*HEADER    TOXIN                                   13-MAY-16   5JYH              
*TITLE     SOLUTION STRUCTURE OF HGE36: SCORPINE-LIKE PEPTIDE FROM HADRURUS      
*TITLE    2 GERTSCHI                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HGE-SCORPINE;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: HG-SCORPINE-LIKE 1,HGSCPLIKE1;                              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HADRURUS GERTSCHI;                              
*SOURCE   3 ORGANISM_COMMON: SCORPION;                                           
*SOURCE   4 ORGANISM_TAXID: 380989;                                              
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    SCORPINE-LIKE PEPTIDE, HADRURUS GERTSCHI, ANTIPARASITIC ACTIVITY,     
*KEYWDS   2 TOXIN                                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    D.FLORES-SOLIS,R.RODRIGUEZ DE LA VEGA,F.DEL RIO-PORTILLA              
*REVDAT   1   29-JUN-16 5JYH    0                                                
# Restraints file 1: final_minim.restrt
    
12365
  27.4944154  20.5220034  36.9239785  27.6542005  19.7042435  37.4996512
  27.7810046  21.3409278  37.4439955  28.0750421  20.4508544  36.0968296
  26.0692329  20.6197595  36.5469690  25.4675075  20.6102322  37.4548235
  25.8084529  21.9313817  35.7895008  24.7843144  21.9638097  35.4304636
  25.9593826  22.7831231  36.4488519  26.4823281  22.0142861  34.9350173
  25.6665447  19.4171850  35.6933396  26.3574746  19.1430517  34.7162522
  24.5615598  18.7182108  36.0157226  24.0110693  19.0146775  36.8158132
  24.1083780  17.5153771  35.2768584  24.4265821  17.6220178  34.2386222
  24.8155209  16.2566625  35.8252091  24.6115587  15.4260930  35.1468313
  25.8918125  16.4314606  35.8067431  24.3869275  15.8422484  37.2471341
  24.5839447  16.6588362  37.9441141  23.3116159  15.6562662  37.2550014
  25.1024300  14.5662620  37.7357940  24.6720667  14.2811514  38.6944662
  24.9318309  13.7526711  37.0280278  26.6076525  14.7786375  37.9312198
  27.0776240  14.9699675  36.9619465  26.7416245  15.6679623  38.5499579
  27.2666812  13.6237031  38.5897194  27.2795023  12.7925867  38.0068909
  28.2341592  13.8481830  38.8008781  26.8104568  13.3633884  39.4642859
  22.5884681  17.3097728  35.1937596  22.1359827  16.5259266  34.3597950
  21.7873279  18.0108928  36.0054107  22.2059140  18.5681074  36.7382861
  20.3214351  17.9473579  35.9087995  20.0532863  16.9077821  35.7034944
  19.6658918  18.3051330  37.2515432  18.6662155  17.8826729  37.2407721
  20.2349555  17.8362332  38.0475904  19.5012534  19.7781258  37.5750238
  18.4991561  20.4022061  37.2493154  20.4603954  20.3634199  38.2437876
  20.3423837  21.3367172  38.5129585  21.2707974  19.8207859  38.5199255
  19.7656009  18.7719021  34.7392785  18.8341637  18.3303524  34.0633482
  20.3688544  19.9362687  34.4815567  21.0579006  20.2606777  35.1617688
  20.0659254  20.7716394  33.3074310  19.5985911  20.1374398  32.5539290
  19.0315484  21.8473390  33.6767723  18.7049208  22.3393903  32.7611525
  18.1601482  21.3625981  34.1143947  19.5432328  22.9220681  34.6453922
  19.8760002  22.4573659  35.5738812  20.3765391  23.4569002  34.1934160
  18.4443642  23.9245781  34.9629438  17.8728160  23.9339132  36.0463825
  18.0699643  24.7634584  34.0250866  18.4499894  24.6871992  33.0843631
  17.2815185  25.3635194  34.2272464  21.2963756  21.3765627  32.6098694
  21.1448973  22.0747328  31.6114050  22.5132538  21.1276785  33.1113888
  22.5746723  20.5628802  33.9453200  23.7709429  21.6694073  32.5664600
  24.5696446  21.3781788  33.2464015  24.0913699  21.0072398  31.2154765
  23.3730411  21.3579806  30.4759480  25.0730021  21.3469698  30.8892957
  24.0835458  19.4902242  31.2265971  25.2196665  18.7819952  31.6591273
  26.1009107  19.3133701  31.9910786  25.2104629  17.3765818  31.6724274
  26.0818965  16.8363197  32.0150507  24.0686831  16.6750305  31.2488575
  24.0641513  15.5934443  31.2583501  22.9312091  17.3786180  30.8162414
  22.0567888  16.8304047  30.4934496  22.9375221  18.7852953  30.8085019
  22.0620379  19.3269054  30.4846627  23.8159618  23.2126924  32.4993559
  24.5259811  23.7779707  31.6738374  23.0194647  23.9018779  33.3274114
  22.4641946  23.3820869  34.0015487  22.8568578  25.3666675  33.2836077
  22.4145652  25.7055033  34.2194304  23.8410861  25.8249266  33.1870580
  21.9845737  25.8884853  32.1287769  21.6481212  27.0747262  32.0982629
  21.5689991  25.0073883  31.2173290  21.8231601  24.0365134  31.3359144
  20.7558629  25.3284529  30.0544682  21.0947536  26.2775295  29.6384516
  20.9467742  24.2344413  28.9963506  20.5987081  23.2878136  29.4044440
  20.3020225  24.4564398  28.1468657  22.6353577  23.9902305  28.3866749
  19.2673512  25.4422811  30.4066902  18.7393221  24.6741292  31.2170161
  18.5736207  26.3715153  29.7536078  19.0839400  27.0160412  29.1519874
  17.1101398  26.4628913  29.7681482  16.7005565  25.4555552  29.8228158
  16.6332694  27.2373476  31.0066158  17.0593130  26.7790396  31.8999820
  17.0081276  28.2539353  30.9551792  15.1273518  27.2882418  31.1673545
  14.3924539  28.3572640  30.6200627  14.9009418  29.1533527  30.0907211
  12.9940968  28.3954052  30.7628128  12.4281096  29.2120023  30.3335591
  12.3285829  27.3724701  31.4604779  11.2525688  27.4026740  31.5690612
  13.0613611  26.3107517  32.0176208  12.5470445  25.5270978  32.5574721
  14.4587433  26.2673833  31.8680919  15.0189184  25.4484307  32.2964976
  16.6143676  27.0976809  28.4625092  17.2651553  27.9927007  27.9282467
  15.4793008  26.6301845  27.9298633  14.9976816  25.8912095  28.4150215
  14.8535928  27.1482164  26.7084135  14.1127411  26.4093450  26.3990902
  14.0801725  28.4281324  27.0510276  14.7680656  29.2116495  27.3726746
  13.5362278  28.7778748  26.1742300  13.3648881  28.2226824  27.8470241
  15.8130700  27.2967223  25.5001273  15.6847949  28.2320283  24.7128996
  16.7563346  26.3607040  25.3314021  16.8144120  25.6464417  26.0500774
  17.8135303  26.3681076  24.2972998  18.3349594  25.4177841  24.4034292
  17.2115042  26.3679011  22.8640814  16.7119753  27.3118784  22.6597861
  18.0088466  26.2789953  22.1357915  16.2522369  25.2330584  22.5944031
  16.6528421  24.1296964  22.2549328  14.9753429  25.4416435  22.7978982
  14.6455648  26.3767900  22.9780771  14.3489180  24.6471293  22.7511515
  18.9314878  27.4225981  24.4922500  19.6892921  27.6792921  23.5535999
  19.0731542  28.0203753  25.6860031  18.4069587  27.8001732  26.4199424
  20.0051174  29.1300164  25.9741245  20.7160264  29.2149393  25.1529525
  19.2323807  30.4705774  26.0633245  18.5596656  30.4355010  26.9234818
  20.1664972  31.6793985  26.2199687  20.6839001  31.6432687  27.1758323
  20.8967862  31.7028777  25.4102567  19.5876180  32.6033456  26.2016705
  18.3976208  30.7414218  24.8008441  19.0305635  30.7135672  23.9135632
  17.6108109  29.9979434  24.7056722  17.9144808  31.7164345  24.8717608
  20.8253082  28.8896514  27.2542716  20.3436713  28.3050272  28.2247395
  22.0592051  29.4017892  27.2766390  22.4122945  29.7804241  26.4084266
  23.0012586  29.4231898  28.4131968  22.9795063  28.4408804  28.8917779
  24.4294957  29.7001914  27.8906856  24.4520576  30.6949205  27.4421880
  25.1153319  29.7098261  28.7396739  24.9718589  28.7067721  26.8630228
  26.0814540  28.1649334  27.0888661  24.3697230  28.5446461  25.7755069
  22.6217210  30.4653251  29.4993867  23.4630221  31.2315900  29.9874210
  21.3344616  30.5723160  29.8485843  20.6827051  29.9174599  29.4275304
  20.8154671  31.6117663  30.7619838  21.1993953  32.5755207  30.4269252
  19.2723143  31.7032900  30.7559600  18.9447607  32.0982796  31.7186201
  18.7895676  32.6823069  29.6849417  19.0615413  32.3215185  28.6969593
  17.7043560  32.7764438  29.7368474  19.2335933  33.6638357  29.8477067
  18.5683462  30.3597336  30.5327727  18.9328651  29.6090326  31.2324788
  17.4973529  30.4922030  30.6878420  18.7226092  30.0081014  29.5118698
  21.3198469  31.4397991  32.1959105  21.8552464  32.3903014  32.7765488
  21.1821696  30.2380116  32.7706425  20.7368280  29.4965650  32.2426825
  21.5271434  29.9630576  34.1769383  21.4171677  30.8840029  34.7509323
  20.5249019  28.9695369  34.7808271  20.6844953  27.9704753  34.3745162
  20.7044877  28.9267348  35.8543011  19.0735694  29.4033155  34.5026838
  18.9919082  30.4908054  34.5460037  18.8011056  29.0806342  33.4969298
  18.0658264  28.8058668  35.4808247  17.0721198  28.9950438  35.0799678
  18.2320717  27.7317837  35.5523853  18.2027356  29.4713167  36.8559067
  19.1471749  29.1605678  37.3107139  18.2403269  30.5558454  36.7141937
  17.0806947  29.1392391  37.7609672  17.2151921  29.5905998  38.6637597
  16.1897502  29.4303823  37.3628639  17.0238700  28.1403600  37.9381466
  22.9791652  29.5132577  34.3652227  23.5277203  29.6609578  35.4563567
  23.6156052  28.9966895  33.3153291  23.0818985  28.8310489  32.4703433
  25.0307938  28.6304982  33.2819328  25.6376517  29.5136988  33.4796763
  25.2346405  27.8887835  34.0535421  25.4594482  28.0474342  31.9343520
  24.6681388  27.9724119  30.9960793  26.7220421  27.6317868  31.8565951
  27.3034566  27.7558133  32.6755507  27.3176946  26.9752172  30.6898862
  26.7417791  27.2604430  29.8069553  28.7632937  27.4650212  30.4724202
  29.0586108  27.2180183  29.4510948  28.7984487  28.5516817  30.5672233
  29.7783738  26.8282788  31.4343337  30.4793653  25.8702382  31.0496486
  29.9174030  27.3135661  32.5868497  27.2921099  25.4439304  30.7912903
  27.4165515  24.8733664  31.8778422  27.2366603  24.7824910  29.6379937
  27.1289728  25.3204725  28.7833875  27.4633196  23.3455255  29.4993357
  27.3167318  22.8518267  30.4610539  26.4259824  22.7932471  28.5234136
  25.4301527  22.9693150  28.9334993  26.5060118  23.3356047  27.5801366
  26.6157524  21.0274876  28.1840938  28.9056464  23.0451945  29.0385527
  29.3660399  21.9015414  29.1084290  29.6611930  24.0607619  28.5915727
  29.2551051  24.9869365  28.5729177  31.0301982  23.9012910  28.0895871
  30.9862118  23.2629058  27.2063647  31.5830839  25.2702292  27.6545627
  30.8243949  25.7538558  27.0396038  31.7648446  25.9062646  28.5227149
  32.8539731  25.1374157  26.7949425  32.8632404  24.1543046  26.3239035
  32.8100889  25.8728419  25.9906376  34.1708246  25.3315108  27.5614751
  34.1112102  24.8292722  28.5271405  34.9734664  24.8818092  26.9749910
  34.4627815  26.8266733  27.7466515  34.3396892  27.3223116  26.7788652
  33.7253968  27.2550752  28.4303709  35.8354362  27.0865446  28.2459625
  35.9952875  26.6910068  29.1674574  36.5477886  26.7150517  27.6208144
  36.0066763  28.0885769  28.3217598  31.9298276  23.1755372  29.0901800
  32.7010637  22.3261633  28.6665409  31.7810627  23.3823904  30.4028970
  31.1499145  24.1315521  30.6918028  32.5272086  22.6238240  31.4306761
  33.5860167  22.6737810  31.1699873  32.3017333  23.2696427  32.8134012
  31.4466969  23.9455483  32.7836539  32.0802288  22.4947725  33.5504490
  33.5306902  24.0418319  33.3059474  33.3149627  24.4648236  34.2858654
  34.3550266  23.3387355  33.4260123  33.9996962  25.1632771  32.3736987
  34.9399552  25.5237004  32.7897807  34.2011910  24.7681801  31.3777716
  33.0423710  26.2818036  32.2792647  32.0527477  26.0669155  32.1624190
  33.3587070  27.5619092  32.3245260  34.5815646  27.9856923  32.2012066
  35.3095032  27.3269979  31.9545844  34.7554261  28.9755603  32.2738661
  32.4487095  28.4711285  32.4810487  31.4907215  28.1653157  32.6425635
  32.7325439  29.4189236  32.6686400  32.2490408  21.1144119  31.4676607
  33.1726255  20.3606811  31.7743395  31.0490537  20.6560850  31.1046022
  30.3474664  21.3318161  30.8270801  30.7363714  19.2237549  30.9516601
  31.1881947  18.6655057  31.7759558  29.2110190  19.0187819  31.0332373
  28.8947742  19.1457459  32.0693207  28.7118907  19.7885386  30.4452506
  28.7144107  17.6780622  30.5403540  28.8357223  16.4492746  31.2024445
  28.1911890  15.5561939  30.4278628  28.0712057  14.5061765  30.6619902
  27.7170371  16.1447548  29.3187160  27.1907039  15.6811498  28.5869743
  28.0305348  17.4827889  29.3755228  27.7607896  18.2445108  28.6558188
  31.3325597  18.6491262  29.6573298  31.9313572  17.5726211  29.6858840
  31.2339929  19.3654360  28.5328268  30.7202843  20.2397199  28.5569480
  31.7345554  18.8714142  27.2425161  31.5562220  17.7954559  27.1997940
  30.9084929  19.4915156  26.1140291  30.9398871  20.5767614  26.2111185
  31.3591498  19.2396715  25.1549673  29.1724874  18.9501493  26.0931948
  33.2559847  19.0494706  27.0549279  33.8872681  18.2091866  26.4189971
  33.8990540  20.0389227  27.6907716  33.3389564  20.7380882  28.1701076
  35.3658385  20.2258610  27.6874864  35.6893415  20.3104890  26.6430676
  35.6927511  21.5425158  28.4245712  35.1464066  22.3595793  27.9532009
  35.3255054  21.4541483  29.4490817  37.1760852  21.9525553  28.5050588
  37.2422743  22.7520022  29.2450116  37.7702504  21.1223355  28.8813770
  37.7915745  22.4900058  27.2001291  37.1075453  23.2137552  26.7554746
  38.7017686  23.0335921  27.4583934  38.1195982  21.4017239  26.1660259
  37.7273087  20.4477292  26.5225506  37.6148277  21.6598229  25.2294754
  39.5794653  21.2703641  25.9393938  39.7836555  20.5033845  25.2934283
  39.9661334  22.1372599  25.5661214  40.0577107  21.0941063  26.8220191
  36.0931080  19.0346006  28.3336770  37.1781342  18.6636759  27.8883538
  35.4707382  18.3720426  29.3130184  34.5901083  18.7352869  29.6453816
  35.9611941  17.1189142  29.9036214  37.0041837  17.2561183  30.1965922
  35.1407393  16.8543581  31.1692924  34.0915629  16.7156921  30.9107087
  35.5053130  15.9532966  31.6637621  35.2337949  17.6961014  31.8568798
  35.9114864  15.9178197  28.9277019  36.6214457  14.9261760  29.1058113
  35.1127329  16.0212905  27.8629429  34.5493765  16.8570736  27.7764007
  35.0647896  15.1130889  26.7065107  35.4881977  14.1476905  26.9836011
  33.5944419  14.8834289  26.2874663  33.2307853  15.8031269  25.8303384
  33.5544330  14.1150861  25.5178065  32.5991516  14.5082385  27.4007705
  32.7389964  15.1518096  28.2717829  31.5943881  14.7179004  27.0242574
  32.6491848  13.0364064  27.8301602  31.6926117  12.2846966  27.5180706
  33.5705215  12.6224673  28.5759058  35.9087027  15.6675187  25.5247864
  35.8876999  15.1175331  24.4269887  36.6406033  16.7722810  25.7341767
  36.6487109  17.1381390  26.6739978  37.3446173  17.5943192  24.7268320
  37.6275681  18.5058492  25.2495449  38.6698378  16.9241728  24.2992691
  39.1279296  16.4587123  25.1708837  38.4566594  16.1456501  23.5708812
  39.6971272  17.9068485  23.7130233  40.4375557  17.5099735  22.7764446
  39.8531671  19.0345799  24.2444064  36.4530500  18.0897162  23.5687272
  36.9114993  18.2431233  22.4371985  35.1690589  18.3469570  23.8581325
  34.8754081  18.2043122  24.8207488  34.1030083  18.7027128  22.9068198
  34.5040116  18.7415097  21.9015192  33.0023089  17.6293830  22.9438633
  32.5948478  17.5624550  23.9518645  32.1907861  17.9486864  22.2861657
  33.4968072  16.2388676  22.5164421  34.4999321  16.2998164  22.0994272
  33.5147145  15.5823197  23.3872167  32.5637139  15.6525649  21.4578358
  31.5519567  15.5622252  21.8511375  32.5454245  16.3537136  20.6209189
  33.0623723  14.3046836  20.9297667  32.4268597  14.0238403  20.0848186
  34.0797534  14.4314746  20.5529766  33.0338930  13.2137736  21.9369446
  33.2699322  12.3383578  21.4807502  33.7184988  13.3359862  22.6797378
  32.1178876  13.1331716  22.3787551  33.4776086  20.0694765  23.1615353
  33.5658587  20.6170390  24.2616415  32.8042973  20.6033334  22.1466033
  32.7285641  20.0736842  21.2799612  31.9354774  21.7636721  22.3155317
  32.4539235  22.5215342  22.8999263  31.5313322  22.3815238  20.9642781
  31.1510842  21.6065747  20.2973836  30.7204241  23.0766229  21.1639684
  32.6581311  23.1588287  20.2669872  33.2400512  23.6968427  21.0167695
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 -22.4581810  28.0551613  21.9901345 -21.0353873 -10.8287758  10.3661410
 -20.7542574 -11.0724060   9.4521445 -21.7443524 -11.4998607  10.5017461
   6.4425064  13.3824374  49.2852490   7.0347132  14.0884662  49.6349632
   5.7628092  13.9190480  48.8466331  12.7247557   8.2868075 -10.2700088
  12.8905291   8.7893076  -9.4393044  13.5645884   8.4627155 -10.7463149
  21.4076078 -14.4785042   7.9456317  21.3123110 -15.3935225   8.2945668
  20.6277416 -14.0595660   8.3834404   0.6897098  13.0108902  14.5330561
   0.2072736  13.5699712  15.1882398  -0.0685776  12.4594407  14.2168132
   1.8666592  -1.2632809  35.0231498   1.2056071  -1.9935908  35.0883452
   2.6582000  -1.7326887  35.3624614  14.7948407 -24.9249931   8.7033606
  14.5961829 -25.4886385   7.9171972  15.4032760 -24.2787811   8.2992052
   8.5747202  -4.7467822 -37.2053731   9.0996252  -4.0619921 -36.7314265
   8.9956469  -4.6991732 -38.0906351   1.0255687  51.9998738  10.4872112
   1.7436370  51.9120265  11.1722976   1.5938611  51.9038751   9.6812295
  15.8932978   8.4395174  47.0602988  15.8675648   7.7835279  46.3184718
  15.0673898   8.1690850  47.5300238   5.8087867  44.4004907  23.5660007
   5.8966180  43.5764734  23.0237525   6.1845300  44.0574402  24.4137193
   3.0427058  10.2300528  61.9704193   3.6215186  11.0072471  61.8048991
   3.2338067  10.0833044  62.9249158   4.4654219  27.7362051 -22.1221325
   4.5373121  27.5957219 -23.0815520   3.6149076  27.2660435 -21.9413042
   5.5488069  -7.1536829  -7.6565840   5.7883692  -6.4287939  -8.2867422
   5.2613633  -6.6057373  -6.8919198  14.6410446  25.1141405  13.2753899
  14.1310771  25.6322766  12.5983506  15.2997211  25.8111647  13.5210542
  27.7544299  -9.9069035 -21.1360512  27.4518380  -9.2549997 -21.7904971
  27.8757678 -10.6961949 -21.7142926  -9.4120656  19.5246863  22.0582519
  -8.7922354  20.2984786  22.1047513  -9.4227473  19.2835520  23.0105482
  10.1817118  -8.9689405   8.6456319  10.4367152  -9.6942143   8.0323687
   9.7329927  -8.3683320   8.0034074  -3.5203625  -6.0185570 -10.6679656
  -2.6285872  -5.6470412 -10.4607109  -3.4186731  -6.9084986 -10.2491844
   1.7857256  12.5403532   2.3558661   2.2299030  13.3170246   1.9442601
   0.8500658  12.7775902   2.1732163   3.4700385 -26.6927422 -16.9979066
   2.5241645 -26.5823243 -16.7221642   3.4230776 -27.6256978 -17.3154820
  46.9080557  41.9104822  39.9615892  46.0582271  42.3795114  39.9295051
  47.4040376  42.3500965  39.2477482  22.4985321  21.1498143 -13.6123162
  22.4125199  22.1411910 -13.6792988  22.7110870  21.0998218 -12.6503191
  53.9636524  31.1587886   4.7902548  54.9383026  31.1889631   4.9027076
  53.7793056  32.1309179   4.7588896  33.5119279 -20.4909672  -0.4483475
  33.8487137 -20.4235224   0.4755697  33.8679956 -19.6414316  -0.8068597
  20.8632673   9.1823213  -7.7114907  20.8598837   8.9372801  -6.7640251
  21.3357795  10.0377229  -7.6803685  -0.0913067  16.6041912  -6.1377506
  -0.9671429  17.0306090  -6.2435735   0.3981586  17.3214884  -5.6822801
  51.7004537  42.1138367  22.3291011  51.6336409  43.0940575  22.4385163
  52.6657387  42.0115559  22.5261790  16.5242599  11.0296536  -3.0198643
  16.3583248  10.0579416  -2.8838071  15.6140730  11.2851131  -3.3120799
  19.1197248  22.8642134   2.1065477  18.3326437  23.4466818   2.0467975
  18.8115042  22.0942669   1.5887691 -26.9004881 -26.2289263 -11.2552762
 -27.4152898 -27.0678903 -11.2540400 -26.8507484 -26.0508965 -10.2950246
   0.8711194   2.2061481   0.9326956   0.9968397   2.6964943   1.7877959
   0.0223837   2.6292588   0.6539203   9.9272111  56.3630517  25.3488702
  10.0671511  55.9107120  24.4927746   9.7710865  55.5867612  25.9325627
  28.4368046   8.6999592  10.4130278  29.1004239   9.3985020  10.5783770
  27.6282773   9.1338993  10.7672575  47.3327016   9.1801103  14.4690167
  46.8723484   9.9505013  14.0556026  47.1282937   8.4897507  13.7976799
   9.1769905  34.9804487   2.7400876   9.6726265  35.6919771   2.2553940
   9.6577756  35.0360370   3.6023251  11.9829919   4.2488008  36.4788714
  11.4395341   3.8468746  35.7569623  11.3744498   4.0921241  37.2387723
  -6.0057835  13.6065046   0.8302019  -6.0748376  13.9343123  -0.0986507
  -6.3219277  14.4020895   1.3097380  34.7213678  38.8810724  -9.6175807
  35.5999627  38.4359870  -9.5716946  34.9113934  39.5384856 -10.3253851
  27.8055666 -17.2988746  11.6666945  28.4576000 -16.5693963  11.8128136
  28.1373503 -17.6314862  10.8000815  13.6860276  20.5101488  24.6532253
  14.0321244  20.2317586  25.5366335  12.7297034  20.2983276  24.7927728
  -0.3800063  26.0276127  -0.7571167  -0.5707101  25.3142756  -0.1017773
  -1.2028717  26.5603191  -0.6495050  12.0065336   0.0007434   2.1455159
  11.8479676  -0.1765088   1.1876594  11.8760240  -0.9085204   2.4985019
 -19.8006563  42.9868690  -7.4008878 -18.9838768  42.6201478  -6.9954867
 -19.4458826  43.2486899  -8.2779338  21.2729909  37.1488989  34.3212671
  21.1047180  37.2518153  33.3522966  21.6838288  38.0288443  34.4969589
  -3.5577273  15.7012811  13.4281799  -3.7843944  16.0464098  12.5289356
