NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
28562 3eza 4264 cing 1-original 12 XPLOR/CNS dipolar coupling


!
! M1:  ***    -  ***   

! I2:  ***    -  ***   

! S3:  ***    -  ***   

! G4:  86.91  -  92.72 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 4    and name N   )
       ( resid 4    and name HN  )  -5.8048  0.2000

! I5:  87.60  -  93.27 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 5    and name N   )
       ( resid 5    and name HN  )  -5.6681  0.2000

! L6: 104.65  -  93.49 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name N   )
       ( resid 6    and name HN  )  11.1614  0.2000

! A7:  98.14  -  93.58 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 7    and name N   )
       ( resid 7    and name HN  )  4.5512  0.2000

! S8:  ***    -  ***   

! P9:  ***    -  ***   

! G10: 111.63  -  92.73 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )  18.8961  0.2000

! I11: 112.27  -  93.49 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 11   and name N   )
       ( resid 11   and name HN  )  18.7745  0.2000

! A12: 114.83  -  95.55 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name N   )
       ( resid 12   and name HN  )  19.2760  0.2000

! F13: 112.79  -  ***   

! G14: 118.88  -  96.64 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )  22.2392  0.2000

! K15: 114.57  -  93.88 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )  20.6892  0.2000

! A16:  ***    -  92.97 

! L17:  ***    -  ***   

! L18:  97.54  -  92.98 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   )
       ( resid 18   and name HN  )  4.5588  0.2000

! L19:  97.01  -  94.75 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )  2.2642  0.2000

! K20: 100.65  -  93.91 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name N   )
       ( resid 20   and name HN  )  6.7394  0.2000

! E21: 102.89  -  90.35 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  12.5366  0.2000

! D22: 108.51  -  92.20 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   )
       ( resid 22   and name HN  )  16.3052  0.2000

! E23:  ***    -  92.95 

! I24:  97.95  -  91.63 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   )
       ( resid 24   and name HN  )  6.3139  0.2000

! V25: 104.94  -  94.30 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name N   )
       ( resid 25   and name HN  )  10.6447  0.2000

! I26: 103.79  -  93.20 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26   and name N   )
       ( resid 26   and name HN  )  10.5915  0.2000

! D27: 114.96  -  95.50 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )  19.4583  0.2000

! R28:  86.21  -  91.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )  -5.4857  0.2000

! K29:  ***    -  ***   

! K30: 113.10  -  92.23 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name N   )
       ( resid 30   and name HN  )  20.8640  0.2000

! I31:  99.27  -  91.90 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )  7.3700  0.2000

! S32:  86.80  -  93.08 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )  -6.2835  0.2000

! A33: 104.30  -  92.93 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )  11.3665  0.2000

! D34: 111.29  -  92.82 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34   and name N   )
       ( resid 34   and name HN  )  18.4706  0.2000

! Q35:  ***    -  ***   

! V36:  84.26  -  93.58 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )  -9.3227  0.2000

! D37:  91.13  -  93.35 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )  -2.2186  0.2000

! Q38:  98.20  -  ***   

! E39:  ***    -  93.85 

! V40:  78.59  -  91.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )  -13.1065  0.2000

! E41:  91.22  -  91.75 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name N   )
       ( resid 41   and name HN  )  -0.5243  0.2000

! R42:  95.47  -  93.28 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )  2.1882  0.2000

! F43:  ***    -  ***   

! L44:  ***    -  ***   

! S45: 100.07  -  94.28 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   )
       ( resid 45   and name HN  )  5.7972  0.2000

! G46:  91.30  -  95.70 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )  -4.3992  0.2000

! R47:  78.21  -  92.06 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   )
       ( resid 47   and name HN  )  -13.8511  0.2000

! A48:  ***    -  92.38 

! K49:  ***    -  ***   

! A50: 116.47  -  93.79 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   )
       ( resid 50   and name HN  )  22.6799  0.2000

! S51:  ***    -  ***   

! A52:  96.63  -  91.52 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name N   )
       ( resid 52   and name HN  )  5.1134  0.2000

