180   1HG2  VAL  27          HG23      VAL  27   1.577  -5.328   3.088
  181   2HG2  VAL  27          HG22      VAL  27   3.235  -4.787   3.349
  182   3HG2  VAL  27          HG21      VAL  27   1.922  -3.611   3.285
  183    H    CYS  28           HN       CYS  28   0.275  -6.092  -1.227
  184    HA   CYS  28           HA       CYS  28   2.425  -5.851  -3.296
  185   1HB   CYS  28           HB2      CYS  28  -0.205  -7.324  -3.340
  186   2HB   CYS  28           HB1      CYS  28   1.175  -7.579  -4.397
  187    H    TYR  29           HN       TYR  29   1.804  -5.274  -5.451
  188    HA   TYR  29           HA       TYR  29  -0.615  -3.617  -5.823
  189   1HB   TYR  29           HB2      TYR  29   2.237  -2.744  -6.179
  190   2HB   TYR  29           HB1      TYR  29   0.831  -1.843  -6.704
  191    HD1  TYR  29           HD1      TYR  29   2.536  -3.256  -3.774
  192    HD2  TYR  29           HD2      TYR  29  -0.360  -0.479  -5.236
  193    HE1  TYR  29           HE1      TYR  29   2.425  -2.208  -1.537
  194    HE2  TYR  29           HE2      TYR  29  -0.494   0.586  -3.010
  195    HH   TYR  29           HH       TYR  29   0.905  -0.856  -0.205
  196    H    ASP  30           HN       ASP  30  -0.481  -2.856  -8.302
  197    HA   ASP  30           HA       ASP  30   0.156  -5.226  -9.880
  198   1HB   ASP  30           HB2      ASP  30  -1.105  -4.192 -11.542
  199   2HB   ASP  30           HB1      ASP  30  -1.873  -3.693 -10.038
  200    H    SER  31           HN       SER  31   1.377  -1.881  -9.693
  201    HA   SER  31           HA       SER  31   3.385  -2.373 -11.810
  202   1HB   SER  31           HB2      SER  31   3.344  -0.096  -9.893
  203   2HB   SER  31           HB1      SER  31   3.889  -0.110 -11.563
  204    HG   SER  31           HG       SER  31   1.742  -0.395 -12.201
  205    H    LYS  32           HN       LYS  32   5.307  -3.591 -11.295
  206    HA   LYS  32           HA       LYS  32   5.986  -4.361  -8.659
  207   1HB   LYS  32           HB2      LYS  32   8.069  -5.098  -9.642
  208   2HB   LYS  32           HB1      LYS  32   6.930  -5.102 -10.994
  209   1HG   LYS  32           HG2      LYS  32   7.831  -3.112 -11.915
  210   2HG   LYS  32           HG1      LYS  32   8.674  -2.702 -10.421
  211   1HD   LYS  32           HD2      LYS  32  10.313  -3.596 -12.006
  212   2HD   LYS  32           HD1      LYS  32  10.073  -4.789 -10.720
  213   1HE   LYS  32           HE2      LYS  32   8.077  -5.361 -12.671
  214   2HE   LYS  32           HE1      LYS  32   9.597  -5.141 -13.565
  215   1HZ   LYS  32           HZ2      LYS  32  10.700  -6.586 -11.965
  216   2HZ   LYS  32           HZ1      LYS  32   9.236  -6.819 -11.135
  217   3HZ   LYS  32           HZ3      LYS  32   9.414  -7.401 -12.719
  218    H    ALA  33           HN       ALA  33   6.739  -1.421 -10.489
  219    HA   ALA  33           HA       ALA  33   8.507  -0.150  -8.687
  220   1HB   ALA  33           HB2      ALA  33   7.826   0.499 -11.065
  221   2HB   ALA  33           HB1      ALA  33   6.296   1.066 -10.389
  222   3HB   ALA  33           HB3      ALA  33   7.811   1.843  -9.919
  223    H    ILE  34           HN       ILE  34   4.855  -0.130  -8.868
  224    HA   ILE  34           HA       ILE  34   4.500   1.635  -6.715
  225    HB   ILE  34           HB       ILE  34   3.007  -0.561  -8.001
  226   1HG1  ILE  34          HG12      ILE  34   2.929   2.453  -7.935
  227   2HG1  ILE  34          HG11      ILE  34   3.073   1.390  -9.330
  228   1HG2  ILE  34          HG23      ILE  34   2.409  -0.323  -5.505
  229   2HG2  ILE  34          HG22      ILE  34   1.850   1.298  -5.900
  230   3HG2  ILE  34          HG21      ILE  34   1.073  -0.102  -6.630
  231   1HD1  ILE  34          HD12      ILE  34   0.761   0.516  -8.714
  232   2HD1  ILE  34          HD11      ILE  34   0.655   1.886  -7.608
  233   3HD1  ILE  34          HD13      ILE  34   0.824   2.164  -9.343
  234    H    CYS  35           HN       CYS  35   5.400  -1.634  -6.861
  235    HA   CYS  35           HA       CYS  35   4.816  -2.472  -4.159
  236   1HB   CYS  35           HB2      CYS  35   5.539  -4.100  -5.857
  237   2HB   CYS  35           HB1      CYS  35   7.076  -3.237  -6.069
  238    H    ASN  36           HN       ASN  36   8.028  -1.544  -5.501
  239    HA   ASN  36           HA       ASN  36   9.245  -0.921  -2.983
  240   1HB   ASN  36           HB2      ASN  36   9.604   0.198  -5.803
  241   2HB   ASN  36           HB1      ASN  36  10.719   0.540  -4.474
  242   1HD2  ASN  36          HD22      ASN  36  12.360  -2.570  -4.745
  243   2HD2  ASN  36          HD21      ASN  36  12.320  -1.030  -4.035
  244    H    LYS  37           HN       LYS  37   7.737   1.356  -5.261
  245    HA   LYS  37           HA       LYS  37   7.955   3.710  -3.741
  246   1HB   LYS  37           HB2      LYS  37   7.515   3.311  -6.197
  247   2HB   LYS  37           HB1      LYS  37   5.835   3.009  -5.756
  248   1HG   LYS  37           HG2      LYS  37   7.258   5.544  -4.926
  249   2HG   LYS  37           HG1      LYS  37   6.445   5.411  -6.484
  250   1HD   LYS  37           HD2      LYS  37   4.454   4.503  -4.957
  251   2HD   LYS  37           HD1      LYS  37   5.275   5.469  -3.733
  252   1HE   LYS  37           HE2      LYS  37   4.383   6.503  -6.457
  253   2HE   LYS  37           HE1      LYS  37   3.566   6.829  -4.914
  254   1HZ   LYS  37           HZ3      LYS  37   5.714   7.680  -4.069
  255   2HZ   LYS  37           HZ2      LYS  37   6.367   7.521  -5.628
  256   3HZ   LYS  37           HZ1      LYS  37   5.092   8.608  -5.344
  257    H    ASN  38           HN       ASN  38   4.705   2.493  -4.538
  258    HA   ASN  38           HA       ASN  38   3.378   3.839  -2.523
  259   1HB   ASN  38           HB2      ASN  38   2.916   1.574  -4.329