  -2.5642385  15.7750629  13.3531426 -16.6512086   9.6778387  12.2211856
 -17.1014299   8.9624850  11.7200278 -16.6009341   9.2564568  13.1098931
   7.6292691  -5.5912772   8.6355655   6.8443355  -4.9956814   8.5856173
   7.3799812  -6.1020175   9.4461813  12.7573884  19.1744543 -13.1653363
  12.7144341  19.8531289 -13.8621313  12.0114210  19.4806851 -12.5889819
   5.7641811  24.0320136  10.0182164   5.4464480  23.0988701  10.0528614
   5.0902589  24.4054602   9.4029914   6.7996360   0.5735321   0.4029114
   7.2513735   1.2809197   0.9261625   6.6923006  -0.0987539   1.1192734
  11.5308130   6.1686423  18.2860938  10.7365271   6.1263214  18.8663615
  11.4610005   7.1019751  17.9793261  37.1842848  -9.3082366  -5.9071886
  37.7752576  -9.6725912  -6.6160825  36.3131954  -9.5108375  -6.3333050
  23.4486760   0.1845801  10.8449716  23.0472182   0.8241977  10.2080040
  24.2492150   0.6903685  11.1001819   3.3634777   4.6539808 -19.8322279
   2.4722206   5.0364311 -20.0059052   3.6814598   4.5546855 -20.7609814
 -26.0579882  -6.5559771  -8.1192849 -26.8993756  -7.0500356  -7.9803346
 -26.3232548  -5.9809973  -8.8704477   1.3301620  10.1300796   5.7927898
   0.5684713   9.8548963   5.2288288   2.0398549   9.5881190   5.3458105
   6.8595566 -11.5668590  19.1819881   7.2943433 -12.2069964  18.5703781
   7.4648622 -10.7960110  19.0415595 -21.9360177 -14.9415903  13.9787032
 -21.3481387 -14.2191669  13.6742372 -21.6667929 -14.9949740  14.9257959
  34.8827682  30.5239626  14.2918431  35.2280345  29.6319383  14.0490133
  35.1482614  31.0253167  13.4868347  -5.2598885  -0.7022482  -0.3112012
  -5.1702176  -1.6313680  -0.6111244  -6.0365553  -0.7687581   0.2736491
   2.3247482 -11.6139789  39.7106264   1.9145796 -12.5094212  39.6274839
   3.2111385 -11.8750049  40.0402670  45.8702061  10.2815743 -12.2669008
  45.3135141   9.4649534 -12.1920422  46.5448314   9.9649122 -12.9001580
 -18.9502217   1.5509488  18.3788219 -18.1952151   1.5566600  17.7386573
 -18.8421528   0.6440804  18.7392965   6.1255535 -11.9741311  21.8440646
   6.9077711 -11.5793732  22.3015551   6.3778562 -11.7751409  20.9118870
  27.6321801  36.6071820  44.8591719  26.8099627  36.9734500  45.2704949
  27.8892374  37.4041586  44.3243507 -30.6015790  -6.6677087  -3.8521065
 -31.2224849  -6.0013251  -4.2274936 -31.1922729  -7.1139562  -3.2171863
  26.4645506  29.1300047  44.1175535  25.8197343  29.0921572  43.3723133
  27.1374890  29.7305905  43.7263928  -3.3550131  31.5947620   4.6516905
  -3.6628469  32.0328351   3.8121954  -3.1837394  30.6883722   4.2574635
   6.4927155 -31.4227200  27.2499014   6.6499364 -30.6795103  26.6140550
   7.1658023 -32.0601022  26.8869696   9.4966939  -7.1956719 -16.8398873
   9.8939133  -7.9922721 -17.2630260  10.2796934  -6.5896320 -16.9013816
  -1.7880200 -33.7006221 -39.8020581  -2.5971660 -33.9848918 -40.2992278
  -1.2636355 -33.3472933 -40.5597895  24.9997588   4.1464478 -10.4305961
  25.2499005   3.4320832  -9.8028953  25.3476543   3.7587810 -11.2674263
  37.1506252  -9.2715841 -10.9701788  36.9231213  -8.7129871 -10.1905356
  36.2946265  -9.7404665 -11.0871655  16.6125149  -2.2217935 -24.1329409
  15.6988969  -2.0405339 -23.8083756  17.0931911  -2.1888019 -23.2705370
   6.0583371  10.5763542  -3.9541267   6.1651703   9.7723358  -3.4234863
   6.6865616  11.1814363  -3.4993284  -8.3119221  45.3801750   7.0666758
  -8.5817760  46.1978547   6.5730543  -9.2158252  45.0918159   7.3577147
  15.5474436  21.9710380  10.4117759  15.2810234  22.7765020   9.9223335
  15.0782147  22.1162923  11.2633982   2.8413890  35.1226397  -1.7448203
   2.7941824  35.8011216  -1.0311218   2.0546702  35.3938037  -2.2751434
  10.6167942  32.4031935  31.2929107  11.0935972  31.8031269  31.9237872
  10.1489134  31.7094058  30.7584373  -7.1431789  36.4647050  42.5680750
  -7.5873495  36.7691865  43.3884207  -6.7549830  35.6196844  42.8956057
  -1.7284734   1.2730438  -5.3072281  -0.9327094   1.8394175  -5.4874931
  -1.9905717   1.0975409  -6.2463467  13.5138437  26.4487782  19.7807349
  12.9116812  25.7088850  20.0339625  13.3451108  27.0558758  20.5361250
   9.2572330 -14.3512033   5.7553384   8.8453683 -13.5830924   6.2153070
   8.5361323 -14.5531160   5.1106005  18.4812586  40.5048441   5.9180931
  18.8382720  41.4274316   5.8934067  18.9116302  40.1541639   5.1005191
  14.0033973  -2.0092288  20.9926513  14.3763686  -1.1634002  21.3423058
  14.5135992  -2.0649567  20.1502095
  60.1409761  41.6025404  49.7582396  90.0000000  90.0000000  90.0000000
# Restraints file 2: RST
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,11,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=15,20,18,19, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=17,23,21,22, &end
#
#  chirality for residue 2 atoms:  CD NZ HE2 HE3
 &rst iat=23,29,27,28, &end
#
#  chirality for residue 2 atoms:  CG CE HD2 HD3
 &rst iat=20,26,24,25, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=13,33,16,17, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=37,42,40,41, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=35,47,38,39, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=51,56,54,55, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=53,59,57,58, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=49,64,52,53, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=68,73,71,72, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=66,84,69,70, &end
#
#  chirality for residue 6 atoms:  N C HA2 HA3
 &rst iat=86,91,89,90, &end
#
#  chirality for residue 7 atoms:  CA SG HB2 HB3
 &rst iat=95,100,98,99, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=93,101,96,97, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=105,110,108,109, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=103,121,106,107, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=123,131,126,127, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=135,140,138,139, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=133,145,136,137, &end
#
#  chirality for residue 11 atoms:  CA CG1 CG2 HB
 &rst iat=149,153,157,152, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=147,161,150,151, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=165,170,168,169, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=163,173,166,167, &end
#
#  chirality for residue 13 atoms:  CA CG1 CG2 HB
 &rst iat=177,181,185,180, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=175,189,178,179, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=193,198,196,197, &end
#
#  chirality for residue 14 atoms:  CB CD HG2 HG3
 &rst iat=195,201,199,200, &end
#
#  chirality for residue 14 atoms:  CD NZ HE2 HE3
 &rst iat=201,207,205,206, &end
#
#  chirality for residue 14 atoms:  CG CE HD2 HD3
 &rst iat=198,204,202,203, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=191,211,194,195, &end
#
#  chirality for residue 15 atoms:  N C HA2 HA3
 &rst iat=213,218,216,217, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=222,227,225,226, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=220,230,223,224, &end
#
#  chirality for residue 17 atoms:  CA SG HB2 HB3
 &rst iat=234,239,237,238, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=232,240,235,236, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=244,249,247,248, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=246,252,250,251, &end
#
#  chirality for residue 18 atoms:  CD NZ HE2 HE3
 &rst iat=252,258,256,257, &end
#
#  chirality for residue 18 atoms:  CG CE HD2 HD3
 &rst iat=249,255,253,254, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=242,262,245,246, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=266,271,269,270, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=268,274,272,273, &end
#
#  chirality for residue 19 atoms:  CG NE HD2 HD3
 &rst iat=271,277,275,276, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=264,286,267,268, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=290,295,293,294, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=288,303,291,292, &end
#
#  chirality for residue 21 atoms:  CA SG HB2 HB3
 &rst iat=307,312,310,311, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=305,313,308,309, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=317,322,320,321, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=319,325,323,324, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=325,331,329,330, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=322,328,326,327, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=315,335,318,319, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=337,345,340,341, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=349,354,352,353, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=351,357,355,356, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=347,360,350,351, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=364,369,367,368, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=362,372,365,366, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=376,381,379,380, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=378,384,382,383, &end
#
#  chirality for residue 26 atoms:  CD NZ HE2 HE3
 &rst iat=384,390,388,389, &end
#
#  chirality for residue 26 atoms:  CG CE HD2 HD3
 &rst iat=381,387,385,386, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=374,394,377,378, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=398,403,401,402, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=400,406,404,405, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=396,409,399,400, &end
#
#  chirality for residue 28 atoms:  N C HA2 HA3
 &rst iat=411,416,414,415, &end
#
#  chirality for residue 29 atoms:  CA CG2 CG1 HB
 &rst iat=420,424,428,423, &end
#
#  chirality for residue 29 atoms:  CB CD1 HG12 HG13
 &rst iat=422,431,429,430, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=418,435,421,422, &end
#
#  chirality for residue 30 atoms:  CA SG HB2 HB3
 &rst iat=439,444,442,443, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=437,445,440,441, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=449,454,452,453, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=447,462,450,451, &end
#
#  chirality for residue 32 atoms:  N C HA2 HA3
 &rst iat=464,469,467,468, &end
#
#  chirality for residue 33 atoms:  CA CG2 OG1 HB
 &rst iat=473,477,481,476, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=471,483,474,475, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=487,492,490,491, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=489,495,493,494, &end
#
#  chirality for residue 34 atoms:  CD NZ HE2 HE3
 &rst iat=495,501,499,500, &end
#
#  chirality for residue 34 atoms:  CG CE HD2 HD3
 &rst iat=492,498,496,497, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=485,505,488,489, &end
#
#  chirality for residue 35 atoms:  CA SG HB2 HB3
 &rst iat=509,514,512,513, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=507,515,510,511, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=519,524,522,523, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=521,527,525,526, &end
#
#  chirality for residue 36 atoms:  CD NZ HE2 HE3
 &rst iat=527,533,531,532, &end
#
#  chirality for residue 36 atoms:  CG CE HD2 HD3
 &rst iat=524,530,528,529, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=517,537,520,521, &end
#
#  chirality for residue 37 atoms:  CA SG HB2 HB3
 &rst iat=541,546,544,545, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=539,547,542,543, &end
#
#  chirality for residue 38 atoms:  N C HA2 HA3
 &rst iat=549,554,552,553, &end
#
#  chirality for residue 39 atoms:  CA CG1 CG2 HB
 &rst iat=558,562,566,561, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=556,570,559,560, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=582,576,580,581, &end
#
#  chirality for residue 40 atoms:  CB CD HG2 HG3
 &rst iat=579,573,577,578, &end
#
#  chirality for residue 40 atoms:  CG N HD2 HD3
 &rst iat=576,572,574,575, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=572,584,583,579, &end
#
#  chirality for residue 41 atoms:  CA CG2 CG1 HB
 &rst iat=588,592,596,591, &end
#
#  chirality for residue 41 atoms:  CB CD1 HG12 HG13
 &rst iat=590,599,597,598, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=586,603,589,590, &end
#
#  chirality for residue 42 atoms:  CA OG HB2 HB3
 &rst iat=607,612,610,611, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=605,614,608,609, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=618,623,621,622, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=616,635,619,620, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=639,644,642,643, &end
#
#  chirality for residue 44 atoms:  CB CD1 CD2 HG
 &rst iat=641,646,650,645, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=637,654,640,641, &end
#
#  trans-omega constraint for residue 2
 &rst iat=15,13,11,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=37,35,33,15, &end
#
#  trans-omega constraint for residue 4
 &rst iat=51,49,47,37, &end
#
#  trans-omega constraint for residue 5
 &rst iat=68,66,64,51, &end
#
#  trans-omega constraint for residue 6
 &rst iat=88,86,84,68, &end
#
#  trans-omega constraint for residue 7
 &rst iat=95,93,91,88, &end
#
#  trans-omega constraint for residue 8
 &rst iat=105,103,101,95, &end
#
#  trans-omega constraint for residue 9
 &rst iat=125,123,121,105, &end
#
#  trans-omega constraint for residue 10
 &rst iat=135,133,131,125, &end
#
#  trans-omega constraint for residue 11
 &rst iat=149,147,145,135, &end
#
#  trans-omega constraint for residue 12
 &rst iat=165,163,161,149, &end
#
#  trans-omega constraint for residue 13
 &rst iat=177,175,173,165, &end
#
#  trans-omega constraint for residue 14
 &rst iat=193,191,189,177, &end
#
#  trans-omega constraint for residue 15
 &rst iat=215,213,211,193, &end
#
#  trans-omega constraint for residue 16
 &rst iat=222,220,218,215, &end
#
#  trans-omega constraint for residue 17
 &rst iat=234,232,230,222, &end
#
#  trans-omega constraint for residue 18
 &rst iat=244,242,240,234, &end
#
#  trans-omega constraint for residue 19
 &rst iat=266,264,262,244, &end
#
#  trans-omega constraint for residue 20
 &rst iat=290,288,286,266, &end
#
#  trans-omega constraint for residue 21
 &rst iat=307,305,303,290, &end
#
#  trans-omega constraint for residue 22
 &rst iat=317,315,313,307, &end
#
#  trans-omega constraint for residue 23
 &rst iat=339,337,335,317, &end
#
#  trans-omega constraint for residue 24
 &rst iat=349,347,345,339, &end
#
#  trans-omega constraint for residue 25
 &rst iat=364,362,360,349, &end
#
#  trans-omega constraint for residue 26
 &rst iat=376,374,372,364, &end
#
#  trans-omega constraint for residue 27
 &rst iat=398,396,394,376, &end
#
#  trans-omega constraint for residue 28
 &rst iat=413,411,409,398, &end
#
#  trans-omega constraint for residue 29
 &rst iat=420,418,416,413, &end
#
#  trans-omega constraint for residue 30
 &rst iat=439,437,435,420, &end
#
#  trans-omega constraint for residue 31
 &rst iat=449,447,445,439, &end
#
#  trans-omega constraint for residue 32
 &rst iat=466,464,462,449, &end
#
#  trans-omega constraint for residue 33
 &rst iat=473,471,469,466, &end
#
#  trans-omega constraint for residue 34
 &rst iat=487,485,483,473, &end
#
#  trans-omega constraint for residue 35
 &rst iat=509,507,505,487, &end
#
#  trans-omega constraint for residue 36
 &rst iat=519,517,515,509, &end
#
#  trans-omega constraint for residue 37
 &rst iat=541,539,537,519, &end
#
#  trans-omega constraint for residue 38
 &rst iat=551,549,547,541, &end
#
#  trans-omega constraint for residue 39
 &rst iat=558,556,554,551, &end
#
#  trans-omega constraint for residue 40
 &rst iat=582,572,570,558, &end
#
#  trans-omega constraint for residue 41
 &rst iat=588,586,584,582, &end
#
#  trans-omega constraint for residue 42
 &rst iat=607,605,603,588, &end
#
#  trans-omega constraint for residue 43
 &rst iat=618,616,614,607, &end
#
#  trans-omega constraint for residue 44
 &rst iat=639,637,635,618, &end
#
#  5 PHE   HB2   35   CYX   HB2   3.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  71, 512, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
# 21 CYX   HA    23   ALA   QB    4.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 342, 343, 344,
 &end
#
# 21 CYX   HA    26   LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 385, 386,
 &end
#
# 26 LYS   QD    39   VAL   HA    4.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1= 385, 386,
 &end
#
#  8 PHE   HE    9    ALA   HN    4.94 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 124, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 114, 118,
 &end
#
#  4 GLN   HE22  13   VAL   QG2   4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 186, 187, 188,
 &end
#
#  7 CYX   HA    13   VAL   HN    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 176, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 11 VAL   HA    30   CYX   QB    4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 442, 443,
 &end
#
# 11 VAL   QG1   13   VAL   QG2   3.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 154, 155, 156,
 igr2= 186, 187, 188,
 &end
#
# 11 VAL   QG1   13   VAL   HA    3.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 178, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 154, 155, 156,
 &end
#
# 32 GLY   HA3   33   THR   QG2   4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 468,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 478, 479, 480,
 &end
#
# 26 LYS   QB    37   CYX   HB2   3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 379, 380,
 &end
#
# 26 LYS   QD    37   CYX   HB2   3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr1= 385, 386,
 &end
#
# 37 CYX   HB2   38   GLY   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 550, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 26 LYS   QB    37   CYX   HA    4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 379, 380,
 &end
#
# 26 LYS   QD    37   CYX   HA    4.63 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 542, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 385, 386,
 &end
#
# 36 LYS   HA    37   CYX   HA    4.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 520, 542, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 28 GLY   HA2   37   CYX   HA    3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 542, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 28 GLY   HA3   37   CYX   HA    4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 542, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 29 ILE   HN    37   CYX   HA    3.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 542, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 21 CYX   HB3   37   CYX   HA    4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 542, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 37 CYX   HA    38   GLY   HA3   4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 542, 553, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 29 ILE   HA    30   CYX   HN    2.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 438, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 29 ILE   QD1   30   CYX   HN    3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 432, 433, 434,
 &end
#
# 29 ILE   HN    37   CYX   HN    5.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 540, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 44 LEU   QB    44   LEU   HG    2.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 645, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1= 642, 643,
 &end
#
# 26 LYS   QB    37   CYX   HB3   3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 379, 380,
 &end
#
#  7 CYX   HA    12   ASP   HA    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 166, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  7 CYX   HA    8    PHE   HA    4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 106, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  4 GLN   HN    4    GLN   HG2   4.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  57, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  4 GLN   HN    4    GLN   HG3   4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  58, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  4 GLN   HN    4    GLN   HB3   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  55, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  7 CYX   HA    8    PHE   HN    2.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 104, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  8 PHE   HN    11   VAL   HB    4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 152, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  8 PHE   HN    8    PHE   HB3   3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 109, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  8 PHE   HN    9    ALA   HN    4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 124, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  8 PHE   HN    12   ASP   HA    4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 166, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  8 PHE   HN    8    PHE   HD    5.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 112, 120,
 &end