! Q53:  94.61  -  92.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   )
       ( resid 53   and name HN  )  1.8311  0.2000

! L54:  ***    -  92.60 

! E55:  ***    -  ***   

! T56: 102.75  -  93.06 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name N   )
       ( resid 56   and name HN  )  9.6950  0.2000

! I57:  87.76  -  90.98 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name N   )
       ( resid 57   and name HN  )  -3.2139  0.2000

! K58:  81.71  -  91.99 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name N   )
       ( resid 58   and name HN  )  -10.2800  0.2000

! T59:  97.56  -  99.16 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   )
       ( resid 59   and name HN  )  -1.6032  0.2000

! K60:  97.95  -  93.13 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 60   and name N   )
       ( resid 60   and name HN  )  4.8171  0.2000

! A61:  79.60  -  93.52 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   )
       ( resid 61   and name HN  )  -13.9270  0.2000

! G62:  86.99  -  93.30 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   )
       ( resid 62   and name HN  )  -6.3063  0.2000

! E63:  ***    -  ***   

! T64:  88.12  -  92.74 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   )
       ( resid 64   and name HN  )  -4.6196  0.2000

! F65:  79.84  -  89.71 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65   and name N   )
       ( resid 65   and name HN  )  -9.8697  0.2000

! G66: 100.76  -  94.27 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   )
       ( resid 66   and name HN  )  6.4962  0.2000

! E67: 101.70  -  91.55 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   )
       ( resid 67   and name HN  )  10.1509  0.2000

! E68:  78.17  -  92.10 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   )
       ( resid 68   and name HN  )  -13.9346  0.2000

! K69:  97.38  -  93.23 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   )
       ( resid 69   and name HN  )  4.1409  0.2000

! E70: 102.89  -  92.25 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   )
       ( resid 70   and name HN  )  10.6447  0.2000

! A71:  ***    -  ***   

! I72:  74.67  -  92.09 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   )
       ( resid 72   and name HN  )  -17.4221  0.2000

! F73:  91.47  -  93.42 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   )
       ( resid 73   and name HN  )  -1.9451  0.2000

! E74:  91.21  -  91.67 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   )
       ( resid 74   and name HN  )  -0.4559  0.2000

! G75:  75.81  -  93.16 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   )
       ( resid 75   and name HN  )  -17.3461  0.2000

! H76:  ***    -  ***   

! I77:  ***    -  ***   

! M78:  84.71  -  91.83 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78   and name N   )
       ( resid 78   and name HN  )  -7.1193  0.2000

! L79:  ***    -  ***   

! L80:  82.89  -  92.82 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name N   )
       ( resid 80   and name HN  )  -9.9229  0.2000

! E81:  92.59  -  92.38 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name N   )
       ( resid 81   and name HN  )  0.2127  0.2000

! D82:  74.44  -  93.01 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name N   )
       ( resid 82   and name HN  )  -18.5618  0.2000

! E83: 109.77  -  91.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name N   )
       ( resid 83   and name HN  )  18.1971  0.2000

! E84:  90.07  -  91.19 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name N   )
       ( resid 84   and name HN  )  -1.1245  0.2000

! L85: 110.40  -  93.50 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 85   and name N   )
       ( resid 85   and name HN  )  16.8978  0.2000

! E86:  ***    -  ***   

! Q87:  ***    -  ***   

! E88:  ***    -  ***   

! I89: 115.12  -  93.50 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name N   )
       ( resid 89   and name HN  )  21.6162  0.2000

! I90:  ***    -  ***   

! A91: 103.26  -  92.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 91   and name N   )
       ( resid 91   and name HN  )  10.5687  0.2000

! L92:  97.38  -  92.89 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 92   and name N   )
       ( resid 92   and name HN  )  4.4904  0.2000

! I93: 109.55  -  93.39 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 93   and name N   )
       ( resid 93   and name HN  )  16.1608  0.2000

! K94: 107.13  -  93.67 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 94   and name N   )
       ( resid 94   and name HN  )  13.4636  0.2000