  260   2HB   ASN  38           HB1      ASN  38   1.654   2.066  -3.198
  261   1HD2  ASN  38          HD22      ASN  38   2.408   4.249  -6.513
  262   2HD2  ASN  38          HD21      ASN  38   3.254   2.817  -6.155
  263    H    CYS  39           HN       CYS  39   4.829   0.685  -2.500
  264    HA   CYS  39           HA       CYS  39   3.461  -0.546  -0.363
  265   1HB   CYS  39           HB2      CYS  39   6.383  -0.502  -1.077
  266   2HB   CYS  39           HB1      CYS  39   5.748  -1.549   0.194
  267    H    THR  40           HN       THR  40   5.649   2.184  -0.172
  268    HA   THR  40           HA       THR  40   6.077   2.012   2.712
  269    HB   THR  40           HB       THR  40   6.911   4.416   2.252
  270    HG1  THR  40           HG1      THR  40   6.975   5.031   0.155
  271   1HG2  THR  40          HG22      THR  40   7.982   1.899   0.967
  272   2HG2  THR  40          HG21      THR  40   8.792   3.439   0.669
  273   3HG2  THR  40          HG23      THR  40   8.638   2.827   2.316
   
  No H/Q in entry =         273
  Start of MODEL   29
    1   1H    ASP   1           HT1      ASP   1   7.080  -1.762   7.582
    2   2H    ASP   1           HT3      ASP   1   6.980  -0.668   8.875
    3   3H    ASP   1           HT2      ASP   1   6.297  -0.269   7.371
    4    HA   ASP   1           HA       ASP   1   8.346   0.929   7.571
    5   1HB   ASP   1           HB2      ASP   1  10.365  -0.233   8.229
    6   2HB   ASP   1           HB1      ASP   1   9.100  -0.706   9.366
    7    H    ASP   2           HN       ASP   2  10.374   0.533   5.961
    8    HA   ASP   2           HA       ASP   2   9.172  -0.224   3.380
    9   1HB   ASP   2           HB2      ASP   2  12.016   0.682   4.142
   10   2HB   ASP   2           HB1      ASP   2  11.332   0.692   2.512
   11    H    GLY   3           HN       GLY   3  11.549  -1.248   2.121
   12   1HA   GLY   3           HA2      GLY   3  12.894  -3.345   3.333
   13   2HA   GLY   3           HA1      GLY   3  11.347  -4.047   2.877
   14    H    LEU   4           HN       LEU   4  11.675  -5.223   1.055
   15    HA   LEU   4           HA       LEU   4  13.169  -3.953  -1.207
   16   1HB   LEU   4           HB2      LEU   4  13.250  -6.897  -0.504
   17   2HB   LEU   4           HB1      LEU   4  14.324  -6.003  -1.574
   18    HG   LEU   4           HG       LEU   4  14.148  -5.328   1.366
   19   1HD1  LEU   4          HD13      LEU   4  14.796  -7.823   0.654
   20   2HD1  LEU   4          HD12      LEU   4  16.351  -7.053   0.338
   21   3HD1  LEU   4          HD11      LEU   4  15.639  -6.977   1.951
   22   1HD2  LEU   4          HD23      LEU   4  15.882  -4.658  -0.965
   23   2HD2  LEU   4          HD22      LEU   4  15.408  -3.654   0.407
   24   3HD2  LEU   4          HD21      LEU   4  16.686  -4.854   0.592
   25    H    CYS   5           HN       CYS   5  12.686  -5.516  -3.303
   26    HA   CYS   5           HA       CYS   5   9.779  -6.330  -3.198
   27   1HB   CYS   5           HB2      CYS   5  10.149  -4.011  -4.166
   28   2HB   CYS   5           HB1      CYS   5  11.052  -4.771  -5.475
   29    H    TYR   6           HN       TYR   6   9.326  -8.168  -4.285
   30    HA   TYR   6           HA       TYR   6  11.392  -9.321  -6.121
   31   1HB   TYR   6           HB2      TYR   6  11.304 -11.435  -4.915
   32   2HB   TYR   6           HB1      TYR   6  11.662 -10.157  -3.768
   33    HD1  TYR   6           HD1      TYR   6   9.078 -12.453  -5.024
   34    HD2  TYR   6           HD2      TYR   6  10.126  -9.587  -2.026
   35    HE1  TYR   6           HE1      TYR   6   7.133 -13.174  -3.670
   36    HE2  TYR   6           HE2      TYR   6   8.168 -10.286  -0.660
   37    HH   TYR   6           HH       TYR   6   5.760 -11.493  -1.393
   38    H    GLU   7           HN       GLU   7  10.343 -11.188  -7.422
   39    HA   GLU   7           HA       GLU   7   7.422 -10.562  -7.797
   40   1HB   GLU   7           HB2      GLU   7   7.850 -10.630 -10.130
   41   2HB   GLU   7           HB1      GLU   7   9.230  -9.768  -9.464
   42   1HG   GLU   7           HG2      GLU   7  10.368 -12.107  -9.434
   43   2HG   GLU   7           HG1      GLU   7   9.015 -12.561 -10.488
   44    H    GLY   8           HN       GLY   8   6.073 -12.267  -8.429
   45   1HA   GLY   8           HA2      GLY   8   6.521 -14.804  -9.187
   46   2HA   GLY   8           HA1      GLY   8   6.955 -14.924  -7.485
   47    H    THR   9           HN       THR   9   5.282 -15.665  -6.252
   48    HA   THR   9           HA       THR   9   2.525 -14.712  -6.755
   49    HB   THR   9           HB       THR   9   3.510 -17.549  -6.838
   50    HG1  THR   9           HG1      THR   9   2.694 -17.339  -9.033
   51   1HG2  THR   9          HG21      THR   9   0.873 -16.490  -6.318
   52   2HG2  THR   9          HG23      THR   9   0.872 -17.367  -7.848
   53   3HG2  THR   9          HG22      THR   9   1.395 -18.173  -6.369
   54    H    ASN  10           HN       ASN  10   4.717 -14.826  -4.422
   55    HA   ASN  10           HA       ASN  10   3.663 -16.691  -2.477
   56   1HB   ASN  10           HB2      ASN  10   5.973 -15.782  -2.676
   57   2HB   ASN  10           HB1      ASN  10   5.377 -14.247  -2.046
   58   1HD2  ASN  10          HD22      ASN  10   5.329 -15.436   1.340
   59   2HD2  ASN  10          HD21      ASN  10   5.080 -14.085   0.283
   60    H    CYS  11           HN       CYS  11   2.555 -13.654  -3.402
   61    HA   CYS  11           HA       CYS  11   0.867 -13.506  -0.929
   62   1HB   CYS  11           HB2      CYS  11   2.257 -11.386  -2.558
   63   2HB   CYS  11           HB1      CYS  11   0.863 -10.965  -1.554
   64    H    GLY  12           HN       GLY  12   0.545 -14.780  -3.601
   65   1HA   GLY  12           HA2      GLY  12  -1.384 -15.125  -4.929
   66   2HA   GLY  12           HA1      GLY  12  -2.188 -13.919  -3.912