#
#  8 PHE   HN    8    PHE   HD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 112, 120,
 &end
#
#  8 PHE   HN    13   VAL   QG2   3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 186, 187, 188,
 &end
#
#  8 PHE   HN    11   VAL   QG2   5.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2= 158, 159, 160,
 &end
#
#  8 PHE   HN    13   VAL   QG1   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 182, 183, 184,
 &end
#
#  8 PHE   HN    10   ASN   HN    4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 134, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
#  7 CYX   HB3   8    PHE   HN    4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  99, 104, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  8 PHE   HN    11   VAL   HN    3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 148, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 34 LYS   HB2   34   LYS   QE    4.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 490,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 499, 500,
 &end
#
# 19 ARG   HB3   19   ARG   HE    3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 278, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 19 ARG   QG    19   ARG   HE    4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 278, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 272, 273,
 &end
#
# 19 ARG   HB2   19   ARG   HE    3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 278, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 13 VAL   HN    13   VAL   HB    3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 180, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
# 12 ASP   HA    13   VAL   HN    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 166, 176, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 13 VAL   HN    13   VAL   QG2   2.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
 igr2= 186, 187, 188,
 &end
#
#  2 LYS   HB2   2    LYS   QD    3.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  18,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2=  24,  25,
 &end
#
# 17 CYX   HB2   18   LYS   HN    4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 243, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 34 LYS   HB3   35   CYX   HN    3.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 491, 508, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 34 LYS   HA    35   CYX   HN    2.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 508, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,  &end
#
# 35 CYX   HN    36   LYS   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 518, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 34 LYS   HB2   35   CYX   HN    3.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 490, 508, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 35 CYX   HN    35   CYX   HB3   3.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  5 PHE   HD    35   CYX   HN    4.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=  75,  83,
 &end
#
# 35 CYX   HN    35   CYX   HB2   3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 508, 512, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 14 LYS   QB    14   LYS   QE    5.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 196, 197,
 igr2= 205, 206,
 &end
#
# 14 LYS   HA    14   LYS   QE    4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 194,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 205, 206,
 &end
#
# 13 VAL   HA    13   VAL   QG2   3.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 186, 187, 188,
 &end
#
#  8 PHE   HB3   13   VAL   QG2   3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 186, 187, 188,
 &end
#
# 41 ILE   QG2   41   ILE   HG12  3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 597, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 593, 594, 595,
 &end
#
# 33 THR   HA    34   LYS   HG2   4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 493, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 33 THR   HA    33   THR   HB    2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#  4 GLN   HN    6    GLY   HN    3.45 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  87, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  6 GLY   HN    15   GLY   HA3   5.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  87, 217, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#  5 PHE   HA    6    GLY   HN    3.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  69,  87, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  4 GLN   HG3   6    GLY   HN    3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  87, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  5 PHE   HN    6    GLY   HN    3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  87, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  5 PHE   HB2   6    GLY   HN    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  87, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
# 21 CYX   HB2   28   GLY   HA2   4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 414, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 21 CYX   HB2   28   GLY   HA3   3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 415, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 21 CYX   HB2   28   GLY   HN    4.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 412, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 11 VAL   HA    11   VAL   QG1   2.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr2= 154, 155, 156,
 &end
#
# 11 VAL   QG1   12   ASP   HN    3.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 164, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 154, 155, 156,
 &end
#
# 41 ILE   HN    41   ILE   HB    3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 591, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 34 LYS   HA    34   LYS   HD3   4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 497, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  5 PHE   HB2   34   LYS   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  71, 488, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 34 LYS   HA    34   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 499, 500,
 &end
#
# 34 LYS   HA    34   LYS   HD2   4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 496, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 24 GLU   HN    25   ASP   HA    4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 365, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 25 ASP   HA    41   ILE   QG2   3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 365,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 593, 594, 595,
 &end
#
# 41 ILE   HB    42   SER   HN    4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 606, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 42 SER   HN    42   SER   HB3   3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 611, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 41 ILE   QD1   42   SER   HN    3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 600, 601, 602,
 &end
#
# 41 ILE   HN    42   SER   HN    3.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 606, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
# 42 SER   HN    42   SER   HA    2.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 608, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,  &end
#
# 40 PRO   HA    42   SER   HN    4.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 606, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 41 ILE   QG2   42   SER   HN    4.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 606, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 593, 594, 595,
 &end
#
# 35 CYX   HA    36   LYS   HN    2.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 510, 518, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
# 36 LYS   HN    37   CYX   HN    4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 518, 540, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 29 ILE   HB    36   LYS   HN    5.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 518, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
# 35 CYX   HB3   36   LYS   HN    4.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 518, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 28 GLY   HA2   36   LYS   HN    4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 518, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 31 HIS   HN    36   LYS   HN    4.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 518, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 36 LYS   HN    36   LYS   QG    4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 525, 526,
 &end
#
# 29 ILE   QD1   36   LYS   HN    4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 432, 433, 434,
 &end
#
# 30 CYX   HA    36   LYS   HN    4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 518, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 36 LYS   HN    36   LYS   HB3   3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 518, 523, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 29 ILE   HN    36   LYS   HN    3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 518, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 35 CYX   HB2   36   LYS   HN    4.39 
 &rst
  ixpk= 0, nxpk= 0, iat= 512, 518, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 36 LYS   HN    36   LYS   HB2   3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 518, 522, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  3 ASN   HA    3    ASN   HD21  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  38,  45, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 33 THR   HA    33   THR   QG2   2.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
 igr2= 478, 479, 480,
 &end
#
# 33 THR   HN    33   THR   QG2   3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 472,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr2= 478, 479, 480,
 &end
#
#  9 ALA   HN    33   THR   QG2   3.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 478, 479, 480,
 &end
#
#  8 PHE   HA    9    ALA   QB    4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 128, 129, 130,
 &end
#
# 37 CYX   HN    37   CYX   HB2   3.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 540, 544, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  8 PHE   HN    13   VAL   HN    4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 176, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 36 LYS   HA    37   CYX   HN    2.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 520, 540, r1= 1.30, r2= 1.80, r3= 2.57, r4= 3.07,  &end
#
# 36 LYS   HB3   37   CYX   HN    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 523, 540, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 10 ASN   HN    10   ASN   HD22  5.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 144, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 39 VAL   HB    40   PRO   HD2   3.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 574, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 19 ARG   HA    22   LYS   HB2   3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 320, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 22 LYS   HB2   23   ALA   HN    4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 338, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 18 LYS   QD    22   LYS   HB2   4.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 253, 254,
 &end
#
# 26 LYS   HN    26   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 388, 389,
 &end
#
# 26 LYS   HN    26   LYS   QB    3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 379, 380,
 &end
#
# 25 ASP   HA    26   LYS   HN    3.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 375, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 26 LYS   HN    27   GLU   HN    4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 397, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25 ASP   HN    26   LYS   HN    3.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 375, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 26 LYS   HN    26   LYS   QG    3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 375,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2= 382, 383,
 &end
#
# 22 LYS   HA    26   LYS   HN    3.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 375, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 21 CYX   HB3   26   LYS   HN    5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 375, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
# 42 SER   HB3   43   TYR   HN    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 611, 617, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 19 ARG   HB3   19   ARG   QG    2.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2= 272, 273,
 &end
#
# 19 ARG   HB3   20   HIS   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 289, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 19 ARG   HN    19   ARG   HB3   3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 270, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 18 LYS   QG    22   LYS   HB2   4.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 320, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 250, 251,
 &end
#
# 18 LYS   QG    18   LYS   QD    2.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 250, 251,
 igr2= 253, 254,
 &end
#
# 32 GLY   HN    33   THR   HN    4.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 472, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 32 GLY   HN    32   GLY   HA2   2.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 467, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 31 HIS   HA    32   GLY   HN    3.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 465, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
# 30 CYX   QB    32   GLY   HN    4.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 442, 443,
 &end
#
# 10 ASN   HA    32   GLY   HN    3.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 465, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
# 43 TYR   HB3   43   TYR   HE    5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr2= 627, 632,
 &end
#
# 41 ILE   QD1   43   TYR   HE    4.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 600, 601, 602,
 igr2= 627, 632,
 &end
#
# 43 TYR   HN    43   TYR   HE    5.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr2= 627, 632,
 &end
#
# 43 TYR   HB2   43   TYR   HE    5.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 621,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr2= 627, 632,
 &end
#
# 42 SER   HN    42   SER   HB2   3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 610, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 42 SER   HB2   43   TYR   HN    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 610, 617, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 29 ILE   HB    30   CYX   HN    4.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 438, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 29 ILE   HB    29   ILE   QD1   3.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 423,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 432, 433, 434,
 &end
#
# 29 ILE   HB    31   HIS   HD2   5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 461, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 29 ILE   HB    29   ILE   HG12  2.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 429, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
#  5 PHE   HE    35   CYX   HB3   4.15 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1=  77,  81,
 &end
#
#  5 PHE   HE    35   CYX   HB2   5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1=  77,  81,
 &end
#
#  5 PHE   HE    34   LYS   HB3   4.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1=  77,  81,
 &end
#
# 29 ILE   QG2   29   ILE   HG13  2.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 430, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr1= 425, 426, 427,
 &end
#
# 29 ILE   HA    29   ILE   QG2   3.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 421,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 425, 426, 427,
 &end
#
# 29 ILE   QG2   29   ILE   QD1   2.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1= 425, 426, 427,
 igr2= 432, 433, 434,
 &end
#
# 29 ILE   HN    29   ILE   QG2   4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 425, 426, 427,
 &end
#
# 29 ILE   QG2   29   ILE   HG12  3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 429, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 425, 426, 427,
 &end
#
#  5 PHE   HA    5    PHE   HE    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  69,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=  77,  81,
 &end
#
#  5 PHE   HE    20   HIS   QB    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1=  77,  81,
 igr2= 293, 294,
 &end
#
#  4 GLN   HN    4    GLN   HB2   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  54, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  4 GLN   HB2   4    GLN   HE22  5.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  54,  63, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
# 19 ARG   HA    19   ARG   HE    5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 278, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 19 ARG   HA    19   ARG   QG    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 267,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2= 272, 273,
 &end
#
# 19 ARG   HA    22   LYS   HB3   3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 321, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 19 ARG   HA    22   LYS   HN    3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 316, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 32 GLY   HA2   33   THR   HN    3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 472, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
# 32 GLY   HA3   33   THR   HN    2.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 468, 472, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 16 ASP   QB    18   LYS   QG    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 225, 226,
 igr2= 250, 251,
 &end
#
# 22 LYS   HA    23   ALA   QB    5.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 342, 343, 344,
 &end
#
# 22 LYS   HN    23   ALA   QB    4.38 
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 342, 343, 344,
 &end
#
# 37 CYX   HB2   38   GLY   HA2   5.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 544, 552, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#  9 ALA   HA    32   GLY   HA2   3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 467, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 34 LYS   HN    34   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 499, 500,
 &end
#
# 34 LYS   HN    34   LYS   HB3   3.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 491, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
# 33 THR   QG2   34   LYS   HN    4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 478, 479, 480,
 &end
#
# 33 THR   HN    34   LYS   HN    2.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 486, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 32 GLY   HA2   34   LYS   HN    4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 486, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 34 LYS   HN    34   LYS   HG2   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 493, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 34 LYS   HN    34   LYS   HG3   4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 494, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 22 LYS   HB3   22   LYS   HD3   4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 327, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 39 VAL   QG1   40   PRO   HD2   3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 563, 564, 565,
 &end
#
# 39 VAL   QG1   40   PRO   HD3   3.65 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 563, 564, 565,
 &end
#
# 26 LYS   QB    26   LYS   QD    2.66 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
 igr1= 379, 380,
 igr2= 385, 386,
 &end
#
# 26 LYS   QD    39   VAL   HB    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 561, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 385, 386,
 &end
#
# 26 LYS   QD    37   CYX   HB3   3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 385, 386,
 &end
#
# 26 LYS   QG    26   LYS   QD    2.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1= 382, 383,
 igr2= 385, 386,
 &end