! D95:  ***    -  ***   

! K96: 103.08  -  91.74 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 96   and name N   )
       ( resid 96   and name HN  )  11.3437  0.2000

! H97: 104.63  -  93.58 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 97   and name N   )
       ( resid 97   and name HN  )  11.0474  0.2000

! M98:  94.34  -  91.55 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 98   and name N   )
       ( resid 98   and name HN  )  2.7884  0.2000

! T99: 103.51  -  93.49 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 99   and name N   )
       ( resid 99   and name HN  )  10.0217  0.2000

! A100:  97.83  -  92.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 100  and name N   )
       ( resid 100  and name HN  )  5.2578  0.2000

! D101: 101.55  -  92.32 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 101  and name N   )
       ( resid 101  and name HN  )  9.2315  0.2000

! A102:  94.37  -  94.21 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 102  and name N   )
       ( resid 102  and name HN  )  0.1596  0.2000

! A103: 100.63  -  94.32 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 103  and name N   )
       ( resid 103  and name HN  )  6.3139  0.2000

! A104:  ***    -  92.10 

! H105: 100.75  -  92.28 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 105  and name N   )
       ( resid 105  and name HN  )  8.4641  0.2000

! E106:  96.14  -  92.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 106  and name N   )
       ( resid 106  and name HN  )  3.3659  0.2000

! V107: 101.32  -  93.45 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 107  and name N   )
       ( resid 107  and name HN  )  7.8639  0.2000

! I108:  ***    -  ***   

! E109:  97.31  -  93.39 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 109  and name N   )
       ( resid 109  and name HN  )  3.9281  0.2000

! G110:  98.05  -  93.45 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 110  and name N   )
       ( resid 110  and name HN  )  4.6044  0.2000

! Q111: 102.34  -  ***   

! A112:  96.29  -  ***   

! S113:  93.67  -  92.94 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 113  and name N   )
       ( resid 113  and name HN  )  0.7294  0.2000

! A114:  99.37  -  94.06 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 114  and name N   )
       ( resid 114  and name HN  )  5.3110  0.2000

! L115:  ***    -  ***   

! E116:  97.25  -  91.53 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 116  and name N   )
       ( resid 116  and name HN  )  5.7137  0.2000

! E117:  85.36  -  ***   

! L118: 103.10  -  93.88 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 118  and name N   )
       ( resid 118  and name HN  )  9.2163  0.2000

! D119:  ***    -  93.47 

! D120:  ***    -  91.42 

! E121:  99.59  -  94.00 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 121  and name N   )
       ( resid 121  and name HN  )  5.5845  0.2000

! Y122:  92.64  -  91.65 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 122  and name N   )
       ( resid 122  and name HN  )  0.9877  0.2000

! L123: 105.16  -  94.88 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 123  and name N   )
       ( resid 123  and name HN  )  10.2800  0.2000

! K124:  ***    -  ***   

! E125: 100.88  -  ***   

! R126:  ***    -  ***   

! A127:  ***    -  ***   

! A128:  99.87  -  93.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 128  and name N   )
       ( resid 128  and name HN  )  6.0860  0.2000

! D129:  ***    -  ***   

! V130:  ***    -  ***   

! R131:  ***    -  ***   

! D132:  ***    -  93.74 

! I133:  ***    -  ***   

! G134: 101.71  -  93.48 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 134  and name N   )
       ( resid 134  and name HN  )  8.2286  0.2000

! K135:  ***    -  97.25 

! R136: 104.38  -  93.52 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 136  and name N   )
       ( resid 136  and name HN  )  10.8651  0.2000

! L137:  ***    -  95.48 

! L138:  98.30  -  94.15 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 138  and name N   )
       ( resid 138  and name HN  )  4.1561  0.2000

! R139: 100.56  -  93.00 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 139  and name N   )
       ( resid 139  and name HN  )  7.5600  0.2000