   67    H    LYS  13           HN       LYS  13   0.787 -12.888  -5.176
   68    HA   LYS  13           HA       LYS  13  -0.530 -10.887  -6.820
   69   1HB   LYS  13           HB2      LYS  13   1.551  -9.790  -6.675
   70   2HB   LYS  13           HB1      LYS  13   1.297 -10.613  -5.150
   71   1HG   LYS  13           HG2      LYS  13   2.638 -12.562  -6.163
   72   2HG   LYS  13           HG1      LYS  13   3.126 -11.410  -7.396
   73   1HD   LYS  13           HD2      LYS  13   3.693  -9.910  -5.305
   74   2HD   LYS  13           HD1      LYS  13   3.780 -11.465  -4.485
   75   1HE   LYS  13           HE2      LYS  13   5.174 -11.331  -7.102
   76   2HE   LYS  13           HE1      LYS  13   5.903 -10.392  -5.786
   77   1HZ   LYS  13           HZ2      LYS  13   5.538 -12.408  -4.361
   78   2HZ   LYS  13           HZ1      LYS  13   5.202 -13.270  -5.784
   79   3HZ   LYS  13           HZ3      LYS  13   6.732 -12.577  -5.559
   80    H    VAL  14           HN       VAL  14  -1.016 -13.181  -7.993
   81    HA   VAL  14           HA       VAL  14   0.924 -14.081  -9.953
   82    HB   VAL  14           HB       VAL  14  -2.094 -14.219  -9.681
   83   1HG1  VAL  14          HG11      VAL  14  -0.950 -14.461 -12.108
   84   2HG1  VAL  14          HG13      VAL  14  -0.659 -16.095 -11.509
   85   3HG1  VAL  14          HG12      VAL  14  -2.305 -15.470 -11.610
   86   1HG2  VAL  14          HG22      VAL  14  -0.201 -15.508  -8.229
   87   2HG2  VAL  14          HG21      VAL  14  -1.776 -16.210  -8.596
   88   3HG2  VAL  14          HG23      VAL  14  -0.372 -16.639  -9.572
   89    H    GLY  15           HN       GLY  15   1.743 -12.562 -11.417
   90   1HA   GLY  15           HA2      GLY  15   1.329 -11.356 -13.524
   91   2HA   GLY  15           HA1      GLY  15  -0.300 -10.983 -12.952
   92    H    LYS  16           HN       LYS  16   0.937 -10.284 -10.194
   93    HA   LYS  16           HA       LYS  16   1.972  -7.590 -11.014
   94   1HB   LYS  16           HB2      LYS  16   0.465  -8.349  -8.519
   95   2HB   LYS  16           HB1      LYS  16   0.912  -6.731  -9.041
   96   1HG   LYS  16           HG2      LYS  16  -0.513  -6.936 -11.024
   97   2HG   LYS  16           HG1      LYS  16  -0.975  -8.567 -10.539
   98   1HD   LYS  16           HD2      LYS  16  -1.415  -6.142  -8.777
   99   2HD   LYS  16           HD1      LYS  16  -2.633  -6.745  -9.905
  100   1HE   LYS  16           HE2      LYS  16  -1.433  -8.804  -8.131
  101   2HE   LYS  16           HE1      LYS  16  -2.463  -7.601  -7.328
  102   1HZ   LYS  16           HZ3      LYS  16  -3.211  -9.047  -9.814
  103   2HZ   LYS  16           HZ2      LYS  16  -3.723  -9.506  -8.260
  104   3HZ   LYS  16           HZ1      LYS  16  -4.196  -8.007  -8.905
  105    H    TYR  17           HN       TYR  17   2.723  -7.112  -8.026
  106    HA   TYR  17           HA       TYR  17   4.842  -9.190  -7.719
  107   1HB   TYR  17           HB2      TYR  17   5.491  -6.231  -7.818
  108   2HB   TYR  17           HB1      TYR  17   6.586  -7.625  -7.814
  109    HD1  TYR  17           HD1      TYR  17   4.096  -5.802  -9.927
  110    HD2  TYR  17           HD2      TYR  17   7.071  -8.859  -9.709
  111    HE1  TYR  17           HE1      TYR  17   4.084  -6.003 -12.402
  112    HE2  TYR  17           HE2      TYR  17   7.081  -9.066 -12.155
  113    HH   TYR  17           HH       TYR  17   4.847  -8.228 -14.069
  114    H    CYS  18           HN       CYS  18   6.178  -8.538  -5.480
  115    HA   CYS  18           HA       CYS  18   4.210  -7.328  -3.565
  116   1HB   CYS  18           HB2      CYS  18   5.599 -10.027  -3.514
  117   2HB   CYS  18           HB1      CYS  18   4.915  -9.303  -2.057
  118    H    CYS  19           HN       CYS  19   5.226  -6.710  -1.506
  119    HA   CYS  19           HA       CYS  19   8.166  -6.402  -1.599
  120   1HB   CYS  19           HB2      CYS  19   7.647  -3.999  -0.726
  121   2HB   CYS  19           HB1      CYS  19   7.421  -4.340  -2.443
  122    H    SER  20           HN       SER  20   8.792  -7.547   0.188
  123    HA   SER  20           HA       SER  20   8.096  -6.638   2.843
  124   1HB   SER  20           HB2      SER  20   7.088  -9.015   3.415
  125   2HB   SER  20           HB1      SER  20   6.055  -7.819   2.627
  126    HG   SER  20           HG       SER  20   7.292 -10.113   1.584
  127    HA   PRO  21           HA       PRO  21  12.010  -8.672   3.083
  128   1HB   PRO  21           HB2      PRO  21  12.534  -8.288   5.748
  129   2HB   PRO  21           HB1      PRO  21  12.684  -7.002   4.533
  130   1HG   PRO  21           HG2      PRO  21  10.499  -7.462   6.513
  131   2HG   PRO  21           HG1      PRO  21  11.152  -5.944   5.860
  132   1HD   PRO  21           HD2      PRO  21   8.788  -7.193   5.067
  133   2HD   PRO  21           HD1      PRO  21   9.660  -5.953   4.132
  134    H    ILE  22           HN       ILE  22   9.190  -9.557   4.705
  135    HA   ILE  22           HA       ILE  22   9.878 -12.394   4.743
  136    HB   ILE  22           HB       ILE  22  11.003 -11.188   6.761
  137   1HG1  ILE  22          HG12      ILE  22   9.143 -13.538   7.308
  138   2HG1  ILE  22          HG11      ILE  22  10.802 -13.654   6.723
  139   1HG2  ILE  22          HG23      ILE  22   8.546 -10.136   7.097
  140   2HG2  ILE  22          HG22      ILE  22   8.479 -11.473   8.243
  141   3HG2  ILE  22          HG21      ILE  22   9.749 -10.256   8.377
  142   1HD1  ILE  22          HD13      ILE  22  10.986 -12.051   9.011
  143   2HD1  ILE  22          HD12      ILE  22   9.829 -13.310   9.447
  144   3HD1  ILE  22          HD11      ILE  22  11.440 -13.752   8.884
  145    H    GLY  23           HN       GLY  23   7.863 -13.278   6.410
  146   1HA   GLY  23           HA2      GLY  23   5.498 -12.529   4.834