#
# 26 LYS   HA    26   LYS   QD    3.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 385, 386,
 &end
#
# 21 CYX   HB3   26   LYS   QD    4.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 385, 386,
 &end
#
# 26 LYS   QD    40   PRO   HA    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 583, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 385, 386,
 &end
#
# 43 TYR   HA    43   TYR   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 627, 632,
 &end
#
# 43 TYR   HA    43   TYR   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 627, 632,
 &end
#
# 31 HIS   HA    32   GLY   HA2   4.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 467, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 37 CYX   HA    38   GLY   HN    2.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 542, 550, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16,  &end
#
# 26 LYS   QB    38   GLY   HN    3.51 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1= 379, 380,
 &end
#
# 26 LYS   QD    38   GLY   HN    4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 550, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 385, 386,
 &end
#
# 28 GLY   HA2   38   GLY   HN    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 550, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 12 ASP   HN    30   CYX   QB    4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 442, 443,
 &end
#
# 37 CYX   HB3   38   GLY   HN    3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 545, 550, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 27 GLU   HB2   38   GLY   HN    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 550, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 27 GLU   HB3   38   GLY   HN    4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 550, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 38 GLY   HN    38   GLY   HA3   2.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 553, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,  &end
#
# 34 LYS   HA    34   LYS   HG2   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 488, 493, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 44 LEU   QB    44   LEU   QQD   4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 644, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 642, 643,
 &end
#
#  8 PHE   HA    8    PHE   HE    4.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 114, 118,
 &end
#
#  3 ASN   HA    3    ASN   QB    2.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  38,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2=  40,  41,
 &end
#
# 11 VAL   HA    12   ASP   HN    2.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 164, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16,  &end
#
# 29 ILE   HA    29   ILE   HG13  3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 430, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 29 ILE   HA    29   ILE   HG12  3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 429, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 26 LYS   QB    27   GLU   HN    3.09 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr1= 379, 380,
 &end
#
# 21 CYX   HB3   27   GLU   HN    4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 397, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 26 LYS   QD    27   GLU   HN    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 397, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 385, 386,
 &end
#
# 27 GLU   HN    38   GLY   HN    3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 550, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 27 GLU   HN    28   GLY   HN    4.41 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 412, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 27 GLU   HN    37   CYX   HB3   5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 545, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 27 GLU   HN    39   VAL   QG2   4.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 567, 568, 569,
 &end
#
# 26 LYS   HA    27   GLU   HN    2.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 397, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33,  &end
#
# 27 GLU   HN    39   VAL   HA    4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27 GLU   HN    27   GLU   HB2   3.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 401, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 27 GLU   HN    40   PRO   HA    3.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 583, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 27 GLU   HN    27   GLU   HB3   3.55 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 402, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  8 PHE   HZ    33   THR   QG2   4.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 478, 479, 480,
 &end
#
#  8 PHE   HZ    9    ALA   QB    4.52 
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 128, 129, 130,
 &end
#
# 19 ARG   HN    19   ARG   QG    5.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 265,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2= 272, 273,
 &end
#
# 20 HIS   HN    20   HIS   QB    4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 289,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 293, 294,
 &end
#
# 25 ASP   HN    25   ASP   HA    2.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 365, r1= 1.30, r2= 1.80, r3= 2.48, r4= 2.98,  &end
#
# 23 ALA   QB    25   ASP   HN    4.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 342, 343, 344,
 &end
#
# 25 ASP   HN    25   ASP   HB2   3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 367, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 24 GLU   HN    25   ASP   HN    2.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 363, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,  &end
#
# 24 GLU   HB3   25   ASP   HN    4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 363, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 22 LYS   HA    25   ASP   HN    3.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 363, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 25 ASP   HN    25   ASP   HB3   3.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 368, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 23 ALA   HN    25   ASP   HN    4.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 363, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 24 GLU   HA    25   ASP   HN    3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 363, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 24 GLU   HB2   25   ASP   HN    4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 363, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
# 19 ARG   HA    19   ARG   HD3   4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 276, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 17 CYX   HA    20   HIS   HD2   5.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 302, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  5 PHE   HE    20   HIS   HD2   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1=  77,  81,
 &end
#
# 20 HIS   HD2   21   CYX   HN    3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 306, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 20 HIS   HD2   21   CYX   HA    4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 308, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 20 HIS   HA    20   HIS   HD2   5.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 302, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 20 HIS   HN    20   HIS   HD2   4.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 302, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 13 VAL   HN    13   VAL   QG1   4.08 
 &rst
  ixpk= 0, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 182, 183, 184,
 &end
#
# 13 VAL   HA    13   VAL   QG1   2.82 
 &rst
  ixpk= 0, nxpk= 0, iat= 178,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 182, 183, 184,
 &end
#
# 41 ILE   HB    41   ILE   QD1   2.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 600, 601, 602,
 &end
#
# 41 ILE   HN    41   ILE   QD1   3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 587,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 600, 601, 602,
 &end
#
# 21 CYX   HB3   28   GLY   HA2   4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 414, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
# 24 GLU   HN    26   LYS   HN    3.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 375, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
# 23 ALA   QB    24   GLU   HN    3.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 348, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr1= 342, 343, 344,
 &end
#
# 21 CYX   HA    24   GLU   HN    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 348, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 24 GLU   HN    24   GLU   HG3   3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 356, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 24 GLU   HN    24   GLU   HB2   3.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 352, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  9 ALA   HN    9    ALA   HA    2.63 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 126, r1= 1.30, r2= 1.80, r3= 2.63, r4= 3.13,  &end
#
#  9 ALA   HN    32   GLY   HA2   4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 467, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  8 PHE   HA    9    ALA   HN    2.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 124, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16,  &end
#
#  9 ALA   HN    10   ASN   HA    5.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 136, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  8 PHE   HB2   9    ALA   HN    4.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 124, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  9 ALA   HN    11   VAL   HN    4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 148, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  9 ALA   HN    9    ALA   QB    3.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 128, 129, 130,
 &end
#
# 21 CYX   HN    21   CYX   HB2   3.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 310, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
# 19 ARG   HA    21   CYX   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 306, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 20 HIS   QB    21   CYX   HN    4.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 293, 294,
 &end
#
# 18 LYS   HA    21   CYX   HN    3.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 306, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 21 CYX   HN    28   GLY   HA3   3.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 415, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
# 21 CYX   HN    21   CYX   HB3   3.78 
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 311, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
# 21 CYX   HA    25   ASP   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 21 CYX   HA    24   GLU   HB2   4.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 352, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
# 18 LYS   HA    21   CYX   HB2   3.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 310, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 18 LYS   HA    18   LYS   QG    3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 250, 251,
 &end
#
# 18 LYS   HA    28   GLY   HA2   4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 414, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 18 LYS   HA    28   GLY   HA3   3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 415, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 18 LYS   HA    28   GLY   HN    3.37 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 412, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 18 LYS   HA    18   LYS   QD    3.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 253, 254,
 &end
#
# 18 LYS   HA    18   LYS   QE    4.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 256, 257,
 &end
#
#  8 PHE   HA    9    ALA   HA    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 126, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 28 GLY   HA3   38   GLY   HN    5.17 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 550, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 20 HIS   HD2   28   GLY   HA3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 302, 415, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 40 PRO   HB3   41   ILE   HN    4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 581, 587, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 11 VAL   HB    13   VAL   HN    4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 176, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 40 PRO   HB2   41   ILE   HN    4.27 
 &rst
  ixpk= 0, nxpk= 0, iat= 580, 587, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 41 ILE   HN    41   ILE   HG13  3.58 
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 598, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
# 40 PRO   HA    41   ILE   HN    2.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 587, r1= 1.30, r2= 1.80, r3= 2.51, r4= 3.01,  &end
#
# 41 ILE   HN    41   ILE   QG2   4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 587,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 593, 594, 595,
 &end
#
# 30 CYX   HN    31   HIS   HN    4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 438, 448, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 31 HIS   HN    35   CYX   HA    4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 510, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 31 HIS   HN    32   GLY   HN    4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 465, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 31 HIS   HN    34   LYS   HN    4.36 
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 486, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 29 ILE   QD1   31   HIS   HN    4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 432, 433, 434,
 &end
#
# 30 CYX   HA    31   HIS   HN    2.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 448, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
#  4 GLN   HN    5    PHE   HD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  75,  83,
 &end
#
#  4 GLN   HG3   4    GLN   HE22  3.90 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  63, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  4 GLN   HA    5    PHE   HD    4.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2=  75,  83,
 &end
#
#  4 GLN   HB3   4    GLN   HE22  5.02 
 &rst
  ixpk= 0, nxpk= 0, iat=  55,  63, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  5 PHE   HD    34   LYS   HB3   5.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 491, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1=  75,  83,
 &end
#
# 36 LYS   HA    36   LYS   QG    4.02 
 &rst
  ixpk= 0, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 525, 526,
 &end
#
# 31 HIS   HN    36   LYS   QG    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 525, 526,
 &end
#
# 12 ASP   HN    12   ASP   HB3   3.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 164, 169, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 29 ILE   HA    29   ILE   QD1   3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 421,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 432, 433, 434,
 &end
#
# 29 ILE   QD1   30   CYX   QB    4.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 432, 433, 434,
 igr2= 442, 443,
 &end
#
# 10 ASN   HN    10   ASN   HB3   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 139, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 43 TYR   HN    43   TYR   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 627, 632,
 &end
#
# 41 ILE   QD1   43   TYR   HN    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 617, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 600, 601, 602,
 &end
#
# 42 SER   HA    43   TYR   HN    2.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 608, 617, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  5 PHE   HZ    20   HIS   QB    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 293, 294,
 &end
#
# 10 ASN   HB3   10   ASN   HD21  3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 143, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 10 ASN   HN    10   ASN   HD21  4.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 143, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
# 10 ASN   HB2   10   ASN   HD21  3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 138, 143, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 10 ASN   HA    10   ASN   HD21  4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 143, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 39 VAL   HB    40   PRO   HD3   3.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 561, 575, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 27 GLU   HN    40   PRO   HD3   5.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 575, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
# 39 VAL   QG2   40   PRO   HD3   4.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 567, 568, 569,
 &end
#
# 23 ALA   HA    25   ASP   HN    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 340, 363, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 30 CYX   HA    35   CYX   HA    3.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 510, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
# 29 ILE   HA    30   CYX   HA    4.49 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 440, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 29 ILE   QD1   30   CYX   HA    4.29 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 432, 433, 434,
 &end
#
#  7 CYX   HN    7    CYX   HB3   3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  94,  99, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  7 CYX   HN    8    PHE   HN    4.56 
 &rst
  ixpk= 0, nxpk= 0, iat=  94, 104, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#  6 GLY   HN    7    CYX   HN    2.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  87,  94, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
#  5 PHE   HA    7    CYX   HN    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat=  69,  94, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  4 GLN   HG2   7    CYX   HN    5.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  57,  94, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#  7 CYX   HN    7    CYX   HB2   2.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  94,  98, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
#  7 CYX   HN    30   CYX   QB    5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 442, 443,
 &end
#
#  4 GLN   HG3   7    CYX   HN    3.74 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  94, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  5 PHE   HB3   7    CYX   HN    4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  94, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  8 PHE   HB2   8    PHE   HD    2.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 108,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 112, 120,
 &end
#
#  8 PHE   HD    11   VAL   HB    4.96 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 112, 120,
 &end
#
# 36 LYS   HN    36   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 531, 532,
 &end
#
# 36 LYS   HA    36   LYS   QE    5.03 
 &rst
  ixpk= 0, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr2= 531, 532,
 &end
#
#  2 LYS   HA    2    LYS   HG3   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  22, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  8 PHE   HA    33   THR   QG2   3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 478, 479, 480,
 &end
#
#  8 PHE   HA    10   ASN   HN    4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 134, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  3 ASN   HN    3    ASN   HD21  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  45, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  3 ASN   HN    5    PHE   HN    3.73 
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  67, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 43 TYR   HA    43   TYR   HD    4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 619,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 625, 634,
 &end
#
# 43 TYR   HN    43   TYR   HD    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 625, 634,
 &end
#
#  2 LYS   HB3   2    LYS   QD    3.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  19,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2=  24,  25,
 &end
#
# 41 ILE   QD1   42   SER   HA    4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 608, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 600, 601, 602,
 &end