! N140:  ***    -  ***   

! I141: 103.06  -  92.99 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 141  and name N   )
       ( resid 141  and name HN  )  10.0673  0.2000

! L142:  ***    -  92.41 

! G143:  99.19  -  94.56 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 143  and name N   )
       ( resid 143  and name HN  )  4.6347  0.2000

! L144:  ***    -  ***   

! K145:  ***    -  ***   

! I146: 104.19  -  92.35 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 146  and name N   )
       ( resid 146  and name HN  )  11.8452  0.2000

! I147: 103.83  -  94.13 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 147  and name N   )
       ( resid 147  and name HN  )  9.6950  0.2000

! D148:  90.78  -  92.65 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 148  and name N   )
       ( resid 148  and name HN  )  -1.8691  0.2000

! L149:  76.25  -  93.56 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 149  and name N   )
       ( resid 149  and name HN  )  -17.3081  0.2000

! S150:  73.68  -  91.85 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 150  and name N   )
       ( resid 150  and name HN  )  -18.1667  0.2000

! A151:  97.53  -  92.68 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 151  and name N   )
       ( resid 151  and name HN  )  4.8551  0.2000

! I152:  90.25  -  92.20 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 152  and name N   )
       ( resid 152  and name HN  )  -1.9527  0.2000

! Q153:  ***    -  ***   

! D154:  91.49  -  92.04 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 154  and name N   )
       ( resid 154  and name HN  )  -0.5471  0.2000

! E155:  80.01  -  91.50 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 155  and name N   )
       ( resid 155  and name HN  )  -11.4957  0.2000

! V156:  90.92  -  92.25 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 156  and name N   )
       ( resid 156  and name HN  )  -1.3220  0.2000

! I157:  97.22  -  90.65 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 157  and name N   )
       ( resid 157  and name HN  )  6.5722  0.2000

! L158: 102.39  -  92.26 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 158  and name N   )
       ( resid 158  and name HN  )  10.1281  0.2000

! V159: 101.11  -  92.53 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 159  and name N   )
       ( resid 159  and name HN  )  8.5781  0.2000

! A160:  95.28  -  91.97 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 160  and name N   )
       ( resid 160  and name HN  )  3.3051  0.2000

! A161:  92.65  -  92.61 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 161  and name N   )
       ( resid 161  and name HN  )  0.0380  0.2000

! D162:  98.70  -  91.90 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 162  and name N   )
       ( resid 162  and name HN  )  6.7926  0.2000

! L163:  95.98  -  92.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 163  and name N   )
       ( resid 163  and name HN  )  3.4115  0.2000

! T164:  ***    -  ***   

! P165:  ***    -  ***   

! S166: 102.79  -  92.93 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 166  and name N   )
       ( resid 166  and name HN  )  9.8621  0.2000

! E167:  ***    -  93.68 

! T168:  96.06  -  94.25 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 168  and name N   )
       ( resid 168  and name HN  )  1.8083  0.2000

! A169:  ***    -  ***   

! Q170: 114.62  -  ***   

! L171: 100.10  -  94.14 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 171  and name N   )
       ( resid 171  and name HN  )  5.9644  0.2000

! N172:  ***    -  ***   

! L173:  86.66  -  91.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 173  and name N   )
       ( resid 173  and name HN  )  -4.9083  0.2000

! K174:  82.82  -  91.62 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 174  and name N   )
       ( resid 174  and name HN  )  -8.7984  0.2000

! K175:  63.04  -  91.05 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 175  and name N   )
       ( resid 175  and name HN  )  -28.0136  0.2000

! V176:  99.62  -  92.98 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 176  and name N   )
       ( resid 176  and name HN  )  6.6406  0.2000

! L177: 101.74  -  89.90 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 177  and name N   )
       ( resid 177  and name HN  )  11.8376  0.2000

! G178:  84.70  -  91.68 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 178  and name N   )
       ( resid 178  and name HN  )  -6.9749  0.2000

! F179:  92.32  -  90.77 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 179  and name N   )
       ( resid 179  and name HN  )  1.5576  0.2000