  147   2HA   GLY  23           HA1      GLY  23   5.558 -13.806   6.043
  148    H    LYS  24           HN       LYS  24   6.841 -10.946   7.277
  149    HA   LYS  24           HA       LYS  24   4.434 -10.596   8.904
  150   1HB   LYS  24           HB2      LYS  24   5.800  -9.400  10.401
  151   2HB   LYS  24           HB1      LYS  24   6.812 -10.693   9.772
  152   1HG   LYS  24           HG2      LYS  24   7.576  -8.983   8.001
  153   2HG   LYS  24           HG1      LYS  24   6.844  -7.773   9.051
  154   1HD   LYS  24           HD2      LYS  24   8.917  -9.770   9.991
  155   2HD   LYS  24           HD1      LYS  24   9.295  -8.119   9.495
  156   1HE   LYS  24           HE2      LYS  24   7.167  -8.588  11.577
  157   2HE   LYS  24           HE1      LYS  24   8.879  -8.600  12.041
  158   1HZ   LYS  24           HZ2      LYS  24   9.097  -6.483  10.756
  159   2HZ   LYS  24           HZ1      LYS  24   7.403  -6.437  10.647
  160   3HZ   LYS  24           HZ3      LYS  24   8.155  -6.358  12.165
  161    H    TYR  25           HN       TYR  25   4.880  -9.600   5.948
  162    HA   TYR  25           HA       TYR  25   3.422  -7.065   6.366
  163   1HB   TYR  25           HB2      TYR  25   6.125  -7.341   5.057
  164   2HB   TYR  25           HB1      TYR  25   5.038  -6.022   4.630
  165    HD1  TYR  25           HD1      TYR  25   4.040  -4.672   6.724
  166    HD2  TYR  25           HD2      TYR  25   7.611  -7.043   6.769
  167    HE1  TYR  25           HE1      TYR  25   4.834  -3.430   8.719
  168    HE2  TYR  25           HE2      TYR  25   8.415  -5.803   8.770
  169    HH   TYR  25           HH       TYR  25   7.738  -3.172   9.680
  170    H    CYS  26           HN       CYS  26   5.005  -9.028   3.802
  171    HA   CYS  26           HA       CYS  26   4.220  -9.457   1.562
  172   1HB   CYS  26           HB2      CYS  26   3.230 -11.263   2.857
  173   2HB   CYS  26           HB1      CYS  26   1.960 -10.202   3.482
  174    H    VAL  27           HN       VAL  27   4.124  -6.950   1.099
  175    HA   VAL  27           HA       VAL  27   1.245  -6.078   0.830
  176    HB   VAL  27           HB       VAL  27   3.835  -4.492   0.941
  177   1HG1  VAL  27          HG12      VAL  27   1.367  -3.794  -0.145
  178   2HG1  VAL  27          HG11      VAL  27   1.326  -3.098   1.476
  179   3HG1  VAL  27          HG13      VAL  27   2.630  -2.671   0.367
  180   1HG2  VAL  27          HG22      VAL  27   1.712  -5.153   2.987
  181   2HG2  VAL  27          HG21      VAL  27   3.460  -5.342   3.125
  182   3HG2  VAL  27          HG23      VAL  27   2.743  -3.732   3.156
  183    H    CYS  28           HN       CYS  28   0.610  -6.479  -1.276
  184    HA   CYS  28           HA       CYS  28   2.679  -6.151  -3.421
  185   1HB   CYS  28           HB2      CYS  28   0.129  -7.773  -3.414
  186   2HB   CYS  28           HB1      CYS  28   1.471  -7.927  -4.543
  187    H    TYR  29           HN       TYR  29   1.944  -5.488  -5.523
  188    HA   TYR  29           HA       TYR  29  -0.576  -3.934  -5.662
  189   1HB   TYR  29           HB2      TYR  29   2.198  -2.904  -6.179
  190   2HB   TYR  29           HB1      TYR  29   0.712  -2.041  -6.506
  191    HD1  TYR  29           HD1      TYR  29   2.789  -3.516  -3.869
  192    HD2  TYR  29           HD2      TYR  29  -0.434  -0.886  -4.827
  193    HE1  TYR  29           HE1      TYR  29   2.855  -2.615  -1.570
  194    HE2  TYR  29           HE2      TYR  29  -0.397   0.028  -2.533
  195    HH   TYR  29           HH       TYR  29   0.783  -1.343  -0.030
  196    H    ASP  30           HN       ASP  30  -0.699  -3.057  -8.068
  197    HA   ASP  30           HA       ASP  30  -0.026  -5.266  -9.846
  198   1HB   ASP  30           HB2      ASP  30  -1.484  -4.224 -11.337
  199   2HB   ASP  30           HB1      ASP  30  -2.165  -3.895  -9.747
  200    H    SER  31           HN       SER  31   0.977  -1.867  -9.519
  201    HA   SER  31           HA       SER  31   2.823  -2.084 -11.821
  202   1HB   SER  31           HB2      SER  31   2.796   0.060  -9.756
  203   2HB   SER  31           HB1      SER  31   3.200   0.189 -11.461
  204    HG   SER  31           HG       SER  31   1.069   0.970 -10.876
  205    H    LYS  32           HN       LYS  32   4.805  -3.279 -11.517
  206    HA   LYS  32           HA       LYS  32   5.783  -4.110  -8.993
  207   1HB   LYS  32           HB2      LYS  32   7.793  -4.689 -10.212
  208   2HB   LYS  32           HB1      LYS  32   6.525  -4.701 -11.444
  209   1HG   LYS  32           HG2      LYS  32   7.232  -2.647 -12.369
  210   2HG   LYS  32           HG1      LYS  32   8.165  -2.219 -10.936
  211   1HD   LYS  32           HD2      LYS  32   9.824  -2.934 -12.493
  212   2HD   LYS  32           HD1      LYS  32   9.565  -4.360 -11.474
  213   1HE   LYS  32           HE2      LYS  32   8.106  -5.380 -13.147
  214   2HE   LYS  32           HE1      LYS  32   8.100  -3.890 -14.116
  215   1HZ   LYS  32           HZ2      LYS  32  10.576  -4.081 -14.181
  216   2HZ   LYS  32           HZ1      LYS  32  10.427  -5.633 -13.506
  217   3HZ   LYS  32           HZ3      LYS  32   9.757  -5.304 -15.029
  218    H    ALA  33           HN       ALA  33   6.169  -1.052 -10.742
  219    HA   ALA  33           HA       ALA  33   8.040   0.250  -9.073
  220   1HB   ALA  33           HB3      ALA  33   7.083   0.958 -11.333
  221   2HB   ALA  33           HB2      ALA  33   5.596   1.388 -10.483
  222   3HB   ALA  33           HB1      ALA  33   7.097   2.246 -10.125
  223    H    ILE  34           HN       ILE  34   4.393   0.057  -8.885
  224    HA   ILE  34           HA       ILE  34   4.148   1.690  -6.618
  225    HB   ILE  34           HB       ILE  34   2.677  -0.542  -7.868
  226   1HG1  ILE  34          HG12      ILE  34   2.407   2.452  -7.620