#
#  2 LYS   HN    2    LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  24,  25,
 &end
#
#  2 LYS   HN    4    GLN   HN    3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  50, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  2 LYS   HN    2    LYS   HB2   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  18, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  2 LYS   HN    5    PHE   HN    4.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  67, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  2 LYS   HN    2    LYS   QE    4.42 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2=  27,  28,
 &end
#
#  2 LYS   HN    3    ASN   HN    4.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  36, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  2 LYS   HN    2    LYS   HB3   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  19, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 24 GLU   HN    24   GLU   HG2   3.84 
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 355, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  8 PHE   HD    13   VAL   HB    5.17 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 180, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 112, 120,
 &end
#
# 24 GLU   HA    24   GLU   HB3   2.81 
 &rst
  ixpk= 0, nxpk= 0, iat= 350, 353, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
#  5 PHE   HD    17   CYX   HA    4.28 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=  75,  83,
 &end
#
#  5 PHE   HA    5    PHE   HD    3.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  69,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2=  75,  83,
 &end
#
#  5 PHE   HD    20   HIS   QB    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1=  75,  83,
 igr2= 293, 294,
 &end
#
#  5 PHE   HD    20   HIS   HD2   4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1=  75,  83,
 &end
#
#  5 PHE   HB3   5    PHE   HD    2.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2=  75,  83,
 &end
#
#  2 LYS   HA    2    LYS   QD    5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=  24,  25,
 &end
#
#  2 LYS   HA    2    LYS   QE    4.93 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr2=  27,  28,
 &end
#
#  2 LYS   HA    2    LYS   HG2   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  21, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 44 LEU   HA    44   LEU   QQD   4.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 640, 644, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  9 ALA   HN    33   THR   HA    4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 474, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 28 GLY   HN    29   ILE   HB    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 423, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 28 GLY   HN    29   ILE   HN    5.19 
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 419, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 21 CYX   HB3   28   GLY   HN    4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 412, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 27 GLU   HB2   28   GLY   HN    4.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 401, 412, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 27 GLU   HA    28   GLY   HN    2.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 412, r1= 1.30, r2= 1.80, r3= 2.59, r4= 3.09,  &end
#
#  2 LYS   HN    2    LYS   HG2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  21, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 36 LYS   HN    36   LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 528, 529,
 &end
#
# 36 LYS   HA    36   LYS   QD    4.30 
 &rst
  ixpk= 0, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 528, 529,
 &end
#
#  4 GLN   HN    5    PHE   HN    3.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  67, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  5 PHE   HN    5    PHE   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  77,  81,
 &end
#
#  5 PHE   HN    5    PHE   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  77,  81,
 &end
#
#  5 PHE   HN    5    PHE   HD    4.10 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=  75,  83,
 &end
#
#  4 GLN   HA    5    PHE   HN    3.37 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  67, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  3 ASN   QB    4    GLN   HN    3.26 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  50, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=  40,  41,
 &end
#
# 37 CYX   HN    37   CYX   HB3   3.71 
 &rst
  ixpk= 0, nxpk= 0, iat= 540, 545, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 29 ILE   HN    35   CYX   HB3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 513, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 21 CYX   HB3   37   CYX   HB3   4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 545, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 12 ASP   HN    13   VAL   HN    4.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 164, 176, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 11 VAL   HB    12   ASP   HN    4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 164, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 21 CYX   HB3   38   GLY   HN    4.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 550, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 12 ASP   HN    12   ASP   HB2   3.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 164, 168, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 11 VAL   HN    12   ASP   HN    4.75 
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 164, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 41 ILE   HG13  42   SER   HN    3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 598, 606, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 39 VAL   QG2   40   PRO   HD2   3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 567, 568, 569,
 &end
#
# 26 LYS   QG    37   CYX   HB2   4.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 382, 383,
 &end
#
# 26 LYS   QG    26   LYS   QE    3.58 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 382, 383,
 igr2= 388, 389,
 &end
#
# 26 LYS   QB    26   LYS   QG    2.81 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr1= 379, 380,
 igr2= 382, 383,
 &end
#
# 26 LYS   QG    37   CYX   HB3   4.16 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 382, 383,
 &end
#
# 26 LYS   HA    26   LYS   QG    4.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2= 382, 383,
 &end
#
# 26 LYS   HA    26   LYS   QE    4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 388, 389,
 &end
#
# 22 LYS   HA    25   ASP   HA    3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 365, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 18 LYS   QG    22   LYS   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 250, 251,
 &end
#
# 22 LYS   HA    24   GLU   HN    4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 348, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 18 LYS   QD    22   LYS   HA    4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 253, 254,
 &end
#
# 22 LYS   HA    26   LYS   QB    5.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2= 379, 380,
 &end
#
# 14 LYS   HN    14   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 205, 206,
 &end
#
# 14 LYS   HN    14   LYS   HG3   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 200, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 14 LYS   HN    14   LYS   HG2   4.11 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 199, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 13 VAL   HB    14   LYS   HN    3.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 192, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 14 LYS   HN    14   LYS   QB    3.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 196, 197,
 &end
#
# 13 VAL   QG1   14   LYS   HN    4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 182, 183, 184,
 &end
#
# 13 VAL   QG2   14   LYS   HN    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 186, 187, 188,
 &end
#
# 14 LYS   HN    15   GLY   HN    3.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 214, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#  8 PHE   HD    13   VAL   QG2   3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1= 112, 120,
 igr2= 186, 187, 188,
 &end
#
#  8 PHE   HD    33   THR   QG2   3.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 112, 120,
 igr2= 478, 479, 480,
 &end
#
#  8 PHE   HB3   8    PHE   HD    3.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 112, 120,
 &end
#
#  8 PHE   HD    9    ALA   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 124, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 112, 120,
 &end
#
#  8 PHE   HD    9    ALA   QB    3.13 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1= 112, 120,
 igr2= 128, 129, 130,
 &end
#
#  2 LYS   HN    2    LYS   HG3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  22, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 ILE   HN    30   CYX   HN    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 438, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 29 ILE   HN    29   ILE   HB    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 423, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 29 ILE   HN    36   LYS   HA    5.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 520, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
# 28 GLY   HA2   29   ILE   HN    2.93 
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 419, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
# 28 GLY   HA3   29   ILE   HN    3.46 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 419, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
# 29 ILE   HN    31   HIS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 29 ILE   HN    29   ILE   QD1   4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 419,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 432, 433, 434,
 &end
#
# 29 ILE   HN    31   HIS   HD2   4.97 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 461, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 22 LYS   HB2   22   LYS   QE    4.29 
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 329, 330,
 &end
#
# 22 LYS   HB3   22   LYS   QE    5.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr2= 329, 330,
 &end
#
# 34 LYS   HB3   34   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 499, 500,
 &end
#
# 22 LYS   HA    22   LYS   QE    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 329, 330,
 &end
#
# 31 HIS   HD2   36   LYS   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 461, 518, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 31 HIS   HN    31   HIS   HD2   3.92 
 &rst
  ixpk= 0, nxpk= 0, iat= 448, 461, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 31 HIS   HD2   36   LYS   QG    3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 525, 526,
 &end
#
# 29 ILE   QD1   31   HIS   HD2   3.18 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 461, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 432, 433, 434,
 &end
#
# 31 HIS   HD2   36   LYS   HB3   3.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 461, 523, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
# 31 HIS   HD2   36   LYS   QD    4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 528, 529,
 &end
#
# 31 HIS   HA    31   HIS   HD2   4.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 450, 461, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 31 HIS   HD2   36   LYS   HB2   3.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 461, 522, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  8 PHE   HB2   13   VAL   QG2   3.53 
 &rst
  ixpk= 0, nxpk= 0, iat= 108,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 186, 187, 188,
 &end
#
#  7 CYX   HA    13   VAL   QG2   4.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 186, 187, 188,
 &end
#
# 11 VAL   HB    13   VAL   QG2   3.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 186, 187, 188,
 &end
#
# 12 ASP   HA    13   VAL   QG2   4.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 166,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 186, 187, 188,
 &end
#
# 12 ASP   HN    13   VAL   QG2   4.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2= 186, 187, 188,
 &end
#
# 19 ARG   HN    19   ARG   HB2   3.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 269, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  5 PHE   HD    35   CYX   HB2   5.33 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1=  75,  83,
 &end
#
# 21 CYX   HB2   22   LYS   HN    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 316, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 22 LYS   HN    22   LYS   HB2   2.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 320, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,  &end
#
# 22 LYS   HN    26   LYS   HN    4.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 375, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
# 18 LYS   QG    22   LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 250, 251,
 &end
#
# 22 LYS   HN    24   GLU   HN    4.21 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 348, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 21 CYX   HN    22   LYS   HN    2.87 
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 316, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
# 18 LYS   HA    22   LYS   HN    4.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 245, 316, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
# 22 LYS   HN    28   GLY   HA3   5.48 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 415, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
# 22 LYS   HN    22   LYS   HB3   2.80 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 321, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 22 LYS   HN    22   LYS   HA    2.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 318, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 22 LYS   HN    22   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 329, 330,
 &end
#
# 20 HIS   HA    22   LYS   HN    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 316, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 21 CYX   HB3   22   LYS   HN    3.89 
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 316, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 22 LYS   HN    23   ALA   HN    2.88 
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 338, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
# 18 LYS   QD    22   LYS   HN    5.06 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 253, 254,
 &end
#
# 22 LYS   HN    26   LYS   QB    5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 379, 380,
 &end
#
# 19 ARG   HA    19   ARG   HD2   4.99 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 275, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
# 11 VAL   QG1   13   VAL   QG1   2.80 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 154, 155, 156,
 igr2= 182, 183, 184,
 &end
#
# 11 VAL   HA    11   VAL   QG2   2.77 
 &rst
  ixpk= 0, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr2= 158, 159, 160,
 &end
#
# 41 ILE   QG2   41   ILE   HG13  2.68 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 598, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
 igr1= 593, 594, 595,
 &end
#
#  4 GLN   HA    7    CYX   HB2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  98, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 39 VAL   HA    39   VAL   HB    2.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 561, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
# 39 VAL   HA    40   PRO   HD2   2.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 574, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
# 39 VAL   HA    39   VAL   QG1   2.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 563, 564, 565,
 &end
#
# 39 VAL   HA    40   PRO   HD3   2.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 575, r1= 1.30, r2= 1.80, r3= 2.43, r4= 2.93,  &end
#
# 39 VAL   HA    39   VAL   QG2   3.25 
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 567, 568, 569,
 &end
#
# 10 ASN   HN    32   GLY   HN    3.56 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 465, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 10 ASN   HN    33   THR   HN    4.91 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 472, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  9 ALA   HA    10   ASN   HN    3.01 
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 134, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
# 10 ASN   HN    32   GLY   HA2   3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 467, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  9 ALA   HN    10   ASN   HN    2.95 
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 134, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45,  &end
#
# 10 ASN   HN    32   GLY   HA3   4.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 468, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 10 ASN   HN    31   HIS   HA    5.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 450, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 10 ASN   HN    10   ASN   HB2   4.20 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 138, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 10 ASN   HN    10   ASN   HA    2.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 136, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14,  &end
#
# 10 ASN   HN    11   VAL   HN    3.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 134, 148, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  3 ASN   HA    3    ASN   HD22  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  38,  46, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  3 ASN   HN    3    ASN   HD22  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  36,  46, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  1 ALA   QB    2    LYS   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  14, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=   8,   9,  10,
 &end
#
# 18 LYS   HN    18   LYS   QG    4.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 250, 251,
 &end
#
# 17 CYX   HN    18   LYS   HN    3.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 233, 243, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 16 ASP   QB    18   LYS   HN    5.43 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 225, 226,
 &end
#
# 17 CYX   HB3   18   LYS   HN    4.45 
 &rst
  ixpk= 0, nxpk= 0, iat= 238, 243, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 16 ASP   HA    18   LYS   HN    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 243, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 18 LYS   HN    18   LYS   HB3   3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 248, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 18 LYS   HN    18   LYS   HB2   3.26 
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 247, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 18 LYS   HN    18   LYS   QD    4.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 253, 254,
 &end
#
# 18 LYS   HN    18   LYS   QE    5.12 
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 256, 257,
 &end
#
# 18 LYS   HN    19   ARG   HN    3.86 
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 265, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 29 ILE   HN    29   ILE   HG12  4.64 
 &rst
  ixpk= 0, nxpk= 0, iat= 419, 429, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  7 CYX   HB3   30   CYX   QB    3.01 
 &rst
  ixpk= 0, nxpk= 0, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 442, 443,
 &end
#
# 30 CYX   HN    30   CYX   QB    2.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 438,  -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
 igr2= 442, 443,
 &end
#
#  7 CYX   HA    30   CYX   QB    4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  96,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 442, 443,
 &end
#
# 30 CYX   QB    31   HIS   HN    3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 448, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr1= 442, 443,
 &end
#
#  7 CYX   HB2   30   CYX   QB    3.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  98,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 442, 443,
 &end
#
# 10 ASN   HN    30   CYX   QB    4.05 
 &rst
  ixpk= 0, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 442, 443,
 &end
#
# 10 ASN   HA    30   CYX   QB    3.18 
 &rst
  ixpk= 0, nxpk= 0, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 442, 443,
 &end