! I180:  96.44  -  93.35 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 180  and name N   )
       ( resid 180  and name HN  )  3.0924  0.2000

! T181:  96.84  -  93.45 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 181  and name N   )
       ( resid 181  and name HN  )  3.3887  0.2000

! D182:  93.36  -  93.55 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 182  and name N   )
       ( resid 182  and name HN  )  -0.1824  0.2000

! A183: 104.95  -  93.18 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 183  and name N   )
       ( resid 183  and name HN  )  11.7692  0.2000

! G184:  90.13  -  94.53 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 184  and name N   )
       ( resid 184  and name HN  )  -4.3992  0.2000

! G185:  89.37  -  92.09 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 185  and name N   )
       ( resid 185  and name HN  )  -2.7277  0.2000

! R186:  ***    -  ***   

! T187:  ***    -  ***   

! S188:  ***    -  ***   

! H189:  83.88  -  92.13 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 189  and name N   )
       ( resid 189  and name HN  )  -8.2514  0.2000

! T190: 101.14  -  94.17 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 190  and name N   )
       ( resid 190  and name HN  )  6.9749  0.2000

! S191:  ***    -  ***   

! I192:  ***    -  ***   

! M193:  98.34  -  93.67 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 193  and name N   )
       ( resid 193  and name HN  )  4.6727  0.2000

! A194: 104.23  -  95.07 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 194  and name N   )
       ( resid 194  and name HN  )  9.1631  0.2000

! R195:  86.56  -  94.30 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 195  and name N   )
       ( resid 195  and name HN  )  -7.7423  0.2000

! S196:  85.23  -  94.27 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 196  and name N   )
       ( resid 196  and name HN  )  -9.0340  0.2000

! L197: 107.62  -  94.02 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 197  and name N   )
       ( resid 197  and name HN  )  13.6079  0.2000

! E198:  87.32  -  92.92 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 198  and name N   )
       ( resid 198  and name HN  )  -5.5921  0.2000

! L199:  ***    -  ***   

! P200:  ***    -  ***   

! A201:  94.75  -  91.46 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 201  and name N   )
       ( resid 201  and name HN  )  3.2899  0.2000

! I202:  98.17  -  90.92 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 202  and name N   )
       ( resid 202  and name HN  )  7.2408  0.2000

! V203:  95.49  -  92.58 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 203  and name N   )
       ( resid 203  and name HN  )  2.9100  0.2000

! G204:  81.74  -  93.11 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 204  and name N   )
       ( resid 204  and name HN  )  -11.3741  0.2000

! T205: 109.04  -  92.46 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 205  and name N   )
       ( resid 205  and name HN  )  16.5787  0.2000

! G206:  97.39  -  94.67 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 206  and name N   )
       ( resid 206  and name HN  )  2.7201  0.2000

! S207:  75.27  -  87.30 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 207  and name N   )
       ( resid 207  and name HN  )  -12.0275  0.2000

! V208:  93.34  -  93.95 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 208  and name N   )
       ( resid 208  and name HN  )  -0.6078  0.2000

! T209:  86.08  -  92.13 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 209  and name N   )
       ( resid 209  and name HN  )  -6.0404  0.2000

! S210:  ***    -  92.24 

! Q211:  ***    -  98.51 

! V212:  68.86  -  91.41 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 212  and name N   )
       ( resid 212  and name HN  )  -22.5507  0.2000

! K213:  65.30  -  91.23 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 213  and name N   )
       ( resid 213  and name HN  )  -25.9242  0.2000

! N214:  84.39  -  ***   

! D215:  95.81  -  93.21 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 215  and name N   )
       ( resid 215  and name HN  )  2.5985  0.2000

! D216:  ***    -  93.30 

! Y217:  99.74  -  93.49 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 217  and name N   )
       ( resid 217  and name HN  )  6.2531  0.2000

! L218:  ***    -  ***   

! I219: 112.78  -  92.32 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 219  and name N   )
       ( resid 219  and name HN  )  20.4689  0.2000