  227   2HG1  ILE  34          HG11      ILE  34   2.478   1.474  -9.081
  228   1HG2  ILE  34          HG23      ILE  34   2.318  -0.497  -5.324
  229   2HG2  ILE  34          HG22      ILE  34   1.639   1.111  -5.541
  230   3HG2  ILE  34          HG21      ILE  34   0.862  -0.280  -6.290
  231   1HD1  ILE  34          HD11      ILE  34   0.303   0.408  -8.293
  232   2HD1  ILE  34          HD13      ILE  34   0.221   1.704  -7.101
  233   3HD1  ILE  34          HD12      ILE  34   0.192   2.087  -8.825
  234    H    CYS  35           HN       CYS  35   5.227  -1.501  -7.020
  235    HA   CYS  35           HA       CYS  35   4.980  -2.487  -4.316
  236   1HB   CYS  35           HB2      CYS  35   5.596  -3.981  -6.178
  237   2HB   CYS  35           HB1      CYS  35   7.068  -3.036  -6.477
  238    H    ASN  36           HN       ASN  36   7.974  -1.307  -5.937
  239    HA   ASN  36           HA       ASN  36   9.408  -0.716  -3.518
  240   1HB   ASN  36           HB2      ASN  36  10.435  -0.775  -5.757
  241   2HB   ASN  36           HB1      ASN  36   9.444   0.594  -6.284
  242   1HD2  ASN  36          HD22      ASN  36  11.692   2.973  -4.979
  243   2HD2  ASN  36          HD21      ASN  36  10.345   2.655  -5.961
  244    H    LYS  37           HN       LYS  37   7.543   1.547  -5.537
  245    HA   LYS  37           HA       LYS  37   7.789   3.856  -3.957
  246   1HB   LYS  37           HB2      LYS  37   7.087   3.522  -6.360
  247   2HB   LYS  37           HB1      LYS  37   5.495   3.088  -5.746
  248   1HG   LYS  37           HG2      LYS  37   6.834   5.684  -4.968
  249   2HG   LYS  37           HG1      LYS  37   5.855   5.554  -6.427
  250   1HD   LYS  37           HD2      LYS  37   4.110   4.460  -4.746
  251   2HD   LYS  37           HD1      LYS  37   5.012   5.397  -3.559
  252   1HE   LYS  37           HE2      LYS  37   3.946   6.640  -6.117
  253   2HE   LYS  37           HE1      LYS  37   3.016   6.611  -4.604
  254   1HZ   LYS  37           HZ3      LYS  37   4.972   7.579  -3.484
  255   2HZ   LYS  37           HZ2      LYS  37   5.740   7.735  -4.992
  256   3HZ   LYS  37           HZ1      LYS  37   4.321   8.610  -4.663
  257    H    ASN  38           HN       ASN  38   4.545   2.465  -4.429
  258    HA   ASN  38           HA       ASN  38   3.394   3.653  -2.215
  259   1HB   ASN  38           HB2      ASN  38   2.849   1.429  -4.053
  260   2HB   ASN  38           HB1      ASN  38   1.704   1.799  -2.759
  261   1HD2  ASN  38          HD22      ASN  38   1.924   4.143  -6.043
  262   2HD2  ASN  38          HD21      ASN  38   2.889   2.755  -5.850
  263    H    CYS  39           HN       CYS  39   4.980   0.575  -2.519
  264    HA   CYS  39           HA       CYS  39   3.973  -0.778  -0.254
  265   1HB   CYS  39           HB2      CYS  39   6.765  -0.606  -1.365
  266   2HB   CYS  39           HB1      CYS  39   6.315  -1.757  -0.105
  267    H    THR  40           HN       THR  40   6.129   1.995  -0.290
  268    HA   THR  40           HA       THR  40   6.969   1.725   2.497
  269    HB   THR  40           HB       THR  40   7.735   4.138   2.029
  270    HG1  THR  40           HG1      THR  40   7.370   4.938   0.069
  271   1HG2  THR  40          HG22      THR  40   8.618   1.631   0.701
  272   2HG2  THR  40          HG21      THR  40   9.187   3.113  -0.071
  273   3HG2  THR  40          HG23      THR  40   9.556   2.805   1.626
   
  No H/Q in entry =         273
  Start of MODEL   30
    1   1H    ASP   1           HT1      ASP   1  13.396   4.363   5.778
    2   2H    ASP   1           HT3      ASP   1  11.976   5.268   5.984
    3   3H    ASP   1           HT2      ASP   1  12.055   3.672   6.558
    4    HA   ASP   1           HA       ASP   1  10.774   3.768   4.497
    5   1HB   ASP   1           HB2      ASP   1  11.994   5.840   3.779
    6   2HB   ASP   1           HB1      ASP   1  13.394   4.835   3.400
    7    H    ASP   2           HN       ASP   2  12.047   1.775   5.994
    8    HA   ASP   2           HA       ASP   2  13.911   0.278   4.269
    9   1HB   ASP   2           HB2      ASP   2  12.456  -0.442   6.885
   10   2HB   ASP   2           HB1      ASP   2  13.802  -1.349   6.183
   11    H    GLY   3           HN       GLY   3  13.316  -1.325   2.861
   12   1HA   GLY   3           HA2      GLY   3  11.263  -3.169   3.056
   13   2HA   GLY   3           HA1      GLY   3  10.506  -1.784   2.277
   14    H    LEU   4           HN       LEU   4  11.228  -4.531   1.263
   15    HA   LEU   4           HA       LEU   4  12.741  -3.650  -1.164
   16   1HB   LEU   4           HB2      LEU   4  12.939  -6.367   0.168
   17   2HB   LEU   4           HB1      LEU   4  13.967  -5.712  -1.103
   18    HG   LEU   4           HG       LEU   4  13.777  -4.357   1.590
   19   1HD1  LEU   4          HD11      LEU   4  15.183  -6.861   0.834
   20   2HD1  LEU   4          HD13      LEU   4  16.122  -5.681   1.750
   21   3HD1  LEU   4          HD12      LEU   4  14.617  -6.317   2.414
   22   1HD2  LEU   4          HD21      LEU   4  15.400  -4.138  -0.881
   23   2HD2  LEU   4          HD23      LEU   4  15.004  -2.904   0.317
   24   3HD2  LEU   4          HD22      LEU   4  16.314  -4.044   0.623
   25    H    CYS   5           HN       CYS   5  12.351  -5.619  -2.941
   26    HA   CYS   5           HA       CYS   5   9.543  -6.637  -2.628
   27   1HB   CYS   5           HB2      CYS   5   9.624  -4.353  -3.769
   28   2HB   CYS   5           HB1      CYS   5  10.451  -5.151  -5.106
   29    H    TYR   6           HN       TYR   6   9.036  -8.407  -3.921
   30    HA   TYR   6           HA       TYR   6  11.230  -9.570  -5.588
   31   1HB   TYR   6           HB2      TYR   6  11.082 -11.680  -4.413
   32   2HB   TYR   6           HB1      TYR   6  11.288 -10.421  -3.209
   33    HD1  TYR   6           HD1      TYR   6   8.920 -12.774  -4.750