#
# 11 VAL   HN    30   CYX   QB    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr2= 442, 443,
 &end
#
# 19 ARG   HA    23   ALA   HN    4.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 338, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 23 ALA   HN    23   ALA   QB    2.42 
 &rst
  ixpk= 0, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,
 igr2= 342, 343, 344,
 &end
#
#  8 PHE   HD    13   VAL   QG1   4.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 112, 120,
 igr2= 182, 183, 184,
 &end
#
# 21 CYX   HN    23   ALA   HN    4.28 
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 338, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
# 21 CYX   HA    23   ALA   HN    4.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 338, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  8 PHE   HA    8    PHE   HD    3.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 112, 120,
 &end
#
# 22 LYS   HB3   23   ALA   HN    3.35 
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  4 GLN   HN    4    GLN   HE21  5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  62, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  4 GLN   HG3   4    GLN   HE21  3.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  62, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
# 10 ASN   HA    31   HIS   HA    4.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 450, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 44 LEU   HN    44   LEU   HG    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 645, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 44 LEU   HN    44   LEU   QQD   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 638, 644, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 43 TYR   HN    44   LEU   HN    4.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 617, 638, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  5 PHE   HB2   7    CYX   HA    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  96, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 PHE   HB2   5    PHE   HE    4.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  71,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2=  77,  81,
 &end
#
#  5 PHE   HE    34   LYS   QE    5.35 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=  77,  81,
 igr2= 499, 500,
 &end
#
#  5 PHE   HZ    34   LYS   QE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 499, 500,
 &end
#
#  5 PHE   HN    5    PHE   HB2   3.62 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  71, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
# 16 ASP   QB    18   LYS   QD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 225, 226,
 igr2= 253, 254,
 &end
#
# 18 LYS   HB3   18   LYS   QD    3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 253, 254,
 &end
#
# 18 LYS   HB2   18   LYS   QD    3.69 
 &rst
  ixpk= 0, nxpk= 0, iat= 247,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 253, 254,
 &end
#
# 18 LYS   QD    22   LYS   HB3   4.14 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 253, 254,
 &end
#
# 18 LYS   QD    22   LYS   QE    4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 253, 254,
 igr2= 329, 330,
 &end
#
#  8 PHE   HB2   33   THR   HA    4.43 
 &rst
  ixpk= 0, nxpk= 0, iat= 108, 474, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  7 CYX   HA    11   VAL   HN    4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  96, 148, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
# 11 VAL   HN    11   VAL   QG1   4.06 
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 154, 155, 156,
 &end
#
# 11 VAL   HN    11   VAL   HB    3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 152, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
# 11 VAL   HN    11   VAL   QG2   3.10 
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 158, 159, 160,
 &end
#
#  8 PHE   HN    15   GLY   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  8 PHE   HE    33   THR   QG2   3.77 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 114, 118,
 igr2= 478, 479, 480,
 &end
#
#  8 PHE   HB3   8    PHE   HE    4.70 
 &rst
  ixpk= 0, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 114, 118,
 &end
#
#  8 PHE   HB2   8    PHE   HE    4.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 108,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 114, 118,
 &end
#
#  8 PHE   HE    9    ALA   QB    3.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 114, 118,
 igr2= 128, 129, 130,
 &end
#
# 22 LYS   HB3   22   LYS   HD2   4.22 
 &rst
  ixpk= 0, nxpk= 0, iat= 321, 326, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 41 ILE   HA    41   ILE   QD1   3.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 600, 601, 602,
 &end
#
# 41 ILE   HA    41   ILE   HG13  3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 589, 598, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 41 ILE   HA    41   ILE   QG2   3.74 
 &rst
  ixpk= 0, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 593, 594, 595,
 &end
#
# 27 GLU   HA    28   GLY   HA3   4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 415, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 28 GLY   HA3   29   ILE   HA    5.14 
 &rst
  ixpk= 0, nxpk= 0, iat= 415, 421, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 17 CYX   HA    20   HIS   HN    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 289, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 20 HIS   HN    21   CYX   HN    2.96 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 306, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 19 ARG   HB2   20   HIS   HN    3.98 
 &rst
  ixpk= 0, nxpk= 0, iat= 269, 289, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
# 20 HIS   HN    22   LYS   HN    4.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 289, 316, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 19 ARG   HN    20   HIS   HN    3.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 289, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  4 GLN   HE22  6    GLY   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  87, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 PHE   HD    6    GLY   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  87, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  75,  83,
 &end
#
#  5 PHE   HA    5    PHE   HD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  69,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  75,  83,
 &end
#
#  5 PHE   HD    35   CYX   HB3   3.70 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr1=  75,  83,
 &end
#
#  4 GLN   HE22  7    CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  63,  94, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 PHE   HD    7    CYX   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  75,  83,
 &end
#
#  5 PHE   HN    5    PHE   HD    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  75,  83,
 &end
#
#  5 PHE   HD    35   CYX   HB2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  75,  83,
 &end
#
# 22 LYS   HA    41   ILE   QG2   3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 593, 594, 595,
 &end
#
# 27 GLU   HA    41   ILE   QG2   4.24 
 &rst
  ixpk= 0, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 593, 594, 595,
 &end
#
# 27 GLU   HB3   28   GLY   HN    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 412, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 27 GLU   HB3   39   VAL   HN    4.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 557, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  4 GLN   HA    4    GLN   HG2   3.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  57, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#  4 GLN   HA    4    GLN   HE21  5.24 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  62, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  4 GLN   HA    4    GLN   HG3   3.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  52,  58, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 36 LYS   HB2   37   CYX   HN    4.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 522, 540, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 19 ARG   HB2   19   ARG   QG    2.94 
 &rst
  ixpk= 0, nxpk= 0, iat= 269,  -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
 igr2= 272, 273,
 &end
#
# 19 ARG   HN    19   ARG   HE    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 278, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 17 CYX   HA    19   ARG   HN    4.13 
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 265, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
# 18 LYS   QG    19   ARG   HN    5.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 265, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 250, 251,
 &end
#
# 19 ARG   HN    19   ARG   HD3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 19 ARG   HN    19   ARG   HD2   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 275, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  5 PHE   HB3   17   CYX   HA    3.55 
 &rst
  ixpk= 0, nxpk= 0, iat=  72, 235, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  5 PHE   HB3   6    GLY   HN    5.12 
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  87, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  5 PHE   HB3   5    PHE   HE    4.88 
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2=  77,  81,
 &end
#
#  5 PHE   HB3   20   HIS   HD2   4.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  72, 302, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  5 PHE   HN    5    PHE   HB3   4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  67,  72, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  5 PHE   HB3   35   CYX   HB2   3.50 
 &rst
  ixpk= 0, nxpk= 0, iat=  72, 512, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 24 GLU   HB2   26   LYS   HN    4.57 
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 375, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
# 27 GLU   HA    38   GLY   HA3   5.50 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 553, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  9 ALA   QB    10   ASN   HN    3.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 128, 129, 130,
 &end
#
#  9 ALA   QB    11   VAL   HN    4.11 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 128, 129, 130,
 &end
#
# 39 VAL   HN    39   VAL   HB    3.68 
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 561, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 39 VAL   HN    40   PRO   HD2   4.79 
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 574, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 38 GLY   HA2   39   VAL   HN    3.16 
 &rst
  ixpk= 0, nxpk= 0, iat= 552, 557, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
# 39 VAL   HN    39   VAL   QG1   2.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 563, 564, 565,
 &end
#
# 38 GLY   HN    39   VAL   HN    4.32 
 &rst
  ixpk= 0, nxpk= 0, iat= 550, 557, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 39 VAL   HN    39   VAL   QG2   2.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2= 567, 568, 569,
 &end
#
# 38 GLY   HA3   39   VAL   HN    2.65 
 &rst
  ixpk= 0, nxpk= 0, iat= 553, 557, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
#  2 LYS   HN    2    LYS   QB    3.69 
 &rst
  ixpk= 0, nxpk= 0, iat=  14,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2=  18,  19,
 &end
#
#  2 LYS   HA    2    LYS   QG    3.40 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr2=  21,  22,
 &end
#
#  2 LYS   QB    2    LYS   QD    2.44 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,
 igr1=  18,  19,
 igr2=  24,  25,
 &end
#
#  2 LYS   QB    2    LYS   QE    3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1=  18,  19,
 igr2=  27,  28,
 &end
#
#  2 LYS   QG    2    LYS   QE    3.41 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1=  21,  22,
 igr2=  27,  28,
 &end
#
#  2 LYS   QG    3    ASN   QD2   4.03 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=  21,  22,
 igr2=  45,  46,
 &end
#
#  3 ASN   HA    3    ASN   QD2   4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  38,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr2=  45,  46,
 &end
#
#  3 ASN   QB    3    ASN   QD2   3.36 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=  40,  41,
 igr2=  45,  46,
 &end
#
#  4 GLN   HN    4    GLN   QB    3.38 
 &rst
  ixpk= 0, nxpk= 0, iat=  50,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=  54,  55,
 &end
#
#  4 GLN   QB    4    GLN   HE21  4.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  62, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=  54,  55,
 &end
#
#  4 GLN   HG3   6    GLY   QA    3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2=  89,  90,
 &end
#
#  7 CYX   HN    17   CYX   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 237, 238,
 &end
#
# 10 ASN   HN    10   ASN   QB    3.66 
 &rst
  ixpk= 0, nxpk= 0, iat= 134,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 138, 139,
 &end
#
# 10 ASN   QB    10   ASN   HD21  2.79 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 143, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr1= 138, 139,
 &end
#
# 10 ASN   QB    10   ASN   HD22  3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 138, 139,
 &end
#
# 10 ASN   QB    32   GLY   HN    4.95 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 138, 139,
 &end
#
# 12 ASP   HN    12   ASP   QB    3.09 
 &rst
  ixpk= 0, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr2= 168, 169,
 &end
#
# 13 VAL   HB    14   LYS   QG    3.90 
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 199, 200,
 &end
#
# 14 LYS   HN    14   LYS   QG    3.60 
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 199, 200,
 &end
#
# 14 LYS   HN    14   LYS   QD    4.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2= 202, 203,
 &end
#
# 14 LYS   HA    14   LYS   QD    4.07 
 &rst
  ixpk= 0, nxpk= 0, iat= 194,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr2= 202, 203,
 &end
#
# 14 LYS   QB    14   LYS   QD    2.87 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,
 igr1= 196, 197,
 igr2= 202, 203,
 &end
#
# 16 ASP   QB    18   LYS   QB    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 225, 226,
 igr2= 247, 248,
 &end
#
# 17 CYX   HN    17   CYX   QB    3.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 237, 238,
 &end
#
# 17 CYX   HA    19   ARG   QB    4.72 
 &rst
  ixpk= 0, nxpk= 0, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 269, 270,
 &end
#
# 17 CYX   QB    18   LYS   HN    3.83 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 237, 238,
 &end
#
# 17 CYX   QB    19   ARG   HN    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 265, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 237, 238,
 &end
#
# 17 CYX   QB    35   CYX   HB2   3.99 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 237, 238,
 &end
#
# 18 LYS   HN    18   LYS   QB    2.83 
 &rst
  ixpk= 0, nxpk= 0, iat= 243,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2= 247, 248,
 &end
#
# 18 LYS   QB    18   LYS   QD    2.91 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr1= 247, 248,
 igr2= 253, 254,
 &end
#
# 18 LYS   QB    18   LYS   QE    3.54 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 247, 248,
 igr2= 256, 257,
 &end
#
# 18 LYS   QB    19   ARG   HN    4.22 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 265, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 247, 248,
 &end
#
# 19 ARG   HN    19   ARG   QB    3.15 
 &rst
  ixpk= 0, nxpk= 0, iat= 265,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2= 269, 270,
 &end
#
# 19 ARG   HA    19   ARG   QD    4.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 267,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 275, 276,
 &end
#
# 19 ARG   QB    19   ARG   QD    2.92 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr1= 269, 270,
 igr2= 275, 276,
 &end
#
# 19 ARG   QB    19   ARG   HE    3.49 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 278, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 269, 270,
 &end
#
# 19 ARG   QB    20   HIS   HN    3.21 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 289, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr1= 269, 270,
 &end
#
# 19 ARG   QB    20   HIS   QB    5.32 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr1= 269, 270,
 igr2= 293, 294,
 &end
#
# 22 LYS   HN    22   LYS   QG    4.31 
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 323, 324,
 &end
#
# 22 LYS   HN    22   LYS   QD    5.34 
 &rst
  ixpk= 0, nxpk= 0, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 326, 327,
 &end
#
# 22 LYS   HA    22   LYS   QG    3.54 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 323, 324,
 &end
#
# 22 LYS   HA    22   LYS   QD    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 326, 327,
 &end
#
# 22 LYS   HB2   22   LYS   QD    3.67 
 &rst
  ixpk= 0, nxpk= 0, iat= 320,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 326, 327,
 &end
#
# 23 ALA   HN    24   GLU   QG    4.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 355, 356,
 &end
#
# 23 ALA   QB    24   GLU   QG    3.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 342, 343, 344,
 igr2= 355, 356,
 &end
#
# 24 GLU   HN    24   GLU   QG    3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 348,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 355, 356,
 &end
#
# 24 GLU   HA    24   GLU   QG    3.44 
 &rst
  ixpk= 0, nxpk= 0, iat= 350,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 355, 356,
 &end
#
# 24 GLU   QG    25   ASP   HN    5.19 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 363, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr1= 355, 356,
 &end
#
# 27 GLU   HN    27   GLU   QG    3.85 
 &rst
  ixpk= 0, nxpk= 0, iat= 397,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 404, 405,
 &end
#
# 27 GLU   HA    27   GLU   QG    2.76 
 &rst
  ixpk= 0, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
 igr2= 404, 405,
 &end
#
# 27 GLU   QG    28   GLY   HN    4.78 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 412, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 404, 405,
 &end
#
# 27 GLU   QG    41   ILE   HA    4.39 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 589, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 404, 405,
 &end
#
# 31 HIS   HN    31   HIS   QB    3.47 
 &rst
  ixpk= 0, nxpk= 0, iat= 448,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 452, 453,
 &end
#
# 31 HIS   HD2   36   LYS   QB    2.73 
 &rst
  ixpk= 0, nxpk= 0, iat= 461,  -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
 igr2= 522, 523,
 &end
#
# 34 LYS   HN    34   LYS   QD    4.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 496, 497,
 &end
#
# 34 LYS   HA    34   LYS   QD    3.61 
 &rst
  ixpk= 0, nxpk= 0, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 496, 497,
 &end
#
# 34 LYS   HB3   34   LYS   QD    3.59 
 &rst
  ixpk= 0, nxpk= 0, iat= 491,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 496, 497,
 &end
#
# 34 LYS   HG3   34   LYS   QD    2.51 
 &rst
  ixpk= 0, nxpk= 0, iat= 494,  -1, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,
 igr2= 496, 497,
 &end
#
# 34 LYS   QD    35   CYX   HN    4.08 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 496, 497,
 &end
#
# 36 LYS   QB    36   LYS   QD    2.75 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 522, 523,
 igr2= 528, 529,
 &end
#
# 36 LYS   QB    36   LYS   QE    4.20 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 522, 523,
 igr2= 531, 532,
 &end
#
# 39 VAL   HA    40   PRO   QG    4.40 
 &rst
  ixpk= 0, nxpk= 0, iat= 559,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 577, 578,
 &end
#
# 40 PRO   QB    41   ILE   HN    3.64 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 580, 581,
 &end
#
# 42 SER   HN    42   SER   QB    3.04 
 &rst
  ixpk= 0, nxpk= 0, iat= 606,  -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
 igr2= 610, 611,
 &end
#
# 42 SER   HA    42   SER   QB    2.62 
 &rst
  ixpk= 0, nxpk= 0, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,
 igr2= 610, 611,
 &end
#
# 42 SER   QB    43   TYR   HN    3.82 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 617, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 610, 611,
 &end
#
# 43 TYR   HN    43   TYR   QB    3.23 
 &rst
  ixpk= 0, nxpk= 0, iat= 617,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 621, 622,
 &end
#
# 43 TYR   QB    43   TYR   HE    4.71 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 621, 622,
 igr2= 627, 632,
 &end
#
# 43 TYR   QB    43   TYR   HD    3.27 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1= 621, 622,
 igr2= 625, 634,
 &end
#
# 43 TYR   QB    44   LEU   HN    4.31 
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 638, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 621, 622,