! L220: 113.99  -  93.87 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 220  and name N   )
       ( resid 220  and name HN  )  20.1270  0.2000

! D221: 113.72  -  95.48 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 221  and name N   )
       ( resid 221  and name HN  )  18.2427  0.2000

! A222: 111.75  -  94.22 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 222  and name N   )
       ( resid 222  and name HN  )  17.5285  0.2000

! V223:  ***    -  89.88 

! N224:  97.09  -  90.63 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 224  and name N   )
       ( resid 224  and name HN  )  6.4659  0.2000

! N225:  ***    -  ***   

! Q226:  ***    -  ***   

! V227:  ***    -  92.45 

! Y228: 115.56  -  94.40 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 228  and name N   )
       ( resid 228  and name HN  )  21.1603  0.2000

! V229: 109.07  -  94.43 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 229  and name N   )
       ( resid 229  and name HN  )  14.6336  0.2000

! N230:  98.58  -  93.92 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 230  and name N   )
       ( resid 230  and name HN  )  4.6575  0.2000

! P231:  ***    -  ***   

! T232: 109.63  -  93.74 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 232  and name N   )
       ( resid 232  and name HN  )  15.8949  0.2000

! N233:  97.95  -  ***   

! E234:  ***    -  ***   

! V235: 100.37  -  92.26 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 235  and name N   )
       ( resid 235  and name HN  )  8.1070  0.2000

! I236: 100.04  -  93.76 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 236  and name N   )
       ( resid 236  and name HN  )  6.2835  0.2000

! D237:  ***    -  ***   

! K238:  ***    -  ***   

! M239: 102.95  -  93.81 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 239  and name N   )
       ( resid 239  and name HN  )  9.1403  0.2000

! R240:  96.69  -  94.63 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 240  and name N   )
       ( resid 240  and name HN  )  2.0590  0.2000




HPR: Da(NH) = -16.3 Hz, Rhombicity = 0.4



!
! F302: 108.32  -  96.50 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 302  and name N   )
       ( resid 302  and name HN  )  11.8148  0.2000

! Q303: 105.06  -  94.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 303  and name N   )
       ( resid 303  and name HN  )  10.2724  0.2000

! Q304: 110.54  -  94.40 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 304  and name N   )
       ( resid 304  and name HN  )  16.1380  0.2000

! E305: 107.40  -  92.11 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 305  and name N   )
       ( resid 305  and name HN  )  15.2947  0.2000

! V306: 111.81  -  92.60 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 306  and name N   )
       ( resid 306  and name HN  )  19.2076  0.2000

! T307: 110.27  -  93.62 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 307  and name N   )
       ( resid 307  and name HN  )  16.6471  0.2000

! I308:  97.98  -  94.77 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 308  and name N   )
       ( resid 308  and name HN  )  3.2139  0.2000

! T309:  92.86  -  93.27 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 309  and name N   )
       ( resid 309  and name HN  )  -0.4103  0.2000

! A310:  76.37  -  92.11 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 310  and name N   )
       ( resid 310  and name HN  )  -15.7353  0.2000

! N312:  97.44  -  93.37 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 312  and name N   )
       ( resid 312  and name HN  )  4.0649  0.2000

! G313: 113.52  -  94.08 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 313  and name N   )
       ( resid 313  and name HN  )  19.4431  0.2000

! L314:  90.46  -  92.88 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 314  and name N   )
       ( resid 314  and name HN  )  -2.4237  0.2000

! H315: 102.56  -  91.06 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 315  and name N   )
       ( resid 315  and name HN  )  11.5033  0.2000

! T316:  82.83  -  91.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 316  and name N   )
       ( resid 316  and name HN  )  -8.8668  0.2000

! R317:  77.45  -  91.86 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 317  and name N   )
       ( resid 317  and name HN  )  -14.4133  0.2000

! A319:  79.89  -  93.60 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 319  and name N   )
       ( resid 319  and name HN  )  -13.7067  0.2000

! A320:  71.30  -  93.03 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 320  and name N   )
       ( resid 320  and name HN  )  -21.7301  0.2000