   34    HD2  TYR   6           HD2      TYR   6   9.554  -9.908  -1.640
   35    HE1  TYR   6           HE1      TYR   6   6.865 -13.568  -3.614
   36    HE2  TYR   6           HE2      TYR   6   7.487 -10.679  -0.495
   37    HH   TYR   6           HH       TYR   6   6.162 -13.093  -0.556
   38    H    GLU   7           HN       GLU   7  10.274 -11.402  -6.993
   39    HA   GLU   7           HA       GLU   7   7.395 -10.744  -7.591
   40   1HB   GLU   7           HB2      GLU   7   8.009 -10.797  -9.882
   41   2HB   GLU   7           HB1      GLU   7   9.343  -9.959  -9.102
   42   1HG   GLU   7           HG2      GLU   7  10.444 -12.314  -9.001
   43   2HG   GLU   7           HG1      GLU   7   9.173 -12.741 -10.162
   44    H    GLY   8           HN       GLY   8   6.089 -12.427  -8.362
   45   1HA   GLY   8           HA2      GLY   8   6.560 -14.962  -9.106
   46   2HA   GLY   8           HA1      GLY   8   6.855 -15.104  -7.375
   47    H    THR   9           HN       THR   9   5.081 -15.847  -6.301
   48    HA   THR   9           HA       THR   9   2.382 -14.839  -6.991
   49    HB   THR   9           HB       THR   9   3.336 -17.688  -7.051
   50    HG1  THR   9           HG1      THR   9   3.501 -17.403  -9.119
   51   1HG2  THR   9          HG21      THR   9   0.682 -16.615  -6.691
   52   2HG2  THR   9          HG23      THR   9   0.775 -17.446  -8.244
   53   3HG2  THR   9          HG22      THR   9   1.187 -18.303  -6.760
   54    H    ASN  10           HN       ASN  10   4.411 -15.056  -4.509
   55    HA   ASN  10           HA       ASN  10   3.154 -16.917  -2.684
   56   1HB   ASN  10           HB2      ASN  10   5.509 -16.120  -2.710
   57   2HB   ASN  10           HB1      ASN  10   4.949 -14.566  -2.094
   58   1HD2  ASN  10          HD22      ASN  10   4.621 -15.795   1.260
   59   2HD2  ASN  10          HD21      ASN  10   4.509 -14.419   0.211
   60    H    CYS  11           HN       CYS  11   2.202 -13.842  -3.632
   61    HA   CYS  11           HA       CYS  11   0.397 -13.660  -1.246
   62   1HB   CYS  11           HB2      CYS  11   1.954 -11.572  -2.761
   63   2HB   CYS  11           HB1      CYS  11   0.530 -11.111  -1.817
   64    H    GLY  12           HN       GLY  12   0.167 -14.875  -3.957
   65   1HA   GLY  12           HA2      GLY  12  -1.710 -15.129  -5.378
   66   2HA   GLY  12           HA1      GLY  12  -2.517 -13.912  -4.379
   67    H    LYS  13           HN       LYS  13   0.546 -12.964  -5.484
   68    HA   LYS  13           HA       LYS  13  -0.621 -10.892  -7.153
   69   1HB   LYS  13           HB2      LYS  13   1.497  -9.883  -6.909
   70   2HB   LYS  13           HB1      LYS  13   1.148 -10.716  -5.408
   71   1HG   LYS  13           HG2      LYS  13   2.440 -12.706  -6.388
   72   2HG   LYS  13           HG1      LYS  13   3.023 -11.570  -7.593
   73   1HD   LYS  13           HD2      LYS  13   3.518 -10.139  -5.386
   74   2HD   LYS  13           HD1      LYS  13   3.647 -11.754  -4.701
   75   1HE   LYS  13           HE2      LYS  13   5.003 -11.589  -7.276
   76   2HE   LYS  13           HE1      LYS  13   5.660 -10.424  -6.116
   77   1HZ   LYS  13           HZ1      LYS  13   5.457 -12.388  -4.473
   78   2HZ   LYS  13           HZ3      LYS  13   5.437 -13.352  -5.869
   79   3HZ   LYS  13           HZ2      LYS  13   6.772 -12.352  -5.548
   80    H    VAL  14           HN       VAL  14  -1.132 -13.162  -8.385
   81    HA   VAL  14           HA       VAL  14   0.863 -14.086 -10.274
   82    HB   VAL  14           HB       VAL  14  -2.164 -14.140 -10.123
   83   1HG1  VAL  14          HG11      VAL  14  -1.492 -14.225 -12.505
   84   2HG1  VAL  14          HG13      VAL  14  -0.389 -15.553 -12.143
   85   3HG1  VAL  14          HG12      VAL  14  -2.130 -15.780 -11.970
   86   1HG2  VAL  14          HG22      VAL  14  -0.423 -15.530  -8.631
   87   2HG2  VAL  14          HG21      VAL  14  -1.943 -16.233  -9.182
   88   3HG2  VAL  14          HG23      VAL  14  -0.447 -16.583 -10.047
   89    H    GLY  15           HN       GLY  15   1.791 -12.584 -11.691
   90   1HA   GLY  15           HA2      GLY  15   1.492 -11.335 -13.796
   91   2HA   GLY  15           HA1      GLY  15  -0.137 -10.903 -13.267
   92    H    LYS  16           HN       LYS  16   1.105 -10.299 -10.460
   93    HA   LYS  16           HA       LYS  16   2.297  -7.654 -11.229
   94   1HB   LYS  16           HB2      LYS  16   0.524  -8.285  -8.877
   95   2HB   LYS  16           HB1      LYS  16   1.109  -6.702  -9.374
   96   1HG   LYS  16           HG2      LYS  16  -0.096  -6.939 -11.528
   97   2HG   LYS  16           HG1      LYS  16  -0.762  -8.473 -10.967
   98   1HD   LYS  16           HD2      LYS  16  -1.250  -6.558  -8.913
   99   2HD   LYS  16           HD1      LYS  16  -1.711  -5.808 -10.441
  100   1HE   LYS  16           HE2      LYS  16  -3.060  -7.858 -10.988
  101   2HE   LYS  16           HE1      LYS  16  -2.699  -8.473  -9.362
  102   1HZ   LYS  16           HZ1      LYS  16  -3.781  -5.752  -9.796
  103   2HZ   LYS  16           HZ3      LYS  16  -4.806  -7.091  -9.623
  104   3HZ   LYS  16           HZ2      LYS  16  -3.754  -6.660  -8.361
  105    H    TYR  17           HN       TYR  17   2.775  -7.213  -8.147
  106    HA   TYR  17           HA       TYR  17   4.794  -9.367  -7.694
  107   1HB   TYR  17           HB2      TYR  17   5.539  -6.437  -7.618
  108   2HB   TYR  17           HB1      TYR  17   6.584  -7.867  -7.586
  109    HD1  TYR  17           HD1      TYR  17   4.352  -5.864  -9.813
  110    HD2  TYR  17           HD2      TYR  17   7.202  -9.028  -9.485
  111    HE1  TYR  17           HE1      TYR  17   4.563  -5.943 -12.287
  112    HE2  TYR  17           HE2      TYR  17   7.434  -9.115 -11.927
  113    HH   TYR  17           HH       TYR  17   6.077  -6.677 -13.980