 &end
# 656 atoms read from pdb file protein.amb.pdb.
# 1 ALA PSI:  (1 ALA N)-(1 ALA CA)-(1 ALA C)-(2 LYS N) -75.0 185.0
 &rst     iat =     1,     5,    11,    13,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	  rk2 =   2.0, rk3 =   2.0,				&end

# 1 ALA PSI:  (1 ALA N)-(1 ALA CA)-(1 ALA C)-(2 LYS N)  25.0  55.0
 &rst     iat =     1,     5,    11,    13,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 1 ALA PSI:  (1 ALA N)-(1 ALA CA)-(1 ALA C)-(2 LYS N) 105.0 185.0
 &rst     iat =     1,     5,    11,    13,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 2 LYS PHI:  (1 ALA C)-(2 LYS N)-(2 LYS CA)-(2 LYS C) -175.0  75.0
 &rst     iat =    11,    13,    15,    33,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 2 LYS PSI:  (2 LYS N)-(2 LYS CA)-(2 LYS C)-(3 ASN N) -75.0 185.0
 &rst     iat =    13,    15,    33,    35,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 2 LYS PHI:  (1 ALA C)-(2 LYS N)-(2 LYS CA)-(2 LYS C) -255.0 -25.0
 &rst     iat =    11,    13,    15,    33,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 2 LYS PSI:  (2 LYS N)-(2 LYS CA)-(2 LYS C)-(3 ASN N)  25.0  55.0
 &rst     iat =    13,    15,    33,    35,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 2 LYS PHI:  (1 ALA C)-(2 LYS N)-(2 LYS CA)-(2 LYS C) -135.0  75.0
 &rst     iat =    11,    13,    15,    33,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 2 LYS PSI:  (2 LYS N)-(2 LYS CA)-(2 LYS C)-(3 ASN N) 105.0 185.0
 &rst     iat =    13,    15,    33,    35,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 3 ASN PHI:  (2 LYS C)-(3 ASN N)-(3 ASN CA)-(3 ASN C) -175.0  75.0
 &rst     iat =    33,    35,    37,    47,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 3 ASN PSI:  (3 ASN N)-(3 ASN CA)-(3 ASN C)-(4 GLN N) -75.0 185.0
 &rst     iat =    35,    37,    47,    49,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 3 ASN PHI:  (2 LYS C)-(3 ASN N)-(3 ASN CA)-(3 ASN C) -255.0 -25.0
 &rst     iat =    33,    35,    37,    47,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 3 ASN PSI:  (3 ASN N)-(3 ASN CA)-(3 ASN C)-(4 GLN N)  25.0  55.0
 &rst     iat =    35,    37,    47,    49,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 3 ASN PHI:  (2 LYS C)-(3 ASN N)-(3 ASN CA)-(3 ASN C) -135.0  75.0
 &rst     iat =    33,    35,    37,    47,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 3 ASN PSI:  (3 ASN N)-(3 ASN CA)-(3 ASN C)-(4 GLN N) 105.0 185.0
 &rst     iat =    35,    37,    47,    49,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 4 GLN PHI:  (3 ASN C)-(4 GLN N)-(4 GLN CA)-(4 GLN C) -175.0  75.0
 &rst     iat =    47,    49,    51,    64,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 4 GLN PSI:  (4 GLN N)-(4 GLN CA)-(4 GLN C)-(5 PHE N) -75.0 185.0
 &rst     iat =    49,    51,    64,    66,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 4 GLN PHI:  (3 ASN C)-(4 GLN N)-(4 GLN CA)-(4 GLN C) -255.0 -25.0
 &rst     iat =    47,    49,    51,    64,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 4 GLN PSI:  (4 GLN N)-(4 GLN CA)-(4 GLN C)-(5 PHE N)  25.0  55.0
 &rst     iat =    49,    51,    64,    66,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 4 GLN PHI:  (3 ASN C)-(4 GLN N)-(4 GLN CA)-(4 GLN C) -135.0  75.0
 &rst     iat =    47,    49,    51,    64,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 4 GLN PSI:  (4 GLN N)-(4 GLN CA)-(4 GLN C)-(5 PHE N) 105.0 185.0
 &rst     iat =    49,    51,    64,    66,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 5 PHE PHI:  (4 GLN C)-(5 PHE N)-(5 PHE CA)-(5 PHE C) -175.0  75.0
 &rst     iat =    64,    66,    68,    84,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 5 PHE PSI:  (5 PHE N)-(5 PHE CA)-(5 PHE C)-(6 GLY N) -75.0 185.0
 &rst     iat =    66,    68,    84,    86,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 5 PHE PHI:  (4 GLN C)-(5 PHE N)-(5 PHE CA)-(5 PHE C) -255.0 -25.0
 &rst     iat =    64,    66,    68,    84,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 5 PHE PSI:  (5 PHE N)-(5 PHE CA)-(5 PHE C)-(6 GLY N)  25.0  55.0
 &rst     iat =    66,    68,    84,    86,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 5 PHE PHI:  (4 GLN C)-(5 PHE N)-(5 PHE CA)-(5 PHE C) -135.0  75.0
 &rst     iat =    64,    66,    68,    84,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 5 PHE PSI:  (5 PHE N)-(5 PHE CA)-(5 PHE C)-(6 GLY N) 105.0 185.0
 &rst     iat =    66,    68,    84,    86,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 7 CYS PHI:  (6 GLY C)-(7 CYX N)-(7 CYX CA)-(7 CYX C) -175.0  75.0
 &rst     iat =    91,    93,    95,   101,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 7 CYS PSI:  (7 CYX N)-(7 CYX CA)-(7 CYX C)-(8 PHE N) -75.0 185.0
 &rst     iat =    93,    95,   101,   103,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 7 CYS PHI:  (6 GLY C)-(7 CYX N)-(7 CYX CA)-(7 CYX C) -255.0 -25.0
 &rst     iat =    91,    93,    95,   101,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 7 CYS PSI:  (7 CYX N)-(7 CYX CA)-(7 CYX C)-(8 PHE N)  25.0  55.0
 &rst     iat =    93,    95,   101,   103,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 7 CYS PHI:  (6 GLY C)-(7 CYX N)-(7 CYX CA)-(7 CYX C) -135.0  75.0
 &rst     iat =    91,    93,    95,   101,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 7 CYS PSI:  (7 CYX N)-(7 CYX CA)-(7 CYX C)-(8 PHE N) 105.0 185.0
 &rst     iat =    93,    95,   101,   103,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 8 PHE PHI:  (7 CYX C)-(8 PHE N)-(8 PHE CA)-(8 PHE C) -175.0  75.0
 &rst     iat =   101,   103,   105,   121,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 8 PHE PSI:  (8 PHE N)-(8 PHE CA)-(8 PHE C)-(9 ALA N) -75.0 185.0
 &rst     iat =   103,   105,   121,   123,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 8 PHE PHI:  (7 CYX C)-(8 PHE N)-(8 PHE CA)-(8 PHE C) -255.0 -25.0
 &rst     iat =   101,   103,   105,   121,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 8 PHE PSI:  (8 PHE N)-(8 PHE CA)-(8 PHE C)-(9 ALA N)  25.0  55.0
 &rst     iat =   103,   105,   121,   123,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 8 PHE PHI:  (7 CYX C)-(8 PHE N)-(8 PHE CA)-(8 PHE C) -135.0  75.0
 &rst     iat =   101,   103,   105,   121,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 8 PHE PSI:  (8 PHE N)-(8 PHE CA)-(8 PHE C)-(9 ALA N) 105.0 185.0
 &rst     iat =   103,   105,   121,   123,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 9 ALA PHI:  (8 PHE C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -175.0  75.0
 &rst     iat =   121,   123,   125,   131,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 ASN N) -75.0 185.0
 &rst     iat =   123,   125,   131,   133,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 9 ALA PHI:  (8 PHE C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -255.0 -25.0
 &rst     iat =   121,   123,   125,   131,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 ASN N)  25.0  55.0
 &rst     iat =   123,   125,   131,   133,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 9 ALA PHI:  (8 PHE C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -135.0  75.0
 &rst     iat =   121,   123,   125,   131,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 ASN N) 105.0 185.0
 &rst     iat =   123,   125,   131,   133,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 10 ASN PHI:  (9 ALA C)-(10 ASN N)-(10 ASN CA)-(10 ASN C) -175.0  75.0
 &rst     iat =   131,   133,   135,   145,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 10 ASN PSI:  (10 ASN N)-(10 ASN CA)-(10 ASN C)-(11 VAL N) -75.0 185.0
 &rst     iat =   133,   135,   145,   147,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 10 ASN PHI:  (9 ALA C)-(10 ASN N)-(10 ASN CA)-(10 ASN C) -255.0 -25.0
 &rst     iat =   131,   133,   135,   145,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 10 ASN PSI:  (10 ASN N)-(10 ASN CA)-(10 ASN C)-(11 VAL N)  25.0  55.0
 &rst     iat =   133,   135,   145,   147,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 10 ASN PHI:  (9 ALA C)-(10 ASN N)-(10 ASN CA)-(10 ASN C) -135.0  75.0
 &rst     iat =   131,   133,   135,   145,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 10 ASN PSI:  (10 ASN N)-(10 ASN CA)-(10 ASN C)-(11 VAL N) 105.0 185.0
 &rst     iat =   133,   135,   145,   147,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 11 VAL PHI:  (10 ASN C)-(11 VAL N)-(11 VAL CA)-(11 VAL C) -175.0  75.0
 &rst     iat =   145,   147,   149,   161,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 11 VAL PSI:  (11 VAL N)-(11 VAL CA)-(11 VAL C)-(12 ASP N) -75.0 185.0
 &rst     iat =   147,   149,   161,   163,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 11 VAL PHI:  (10 ASN C)-(11 VAL N)-(11 VAL CA)-(11 VAL C) -255.0 -25.0
 &rst     iat =   145,   147,   149,   161,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 11 VAL PSI:  (11 VAL N)-(11 VAL CA)-(11 VAL C)-(12 ASP N)  25.0  55.0
 &rst     iat =   147,   149,   161,   163,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 11 VAL PHI:  (10 ASN C)-(11 VAL N)-(11 VAL CA)-(11 VAL C) -135.0  75.0
 &rst     iat =   145,   147,   149,   161,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 11 VAL PSI:  (11 VAL N)-(11 VAL CA)-(11 VAL C)-(12 ASP N) 105.0 185.0
 &rst     iat =   147,   149,   161,   163,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 12 ASP PHI:  (11 VAL C)-(12 ASP N)-(12 ASP CA)-(12 ASP C) -175.0  75.0
 &rst     iat =   161,   163,   165,   173,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 12 ASP PSI:  (12 ASP N)-(12 ASP CA)-(12 ASP C)-(13 VAL N) -75.0 185.0
 &rst     iat =   163,   165,   173,   175,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 12 ASP PHI:  (11 VAL C)-(12 ASP N)-(12 ASP CA)-(12 ASP C) -255.0 -25.0
 &rst     iat =   161,   163,   165,   173,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 12 ASP PSI:  (12 ASP N)-(12 ASP CA)-(12 ASP C)-(13 VAL N)  25.0  55.0
 &rst     iat =   163,   165,   173,   175,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 12 ASP PHI:  (11 VAL C)-(12 ASP N)-(12 ASP CA)-(12 ASP C) -135.0  75.0
 &rst     iat =   161,   163,   165,   173,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 12 ASP PSI:  (12 ASP N)-(12 ASP CA)-(12 ASP C)-(13 VAL N) 105.0 185.0
 &rst     iat =   163,   165,   173,   175,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 13 VAL PHI:  (12 ASP C)-(13 VAL N)-(13 VAL CA)-(13 VAL C) -175.0  75.0
 &rst     iat =   173,   175,   177,   189,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 13 VAL PSI:  (13 VAL N)-(13 VAL CA)-(13 VAL C)-(14 LYS N) -75.0 185.0
 &rst     iat =   175,   177,   189,   191,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 13 VAL PHI:  (12 ASP C)-(13 VAL N)-(13 VAL CA)-(13 VAL C) -255.0 -25.0
 &rst     iat =   173,   175,   177,   189,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 13 VAL PSI:  (13 VAL N)-(13 VAL CA)-(13 VAL C)-(14 LYS N)  25.0  55.0
 &rst     iat =   175,   177,   189,   191,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 13 VAL PHI:  (12 ASP C)-(13 VAL N)-(13 VAL CA)-(13 VAL C) -135.0  75.0
 &rst     iat =   173,   175,   177,   189,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 13 VAL PSI:  (13 VAL N)-(13 VAL CA)-(13 VAL C)-(14 LYS N) 105.0 185.0
 &rst     iat =   175,   177,   189,   191,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 14 LYS PHI:  (13 VAL C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -175.0  75.0
 &rst     iat =   189,   191,   193,   211,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 GLY N) -75.0 185.0
 &rst     iat =   191,   193,   211,   213,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 14 LYS PHI:  (13 VAL C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -255.0 -25.0
 &rst     iat =   189,   191,   193,   211,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 GLY N)  25.0  55.0
 &rst     iat =   191,   193,   211,   213,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 14 LYS PHI:  (13 VAL C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -135.0  75.0
 &rst     iat =   189,   191,   193,   211,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 GLY N) 105.0 185.0
 &rst     iat =   191,   193,   211,   213,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 16 ASP PHI:  (15 GLY C)-(16 ASP N)-(16 ASP CA)-(16 ASP C) -175.0  75.0
 &rst     iat =   218,   220,   222,   230,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 16 ASP PSI:  (16 ASP N)-(16 ASP CA)-(16 ASP C)-(17 CYX N) -75.0 185.0
 &rst     iat =   220,   222,   230,   232,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 16 ASP PHI:  (15 GLY C)-(16 ASP N)-(16 ASP CA)-(16 ASP C) -255.0 -25.0
 &rst     iat =   218,   220,   222,   230,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 16 ASP PSI:  (16 ASP N)-(16 ASP CA)-(16 ASP C)-(17 CYX N)  25.0  55.0
 &rst     iat =   220,   222,   230,   232,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 16 ASP PHI:  (15 GLY C)-(16 ASP N)-(16 ASP CA)-(16 ASP C) -135.0  75.0
 &rst     iat =   218,   220,   222,   230,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 16 ASP PSI:  (16 ASP N)-(16 ASP CA)-(16 ASP C)-(17 CYX N) 105.0 185.0
 &rst     iat =   220,   222,   230,   232,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 17 CYS PHI:  (16 ASP C)-(17 CYX N)-(17 CYX CA)-(17 CYX C) -175.0  75.0
 &rst     iat =   230,   232,   234,   240,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 17 CYS PSI:  (17 CYX N)-(17 CYX CA)-(17 CYX C)-(18 LYS N) -75.0 185.0
 &rst     iat =   232,   234,   240,   242,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 17 CYS PHI:  (16 ASP C)-(17 CYX N)-(17 CYX CA)-(17 CYX C) -255.0 -25.0
 &rst     iat =   230,   232,   234,   240,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 17 CYS PSI:  (17 CYX N)-(17 CYX CA)-(17 CYX C)-(18 LYS N)  25.0  55.0
 &rst     iat =   232,   234,   240,   242,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 17 CYS PHI:  (16 ASP C)-(17 CYX N)-(17 CYX CA)-(17 CYX C) -135.0  75.0
 &rst     iat =   230,   232,   234,   240,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 17 CYS PSI:  (17 CYX N)-(17 CYX CA)-(17 CYX C)-(18 LYS N) 105.0 185.0
 &rst     iat =   232,   234,   240,   242,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 18 LYS PHI:  (17 CYX C)-(18 LYS N)-(18 LYS CA)-(18 LYS C) -175.0  75.0
 &rst     iat =   240,   242,   244,   262,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 18 LYS PSI:  (18 LYS N)-(18 LYS CA)-(18 LYS C)-(19 ARG N) -75.0 185.0
 &rst     iat =   242,   244,   262,   264,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 18 LYS PHI:  (17 CYX C)-(18 LYS N)-(18 LYS CA)-(18 LYS C) -255.0 -25.0
 &rst     iat =   240,   242,   244,   262,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 18 LYS PSI:  (18 LYS N)-(18 LYS CA)-(18 LYS C)-(19 ARG N)  25.0  55.0
 &rst     iat =   242,   244,   262,   264,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 18 LYS PHI:  (17 CYX C)-(18 LYS N)-(18 LYS CA)-(18 LYS C) -135.0  75.0
 &rst     iat =   240,   242,   244,   262,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 18 LYS PSI:  (18 LYS N)-(18 LYS CA)-(18 LYS C)-(19 ARG N) 105.0 185.0
 &rst     iat =   242,   244,   262,   264,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 19 ARG PHI:  (18 LYS C)-(19 ARG N)-(19 ARG CA)-(19 ARG C) -175.0  75.0
 &rst     iat =   262,   264,   266,   286,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 19 ARG PSI:  (19 ARG N)-(19 ARG CA)-(19 ARG C)-(20 HIE N) -75.0 185.0
 &rst     iat =   264,   266,   286,   288,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 19 ARG PHI:  (18 LYS C)-(19 ARG N)-(19 ARG CA)-(19 ARG C) -255.0 -25.0
 &rst     iat =   262,   264,   266,   286,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 19 ARG PSI:  (19 ARG N)-(19 ARG CA)-(19 ARG C)-(20 HIE N)  25.0  55.0
 &rst     iat =   264,   266,   286,   288,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 19 ARG PHI:  (18 LYS C)-(19 ARG N)-(19 ARG CA)-(19 ARG C) -135.0  75.0
 &rst     iat =   262,   264,   266,   286,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 19 ARG PSI:  (19 ARG N)-(19 ARG CA)-(19 ARG C)-(20 HIE N) 105.0 185.0
 &rst     iat =   264,   266,   286,   288,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 20 HIS PHI:  (19 ARG C)-(20 HIE N)-(20 HIE CA)-(20 HIE C) -175.0  75.0
 &rst     iat =   286,   288,   290,   303,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 20 HIS PSI:  (20 HIE N)-(20 HIE CA)-(20 HIE C)-(21 CYX N) -75.0 185.0
 &rst     iat =   288,   290,   303,   305,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 20 HIS PHI:  (19 ARG C)-(20 HIE N)-(20 HIE CA)-(20 HIE C) -255.0 -25.0
 &rst     iat =   286,   288,   290,   303,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 20 HIS PSI:  (20 HIE N)-(20 HIE CA)-(20 HIE C)-(21 CYX N)  25.0  55.0
 &rst     iat =   288,   290,   303,   305,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 20 HIS PHI:  (19 ARG C)-(20 HIE N)-(20 HIE CA)-(20 HIE C) -135.0  75.0
 &rst     iat =   286,   288,   290,   303,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 20 HIS PSI:  (20 HIE N)-(20 HIE CA)-(20 HIE C)-(21 CYX N) 105.0 185.0
 &rst     iat =   288,   290,   303,   305,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 21 CYS PHI:  (20 HIE C)-(21 CYX N)-(21 CYX CA)-(21 CYX C) -175.0  75.0
 &rst     iat =   303,   305,   307,   313,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 21 CYS PSI:  (21 CYX N)-(21 CYX CA)-(21 CYX C)-(22 LYS N) -75.0 185.0
 &rst     iat =   305,   307,   313,   315,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 21 CYS PHI:  (20 HIE C)-(21 CYX N)-(21 CYX CA)-(21 CYX C) -255.0 -25.0
 &rst     iat =   303,   305,   307,   313,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 21 CYS PSI:  (21 CYX N)-(21 CYX CA)-(21 CYX C)-(22 LYS N)  25.0  55.0