! Q321:  78.59  -  92.95 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 321  and name N   )
       ( resid 321  and name HN  )  -14.3525  0.2000

! F322:  80.55  -  93.11 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 322  and name N   )
       ( resid 322  and name HN  )  -12.5518  0.2000

! V323:  74.69  -  91.37 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 323  and name N   )
       ( resid 323  and name HN  )  -16.6775  0.2000

! K324:  71.43  -  93.86 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 324  and name N   )
       ( resid 324  and name HN  )  -22.4291  0.2000

! E325:  82.24  -  94.41 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 325  and name N   )
       ( resid 325  and name HN  )  -12.1719  0.2000

! A326:  80.77  -  93.16 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 326  and name N   )
       ( resid 326  and name HN  )  -12.3847  0.2000

! K327:  69.87  -  92.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 327  and name N   )
       ( resid 327  and name HN  )  -22.8166  0.2000

! G328:  88.15  -  94.17 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 328  and name N   )
       ( resid 328  and name HN  )  -6.0176  0.2000

! T330: 110.07  -  93.12 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 330  and name N   )
       ( resid 330  and name HN  )  16.9510  0.2000

! S331: 106.04  -  94.29 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 331  and name N   )
       ( resid 331  and name HN  )  11.7464  0.2000

! E332:  ***    -  ***   

! I333: 106.36  -  93.08 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 333  and name N   )
       ( resid 333  and name HN  )  13.2812  0.2000

! T334: 107.21  -  93.23 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 334  and name N   )
       ( resid 334  and name HN  )  13.9726  0.2000

! V335: 113.95  -  91.81 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 335  and name N   )
       ( resid 335  and name HN  )  22.1480  0.2000

! T336: 113.02  -  92.43 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 336  and name N   )
       ( resid 336  and name HN  )  20.5904  0.2000

! S337: 112.26  -  94.75 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 337  and name N   )
       ( resid 337  and name HN  )  17.5057  0.2000

! N338: 118.85  -  94.99 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 338  and name N   )
       ( resid 338  and name HN  )  23.8651  0.2000

! G339: 108.53  -  94.61 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 339  and name N   )
       ( resid 339  and name HN  )  13.9194  0.2000

! K340:  90.01  -  92.06 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 340  and name N   )
       ( resid 340  and name HN  )  -2.0438  0.2000

! S341: 101.76  -  91.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 341  and name N   )
       ( resid 341  and name HN  )  9.9837  0.2000

! A342: 113.91  -  93.48 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 342  and name N   )
       ( resid 342  and name HN  )  20.4309  0.2000

! S343: 113.89  -  92.64 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 343  and name N   )
       ( resid 343  and name HN  )  21.2439  0.2000

! A344:  77.07  -  92.04 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 344  and name N   )
       ( resid 344  and name HN  )  -14.9680  0.2000

! K345:  74.32  -  91.71 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 345  and name N   )
       ( resid 345  and name HN  )  -17.3993  0.2000

! S346: 107.62  -  93.98 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 346  and name N   )
       ( resid 346  and name HN  )  13.6383  0.2000

! L347: 102.84  -  93.36 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 347  and name N   )
       ( resid 347  and name HN  )  9.4746  0.2000

! F348:  91.54  -  92.78 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 348  and name N   )
       ( resid 348  and name HN  )  -1.2385  0.2000

! K349:  92.03  -  92.67 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 349  and name N   )
       ( resid 349  and name HN  )  -0.6458  0.2000

! L350: 100.33  -  94.34 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 350  and name N   )
       ( resid 350  and name HN  )  5.9872  0.2000

! Q351: 103.26  -  93.96 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 351  and name N   )
       ( resid 351  and name HN  )  9.2923  0.2000

! T352:  80.54  -  91.68 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 352  and name N   )
       ( resid 352  and name HN  )  -11.1462  0.2000

! L353:  ***    -  ***   

! G354:  94.67  -  95.39 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 354  and name N   )
       ( resid 354  and name HN  )  -0.7218  0.2000