  114    H    CYS  18           HN       CYS  18   5.957  -8.780  -5.331
  115    HA   CYS  18           HA       CYS  18   3.852  -7.570  -3.568
  116   1HB   CYS  18           HB2      CYS  18   5.198 -10.292  -3.419
  117   2HB   CYS  18           HB1      CYS  18   4.335  -9.585  -2.051
  118    H    CYS  19           HN       CYS  19   4.722  -7.012  -1.412
  119    HA   CYS  19           HA       CYS  19   7.668  -6.706  -1.353
  120   1HB   CYS  19           HB2      CYS  19   7.069  -4.382  -0.321
  121   2HB   CYS  19           HB1      CYS  19   6.902  -4.600  -2.065
  122    H    SER  20           HN       SER  20   8.506  -7.517   0.513
  123    HA   SER  20           HA       SER  20   7.299  -7.052   3.125
  124   1HB   SER  20           HB2      SER  20   6.981  -9.561   3.557
  125   2HB   SER  20           HB1      SER  20   5.857  -8.881   2.379
  126    HG   SER  20           HG       SER  20   8.150 -10.466   1.961
  127    HA   PRO  21           HA       PRO  21  11.681  -7.626   3.545
  128   1HB   PRO  21           HB2      PRO  21  11.936  -6.857   6.164
  129   2HB   PRO  21           HB1      PRO  21  11.723  -5.710   4.825
  130   1HG   PRO  21           HG2      PRO  21   9.721  -6.642   6.828
  131   2HG   PRO  21           HG1      PRO  21   9.868  -5.078   6.000
  132   1HD   PRO  21           HD2      PRO  21   8.091  -7.151   5.360
  133   2HD   PRO  21           HD1      PRO  21   8.494  -5.765   4.318
  134    H    ILE  22           HN       ILE  22   9.284  -9.464   4.886
  135    HA   ILE  22           HA       ILE  22  11.106 -11.656   5.477
  136    HB   ILE  22           HB       ILE  22  11.092 -10.046   7.471
  137   1HG1  ILE  22          HG12      ILE  22  10.223 -12.938   7.868
  138   2HG1  ILE  22          HG11      ILE  22  11.875 -12.317   7.872
  139   1HG2  ILE  22          HG21      ILE  22   8.356 -10.232   7.034
  140   2HG2  ILE  22          HG23      ILE  22   8.614 -11.141   8.524
  141   3HG2  ILE  22          HG22      ILE  22   9.146  -9.462   8.409
  142   1HD1  ILE  22          HD12      ILE  22  10.639 -10.774   9.815
  143   2HD1  ILE  22          HD11      ILE  22   9.894 -12.356  10.037
  144   3HD1  ILE  22          HD13      ILE  22  11.648 -12.187  10.122
  145    H    GLY  23           HN       GLY  23   8.462 -10.716   4.205
  146   1HA   GLY  23           HA2      GLY  23   6.631 -11.930   3.266
  147   2HA   GLY  23           HA1      GLY  23   7.222 -13.330   4.148
  148    H    LYS  24           HN       LYS  24   6.892 -10.636   6.155
  149    HA   LYS  24           HA       LYS  24   4.577 -11.875   7.451
  150   1HB   LYS  24           HB2      LYS  24   5.097 -10.447   9.289
  151   2HB   LYS  24           HB1      LYS  24   6.619 -11.050   8.643
  152   1HG   LYS  24           HG2      LYS  24   6.924  -8.953   7.377
  153   2HG   LYS  24           HG1      LYS  24   5.389  -8.352   8.000
  154   1HD   LYS  24           HD2      LYS  24   7.819  -9.073   9.661
  155   2HD   LYS  24           HD1      LYS  24   7.255  -7.441   9.311
  156   1HE   LYS  24           HE2      LYS  24   5.738  -9.558  10.887
  157   2HE   LYS  24           HE1      LYS  24   6.468  -8.080  11.539
  158   1HZ   LYS  24           HZ1      LYS  24   5.092  -6.846   9.866
  159   2HZ   LYS  24           HZ3      LYS  24   4.252  -8.289   9.578
  160   3HZ   LYS  24           HZ2      LYS  24   4.210  -7.576  11.118
  161    H    TYR  25           HN       TYR  25   5.311  -8.912   5.673
  162    HA   TYR  25           HA       TYR  25   2.679  -7.735   6.221
  163   1HB   TYR  25           HB2      TYR  25   5.121  -6.999   4.620
  164   2HB   TYR  25           HB1      TYR  25   3.633  -6.059   4.495
  165    HD1  TYR  25           HD2      TYR  25   2.644  -5.025   6.578
  166    HD2  TYR  25           HD1      TYR  25   6.559  -6.776   6.496
  167    HE1  TYR  25           HE2      TYR  25   3.221  -3.822   8.676
  168    HE2  TYR  25           HE1      TYR  25   7.149  -5.564   8.595
  169    HH   TYR  25           HH       TYR  25   5.655  -3.018   9.714
  170    H    CYS  26           HN       CYS  26   4.318  -9.281   3.455
  171    HA   CYS  26           HA       CYS  26   3.462  -9.904   1.314
  172   1HB   CYS  26           HB2      CYS  26   2.535 -11.619   2.830
  173   2HB   CYS  26           HB1      CYS  26   1.178 -10.564   3.243
  174    H    VAL  27           HN       VAL  27   3.347  -7.352   0.988
  175    HA   VAL  27           HA       VAL  27   0.477  -6.556   0.512
  176    HB   VAL  27           HB       VAL  27   2.997  -4.901   0.909
  177   1HG1  VAL  27          HG11      VAL  27   0.713  -4.192  -0.429
  178   2HG1  VAL  27          HG13      VAL  27   0.326  -3.686   1.215
  179   3HG1  VAL  27          HG12      VAL  27   1.765  -3.054   0.415
  180   1HG2  VAL  27          HG23      VAL  27   1.778  -6.271   2.858
  181   2HG2  VAL  27          HG22      VAL  27   2.401  -4.644   3.129
  182   3HG2  VAL  27          HG21      VAL  27   0.685  -4.888   2.804
  183    H    CYS  28           HN       CYS  28   0.021  -6.808  -1.671
  184    HA   CYS  28           HA       CYS  28   2.298  -6.422  -3.582
  185   1HB   CYS  28           HB2      CYS  28  -0.251  -8.009  -3.911
  186   2HB   CYS  28           HB1      CYS  28   1.210  -8.141  -4.887
  187    H    TYR  29           HN       TYR  29   1.806  -5.642  -5.705
  188    HA   TYR  29           HA       TYR  29  -0.671  -4.048  -6.055
  189   1HB   TYR  29           HB2      TYR  29   2.156  -3.044  -6.180
  190   2HB   TYR  29           HB1      TYR  29   0.744  -2.148  -6.694
  191    HD1  TYR  29           HD1      TYR  29   2.363  -3.760  -3.824
  192    HD2  TYR  29           HD2      TYR  29  -0.576  -0.973  -5.172
  193    HE1  TYR  29           HE1      TYR  29   2.114  -2.921  -1.514