! L355:  97.23  -  93.40 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 355  and name N   )
       ( resid 355  and name HN  )  3.8294  0.2000

! T356:  87.82  -  92.79 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 356  and name N   )
       ( resid 356  and name HN  )  -4.9615  0.2000

! Q357:  81.14  -  91.99 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 357  and name N   )
       ( resid 357  and name HN  )  -10.8499  0.2000

! G358:  97.53  -  93.49 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 358  and name N   )
       ( resid 358  and name HN  )  4.0345  0.2000

! T359:  89.01  -  93.03 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 359  and name N   )
       ( resid 359  and name HN  )  -4.0193  0.2000

! V360:  98.46  -  93.68 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 360  and name N   )
       ( resid 360  and name HN  )  4.7867  0.2000

! V361: 103.86  -  92.68 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 361  and name N   )
       ( resid 361  and name HN  )  11.1842  0.2000

! T362: 111.67  -  91.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 362  and name N   )
       ( resid 362  and name HN  )  20.1042  0.2000

! I363: 115.24  -  93.57 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 363  and name N   )
       ( resid 363  and name HN  )  21.6693  0.2000

! S364: 109.13  -  94.69 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 364  and name N   )
       ( resid 364  and name HN  )  14.4361  0.2000

! A365: 108.81  -  94.71 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 365  and name N   )
       ( resid 365  and name HN  )  14.1018  0.2000

! E366: 100.56  -  91.65 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 366  and name N   )
       ( resid 366  and name HN  )  8.9048  0.2000

! G367: 112.35  -  94.48 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 367  and name N   )
       ( resid 367  and name HN  )  17.8704  0.2000

! E368: 112.84  -  92.22 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 368  and name N   )
       ( resid 368  and name HN  )  20.6208  0.2000

! D369: 111.86  -  91.59 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 369  and name N   )
       ( resid 369  and name HN  )  20.2637  0.2000

! E370:  71.29  -  89.65 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 370  and name N   )
       ( resid 370  and name HN  )  -18.3566  0.2000

! Q371:  77.97  -  92.54 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 371  and name N   )
       ( resid 371  and name HN  )  -14.5653  0.2000

! K372:  78.09  -  91.59 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 372  and name N   )
       ( resid 372  and name HN  )  -13.4940  0.2000

! A373:  71.31  -  92.01 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 373  and name N   )
       ( resid 373  and name HN  )  -20.7044  0.2000

! V374:  70.91  -  93.33 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 374  and name N   )
       ( resid 374  and name HN  )  -22.4139  0.2000

! E375:  74.68  -  93.43 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 375  and name N   )
       ( resid 375  and name HN  )  -18.7517  0.2000

! H376:  76.72  -  92.94 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 376  and name N   )
       ( resid 376  and name HN  )  -16.2140  0.2000

! L377:  63.00  -  92.54 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 377  and name N   )
       ( resid 377  and name HN  )  -29.5408  0.2000

! V378:  72.48  -  93.28 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 378  and name N   )
       ( resid 378  and name HN  )  -20.8032  0.2000

! K379:  76.98  -  92.22 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 379  and name N   )
       ( resid 379  and name HN  )  -15.2339  0.2000

! L380:  73.08  -  92.86 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 380  and name N   )
       ( resid 380  and name HN  )  -19.7775  0.2000

! M381:  70.22  -  93.08 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 381  and name N   )
       ( resid 381  and name HN  )  -22.8622  0.2000

! A382:  78.21  -  92.80 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 382  and name N   )
       ( resid 382  and name HN  )  -14.5881  0.2000

! E383:  83.10  -  91.37 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 383  and name N   )
       ( resid 383  and name HN  )  -8.2666  0.2000

! L384:  77.51  -  93.58 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 384  and name N   )
       ( resid 384  and name HN  )  -16.0621  0.2000

! E385:  99.97  -  91.66 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 385  and name N   )
       ( resid 385  and name HN  )  8.3046  0.2000







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