  194    HE2  TYR  29           HE2      TYR  29  -0.852  -0.119  -2.871
  195    HH   TYR  29           HH       TYR  29   0.589  -0.044  -0.750
  196    H    ASP  30           HN       ASP  30  -0.461  -3.018  -8.417
  197    HA   ASP  30           HA       ASP  30   0.327  -5.164 -10.222
  198   1HB   ASP  30           HB2      ASP  30  -0.884  -3.968 -11.819
  199   2HB   ASP  30           HB1      ASP  30  -1.743  -3.689 -10.308
  200    H    SER  31           HN       SER  31   1.414  -1.821  -9.628
  201    HA   SER  31           HA       SER  31   3.552  -2.061 -11.659
  202   1HB   SER  31           HB2      SER  31   3.325   0.035  -9.556
  203   2HB   SER  31           HB1      SER  31   3.970   0.185 -11.183
  204    HG   SER  31           HG       SER  31   1.314   0.108 -10.297
  205    H    LYS  32           HN       LYS  32   5.425  -3.342 -11.119
  206    HA   LYS  32           HA       LYS  32   5.977  -4.283  -8.509
  207   1HB   LYS  32           HB2      LYS  32   8.114  -4.940  -9.431
  208   2HB   LYS  32           HB1      LYS  32   7.044  -4.859 -10.836
  209   1HG   LYS  32           HG2      LYS  32   7.988  -2.843 -11.601
  210   2HG   LYS  32           HG1      LYS  32   8.702  -2.472 -10.030
  211   1HD   LYS  32           HD2      LYS  32  10.544  -3.255 -11.347
  212   2HD   LYS  32           HD1      LYS  32  10.083  -4.652 -10.362
  213   1HE   LYS  32           HE2      LYS  32   8.585  -5.398 -12.309
  214   2HE   LYS  32           HE1      LYS  32   9.388  -4.153 -13.290
  215   1HZ   LYS  32           HZ1      LYS  32  11.536  -5.101 -12.596
  216   2HZ   LYS  32           HZ3      LYS  32  10.719  -6.348 -11.787
  217   3HZ   LYS  32           HZ2      LYS  32  10.599  -6.211 -13.477
  218    H    ALA  33           HN       ALA  33   6.749  -1.201 -10.074
  219    HA   ALA  33           HA       ALA  33   8.415  -0.048  -8.101
  220   1HB   ALA  33           HB2      ALA  33   7.824   0.770 -10.455
  221   2HB   ALA  33           HB1      ALA  33   6.263   1.271  -9.799
  222   3HB   ALA  33           HB3      ALA  33   7.749   2.021  -9.211
  223    H    ILE  34           HN       ILE  34   4.776  -0.064  -8.458
  224    HA   ILE  34           HA       ILE  34   4.267   1.506  -6.189
  225    HB   ILE  34           HB       ILE  34   2.908  -0.615  -7.726
  226   1HG1  ILE  34          HG12      ILE  34   2.722   2.377  -7.406
  227   2HG1  ILE  34          HG11      ILE  34   2.965   1.442  -8.876
  228   1HG2  ILE  34          HG23      ILE  34   2.184  -0.628  -5.252
  229   2HG2  ILE  34          HG22      ILE  34   1.579   1.001  -5.527
  230   3HG2  ILE  34          HG21      ILE  34   0.897  -0.354  -6.422
  231   1HD1  ILE  34          HD11      ILE  34   0.660   0.451  -8.458
  232   2HD1  ILE  34          HD13      ILE  34   0.456   1.702  -7.234
  233   3HD1  ILE  34          HD12      ILE  34   0.691   2.153  -8.925
  234    H    CYS  35           HN       CYS  35   5.243  -1.718  -6.551
  235    HA   CYS  35           HA       CYS  35   4.559  -2.779  -3.955
  236   1HB   CYS  35           HB2      CYS  35   5.341  -4.240  -5.769
  237   2HB   CYS  35           HB1      CYS  35   6.881  -3.365  -5.848
  238    H    ASN  36           HN       ASN  36   7.826  -1.738  -5.069
  239    HA   ASN  36           HA       ASN  36   8.908  -1.311  -2.442
  240   1HB   ASN  36           HB2      ASN  36  10.247  -1.367  -4.516
  241   2HB   ASN  36           HB1      ASN  36   9.438   0.090  -5.113
  242   1HD2  ASN  36          HD22      ASN  36  12.561   0.438  -2.556
  243   2HD2  ASN  36          HD21      ASN  36  12.051  -1.073  -3.136
  244    H    LYS  37           HN       LYS  37   7.491   1.110  -4.630
  245    HA   LYS  37           HA       LYS  37   7.630   3.364  -2.956
  246   1HB   LYS  37           HB2      LYS  37   7.289   3.114  -5.449
  247   2HB   LYS  37           HB1      LYS  37   5.595   2.785  -5.095
  248   1HG   LYS  37           HG2      LYS  37   6.978   5.265  -4.056
  249   2HG   LYS  37           HG1      LYS  37   6.227   5.228  -5.650
  250   1HD   LYS  37           HD2      LYS  37   4.199   4.201  -4.205
  251   2HD   LYS  37           HD1      LYS  37   4.958   5.183  -2.955
  252   1HE   LYS  37           HE2      LYS  37   4.004   6.161  -5.680
  253   2HE   LYS  37           HE1      LYS  37   3.291   6.559  -4.104
  254   1HZ   LYS  37           HZ2      LYS  37   5.889   7.124  -3.696
  255   2HZ   LYS  37           HZ1      LYS  37   5.720   7.556  -5.330
  256   3HZ   LYS  37           HZ3      LYS  37   4.727   8.273  -4.159
  257    H    ASN  38           HN       ASN  38   4.422   2.201  -3.962
  258    HA   ASN  38           HA       ASN  38   3.018   3.397  -1.900
  259   1HB   ASN  38           HB2      ASN  38   2.623   1.290  -3.905
  260   2HB   ASN  38           HB1      ASN  38   1.315   1.699  -2.792
  261   1HD2  ASN  38          HD22      ASN  38   2.220   4.137  -5.886
  262   2HD2  ASN  38          HD21      ASN  38   3.046   2.676  -5.607
  263    H    CYS  39           HN       CYS  39   4.472   0.257  -2.073
  264    HA   CYS  39           HA       CYS  39   3.033  -1.172  -0.124
  265   1HB   CYS  39           HB2      CYS  39   5.986  -0.993  -0.658
  266   2HB   CYS  39           HB1      CYS  39   5.311  -2.166   0.475
  267    H    THR  40           HN       THR  40   5.322   1.455   0.438
  268    HA   THR  40           HA       THR  40   5.410   1.078   3.337
  269    HB   THR  40           HB       THR  40   6.476   3.437   3.112
  270    HG1  THR  40           HG1      THR  40   7.100   3.807   0.885
  271   1HG2  THR  40          HG23      THR  40   7.511   0.889   1.861
  272   2HG2  THR  40          HG22      THR  40   8.472   2.364   1.763
  273   3HG2  THR  40          HG21      THR  40   8.044   1.697   3.338
   
  No H/Q in entry =         273