 &rst     iat =   305,   307,   313,   315,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 21 CYS PHI:  (20 HIE C)-(21 CYX N)-(21 CYX CA)-(21 CYX C) -135.0  75.0
 &rst     iat =   303,   305,   307,   313,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 21 CYS PSI:  (21 CYX N)-(21 CYX CA)-(21 CYX C)-(22 LYS N) 105.0 185.0
 &rst     iat =   305,   307,   313,   315,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 22 LYS PHI:  (21 CYX C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -175.0  75.0
 &rst     iat =   313,   315,   317,   335,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 ALA N) -75.0 185.0
 &rst     iat =   315,   317,   335,   337,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 22 LYS PHI:  (21 CYX C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -255.0 -25.0
 &rst     iat =   313,   315,   317,   335,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 ALA N)  25.0  55.0
 &rst     iat =   315,   317,   335,   337,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 22 LYS PHI:  (21 CYX C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -135.0  75.0
 &rst     iat =   313,   315,   317,   335,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 ALA N) 105.0 185.0
 &rst     iat =   315,   317,   335,   337,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 23 ALA PHI:  (22 LYS C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -175.0  75.0
 &rst     iat =   335,   337,   339,   345,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 GLU N) -75.0 185.0
 &rst     iat =   337,   339,   345,   347,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 23 ALA PHI:  (22 LYS C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -255.0 -25.0
 &rst     iat =   335,   337,   339,   345,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 GLU N)  25.0  55.0
 &rst     iat =   337,   339,   345,   347,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 23 ALA PHI:  (22 LYS C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -135.0  75.0
 &rst     iat =   335,   337,   339,   345,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 GLU N) 105.0 185.0
 &rst     iat =   337,   339,   345,   347,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 24 GLU PHI:  (23 ALA C)-(24 GLU N)-(24 GLU CA)-(24 GLU C) -175.0  75.0
 &rst     iat =   345,   347,   349,   360,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 24 GLU PSI:  (24 GLU N)-(24 GLU CA)-(24 GLU C)-(25 ASP N) -75.0 185.0
 &rst     iat =   347,   349,   360,   362,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 24 GLU PHI:  (23 ALA C)-(24 GLU N)-(24 GLU CA)-(24 GLU C) -255.0 -25.0
 &rst     iat =   345,   347,   349,   360,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 24 GLU PSI:  (24 GLU N)-(24 GLU CA)-(24 GLU C)-(25 ASP N)  25.0  55.0
 &rst     iat =   347,   349,   360,   362,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 24 GLU PHI:  (23 ALA C)-(24 GLU N)-(24 GLU CA)-(24 GLU C) -135.0  75.0
 &rst     iat =   345,   347,   349,   360,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 24 GLU PSI:  (24 GLU N)-(24 GLU CA)-(24 GLU C)-(25 ASP N) 105.0 185.0
 &rst     iat =   347,   349,   360,   362,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 25 ASP PHI:  (24 GLU C)-(25 ASP N)-(25 ASP CA)-(25 ASP C) -175.0  75.0
 &rst     iat =   360,   362,   364,   372,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 25 ASP PSI:  (25 ASP N)-(25 ASP CA)-(25 ASP C)-(26 LYS N) -75.0 185.0
 &rst     iat =   362,   364,   372,   374,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 25 ASP PHI:  (24 GLU C)-(25 ASP N)-(25 ASP CA)-(25 ASP C) -255.0 -25.0
 &rst     iat =   360,   362,   364,   372,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 25 ASP PSI:  (25 ASP N)-(25 ASP CA)-(25 ASP C)-(26 LYS N)  25.0  55.0
 &rst     iat =   362,   364,   372,   374,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 25 ASP PHI:  (24 GLU C)-(25 ASP N)-(25 ASP CA)-(25 ASP C) -135.0  75.0
 &rst     iat =   360,   362,   364,   372,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 25 ASP PSI:  (25 ASP N)-(25 ASP CA)-(25 ASP C)-(26 LYS N) 105.0 185.0
 &rst     iat =   362,   364,   372,   374,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 26 LYS PHI:  (25 ASP C)-(26 LYS N)-(26 LYS CA)-(26 LYS C) -175.0  75.0
 &rst     iat =   372,   374,   376,   394,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 26 LYS PSI:  (26 LYS N)-(26 LYS CA)-(26 LYS C)-(27 GLU N) -75.0 185.0
 &rst     iat =   374,   376,   394,   396,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 26 LYS PHI:  (25 ASP C)-(26 LYS N)-(26 LYS CA)-(26 LYS C) -255.0 -25.0
 &rst     iat =   372,   374,   376,   394,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 26 LYS PSI:  (26 LYS N)-(26 LYS CA)-(26 LYS C)-(27 GLU N)  25.0  55.0
 &rst     iat =   374,   376,   394,   396,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 26 LYS PHI:  (25 ASP C)-(26 LYS N)-(26 LYS CA)-(26 LYS C) -135.0  75.0
 &rst     iat =   372,   374,   376,   394,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 26 LYS PSI:  (26 LYS N)-(26 LYS CA)-(26 LYS C)-(27 GLU N) 105.0 185.0
 &rst     iat =   374,   376,   394,   396,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 27 GLU PHI:  (26 LYS C)-(27 GLU N)-(27 GLU CA)-(27 GLU C) -175.0  75.0
 &rst     iat =   394,   396,   398,   409,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 27 GLU PSI:  (27 GLU N)-(27 GLU CA)-(27 GLU C)-(28 GLY N) -75.0 185.0
 &rst     iat =   396,   398,   409,   411,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 27 GLU PHI:  (26 LYS C)-(27 GLU N)-(27 GLU CA)-(27 GLU C) -255.0 -25.0
 &rst     iat =   394,   396,   398,   409,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 27 GLU PSI:  (27 GLU N)-(27 GLU CA)-(27 GLU C)-(28 GLY N)  25.0  55.0
 &rst     iat =   396,   398,   409,   411,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 27 GLU PHI:  (26 LYS C)-(27 GLU N)-(27 GLU CA)-(27 GLU C) -135.0  75.0
 &rst     iat =   394,   396,   398,   409,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 27 GLU PSI:  (27 GLU N)-(27 GLU CA)-(27 GLU C)-(28 GLY N) 105.0 185.0
 &rst     iat =   396,   398,   409,   411,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 29 ILE PHI:  (28 GLY C)-(29 ILE N)-(29 ILE CA)-(29 ILE C) -175.0  75.0
 &rst     iat =   416,   418,   420,   435,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 29 ILE PSI:  (29 ILE N)-(29 ILE CA)-(29 ILE C)-(30 CYX N) -75.0 185.0
 &rst     iat =   418,   420,   435,   437,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 29 ILE PHI:  (28 GLY C)-(29 ILE N)-(29 ILE CA)-(29 ILE C) -255.0 -25.0
 &rst     iat =   416,   418,   420,   435,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 29 ILE PSI:  (29 ILE N)-(29 ILE CA)-(29 ILE C)-(30 CYX N)  25.0  55.0
 &rst     iat =   418,   420,   435,   437,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 29 ILE PHI:  (28 GLY C)-(29 ILE N)-(29 ILE CA)-(29 ILE C) -135.0  75.0
 &rst     iat =   416,   418,   420,   435,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 29 ILE PSI:  (29 ILE N)-(29 ILE CA)-(29 ILE C)-(30 CYX N) 105.0 185.0
 &rst     iat =   418,   420,   435,   437,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 30 CYS PHI:  (29 ILE C)-(30 CYX N)-(30 CYX CA)-(30 CYX C) -175.0  75.0
 &rst     iat =   435,   437,   439,   445,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 30 CYS PSI:  (30 CYX N)-(30 CYX CA)-(30 CYX C)-(31 HIE N) -75.0 185.0
 &rst     iat =   437,   439,   445,   447,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 30 CYS PHI:  (29 ILE C)-(30 CYX N)-(30 CYX CA)-(30 CYX C) -255.0 -25.0
 &rst     iat =   435,   437,   439,   445,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 30 CYS PSI:  (30 CYX N)-(30 CYX CA)-(30 CYX C)-(31 HIE N)  25.0  55.0
 &rst     iat =   437,   439,   445,   447,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 30 CYS PHI:  (29 ILE C)-(30 CYX N)-(30 CYX CA)-(30 CYX C) -135.0  75.0
 &rst     iat =   435,   437,   439,   445,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 30 CYS PSI:  (30 CYX N)-(30 CYX CA)-(30 CYX C)-(31 HIE N) 105.0 185.0
 &rst     iat =   437,   439,   445,   447,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 31 HIS PHI:  (30 CYX C)-(31 HIE N)-(31 HIE CA)-(31 HIE C) -175.0  75.0
 &rst     iat =   445,   447,   449,   462,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 31 HIS PSI:  (31 HIE N)-(31 HIE CA)-(31 HIE C)-(32 GLY N) -75.0 185.0
 &rst     iat =   447,   449,   462,   464,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 31 HIS PHI:  (30 CYX C)-(31 HIE N)-(31 HIE CA)-(31 HIE C) -255.0 -25.0
 &rst     iat =   445,   447,   449,   462,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 31 HIS PSI:  (31 HIE N)-(31 HIE CA)-(31 HIE C)-(32 GLY N)  25.0  55.0
 &rst     iat =   447,   449,   462,   464,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 31 HIS PHI:  (30 CYX C)-(31 HIE N)-(31 HIE CA)-(31 HIE C) -135.0  75.0
 &rst     iat =   445,   447,   449,   462,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 31 HIS PSI:  (31 HIE N)-(31 HIE CA)-(31 HIE C)-(32 GLY N) 105.0 185.0
 &rst     iat =   447,   449,   462,   464,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 33 THR PHI:  (32 GLY C)-(33 THR N)-(33 THR CA)-(33 THR C) -175.0  75.0
 &rst     iat =   469,   471,   473,   483,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 33 THR PSI:  (33 THR N)-(33 THR CA)-(33 THR C)-(34 LYS N) -75.0 185.0
 &rst     iat =   471,   473,   483,   485,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 33 THR PHI:  (32 GLY C)-(33 THR N)-(33 THR CA)-(33 THR C) -255.0 -25.0
 &rst     iat =   469,   471,   473,   483,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 33 THR PSI:  (33 THR N)-(33 THR CA)-(33 THR C)-(34 LYS N)  25.0  55.0
 &rst     iat =   471,   473,   483,   485,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 33 THR PHI:  (32 GLY C)-(33 THR N)-(33 THR CA)-(33 THR C) -135.0  75.0
 &rst     iat =   469,   471,   473,   483,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 33 THR PSI:  (33 THR N)-(33 THR CA)-(33 THR C)-(34 LYS N) 105.0 185.0
 &rst     iat =   471,   473,   483,   485,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 34 LYS PHI:  (33 THR C)-(34 LYS N)-(34 LYS CA)-(34 LYS C) -175.0  75.0
 &rst     iat =   483,   485,   487,   505,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 34 LYS PSI:  (34 LYS N)-(34 LYS CA)-(34 LYS C)-(35 CYX N) -75.0 185.0
 &rst     iat =   485,   487,   505,   507,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 34 LYS PHI:  (33 THR C)-(34 LYS N)-(34 LYS CA)-(34 LYS C) -255.0 -25.0
 &rst     iat =   483,   485,   487,   505,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 34 LYS PSI:  (34 LYS N)-(34 LYS CA)-(34 LYS C)-(35 CYX N)  25.0  55.0
 &rst     iat =   485,   487,   505,   507,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 34 LYS PHI:  (33 THR C)-(34 LYS N)-(34 LYS CA)-(34 LYS C) -135.0  75.0
 &rst     iat =   483,   485,   487,   505,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 34 LYS PSI:  (34 LYS N)-(34 LYS CA)-(34 LYS C)-(35 CYX N) 105.0 185.0
 &rst     iat =   485,   487,   505,   507,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 35 CYS PHI:  (34 LYS C)-(35 CYX N)-(35 CYX CA)-(35 CYX C) -175.0  75.0
 &rst     iat =   505,   507,   509,   515,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 35 CYS PSI:  (35 CYX N)-(35 CYX CA)-(35 CYX C)-(36 LYS N) -75.0 185.0
 &rst     iat =   507,   509,   515,   517,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 35 CYS PHI:  (34 LYS C)-(35 CYX N)-(35 CYX CA)-(35 CYX C) -255.0 -25.0
 &rst     iat =   505,   507,   509,   515,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 35 CYS PSI:  (35 CYX N)-(35 CYX CA)-(35 CYX C)-(36 LYS N)  25.0  55.0
 &rst     iat =   507,   509,   515,   517,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 35 CYS PHI:  (34 LYS C)-(35 CYX N)-(35 CYX CA)-(35 CYX C) -135.0  75.0
 &rst     iat =   505,   507,   509,   515,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 35 CYS PSI:  (35 CYX N)-(35 CYX CA)-(35 CYX C)-(36 LYS N) 105.0 185.0
 &rst     iat =   507,   509,   515,   517,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 36 LYS PHI:  (35 CYX C)-(36 LYS N)-(36 LYS CA)-(36 LYS C) -175.0  75.0
 &rst     iat =   515,   517,   519,   537,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 36 LYS PSI:  (36 LYS N)-(36 LYS CA)-(36 LYS C)-(37 CYX N) -75.0 185.0
 &rst     iat =   517,   519,   537,   539,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 36 LYS PHI:  (35 CYX C)-(36 LYS N)-(36 LYS CA)-(36 LYS C) -255.0 -25.0
 &rst     iat =   515,   517,   519,   537,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 36 LYS PSI:  (36 LYS N)-(36 LYS CA)-(36 LYS C)-(37 CYX N)  25.0  55.0
 &rst     iat =   517,   519,   537,   539,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 36 LYS PHI:  (35 CYX C)-(36 LYS N)-(36 LYS CA)-(36 LYS C) -135.0  75.0
 &rst     iat =   515,   517,   519,   537,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 36 LYS PSI:  (36 LYS N)-(36 LYS CA)-(36 LYS C)-(37 CYX N) 105.0 185.0
 &rst     iat =   517,   519,   537,   539,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 37 CYS PHI:  (36 LYS C)-(37 CYX N)-(37 CYX CA)-(37 CYX C) -175.0  75.0
 &rst     iat =   537,   539,   541,   547,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 37 CYS PSI:  (37 CYX N)-(37 CYX CA)-(37 CYX C)-(38 GLY N) -75.0 185.0
 &rst     iat =   539,   541,   547,   549,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 37 CYS PHI:  (36 LYS C)-(37 CYX N)-(37 CYX CA)-(37 CYX C) -255.0 -25.0
 &rst     iat =   537,   539,   541,   547,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 37 CYS PSI:  (37 CYX N)-(37 CYX CA)-(37 CYX C)-(38 GLY N)  25.0  55.0
 &rst     iat =   539,   541,   547,   549,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 37 CYS PHI:  (36 LYS C)-(37 CYX N)-(37 CYX CA)-(37 CYX C) -135.0  75.0
 &rst     iat =   537,   539,   541,   547,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 37 CYS PSI:  (37 CYX N)-(37 CYX CA)-(37 CYX C)-(38 GLY N) 105.0 185.0
 &rst     iat =   539,   541,   547,   549,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 41 ILE PHI:  (40 PRO C)-(41 ILE N)-(41 ILE CA)-(41 ILE C) -175.0  75.0
 &rst     iat =   584,   586,   588,   603,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 41 ILE PSI:  (41 ILE N)-(41 ILE CA)-(41 ILE C)-(42 SER N) -75.0 185.0
 &rst     iat =   586,   588,   603,   605,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 41 ILE PHI:  (40 PRO C)-(41 ILE N)-(41 ILE CA)-(41 ILE C) -255.0 -25.0
 &rst     iat =   584,   586,   588,   603,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 41 ILE PSI:  (41 ILE N)-(41 ILE CA)-(41 ILE C)-(42 SER N)  25.0  55.0
 &rst     iat =   586,   588,   603,   605,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 41 ILE PHI:  (40 PRO C)-(41 ILE N)-(41 ILE CA)-(41 ILE C) -135.0  75.0
 &rst     iat =   584,   586,   588,   603,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 41 ILE PSI:  (41 ILE N)-(41 ILE CA)-(41 ILE C)-(42 SER N) 105.0 185.0
 &rst     iat =   586,   588,   603,   605,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 42 SER PHI:  (41 ILE C)-(42 SER N)-(42 SER CA)-(42 SER C) -175.0  75.0
 &rst     iat =   603,   605,   607,   614,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 42 SER PSI:  (42 SER N)-(42 SER CA)-(42 SER C)-(43 TYR N) -75.0 185.0
 &rst     iat =   605,   607,   614,   616,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 42 SER PHI:  (41 ILE C)-(42 SER N)-(42 SER CA)-(42 SER C) -255.0 -25.0
 &rst     iat =   603,   605,   607,   614,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 42 SER PSI:  (42 SER N)-(42 SER CA)-(42 SER C)-(43 TYR N)  25.0  55.0
 &rst     iat =   605,   607,   614,   616,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 42 SER PHI:  (41 ILE C)-(42 SER N)-(42 SER CA)-(42 SER C) -135.0  75.0
 &rst     iat =   603,   605,   607,   614,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 42 SER PSI:  (42 SER N)-(42 SER CA)-(42 SER C)-(43 TYR N) 105.0 185.0
 &rst     iat =   605,   607,   614,   616,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 43 TYR PHI:  (42 SER C)-(43 TYR N)-(43 TYR CA)-(43 TYR C) -175.0  75.0
 &rst     iat =   614,   616,   618,   635,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 43 TYR PSI:  (43 TYR N)-(43 TYR CA)-(43 TYR C)-(44 LEU N) -75.0 185.0
 &rst     iat =   616,   618,   635,   637,
	  r1 = -76.0, r2 = -75.0, r3 = 185.0, r4 = 186.0,
	&end

# 43 TYR PHI:  (42 SER C)-(43 TYR N)-(43 TYR CA)-(43 TYR C) -255.0 -25.0
 &rst     iat =   614,   616,   618,   635,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 43 TYR PSI:  (43 TYR N)-(43 TYR CA)-(43 TYR C)-(44 LEU N)  25.0  55.0
 &rst     iat =   616,   618,   635,   637,
	  r1 =  24.0, r2 =  25.0, r3 =  55.0, r4 =  56.0,
	&end

# 43 TYR PHI:  (42 SER C)-(43 TYR N)-(43 TYR CA)-(43 TYR C) -135.0  75.0
 &rst     iat =   614,   616,   618,   635,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 43 TYR PSI:  (43 TYR N)-(43 TYR CA)-(43 TYR C)-(44 LEU N) 105.0 185.0
 &rst     iat =   616,   618,   635,   637,
	  r1 = 104.0, r2 = 105.0, r3 = 185.0, r4 = 186.0,
	&end

# 44 LEU PHI:  (43 TYR C)-(44 LEU N)-(44 LEU CA)-(44 LEU C) -175.0  75.0
 &rst     iat =   635,   637,   639,   654,
	  r1 = -176.0, r2 = -175.0, r3 =  75.0, r4 =  76.0,
	&end

# 44 LEU PHI:  (43 TYR C)-(44 LEU N)-(44 LEU CA)-(44 LEU C) -255.0 -25.0
 &rst     iat =   635,   637,   639,   654,
	  r1 = -256.0, r2 = -255.0, r3 = -25.0, r4 = -24.0,
	&end

# 44 LEU PHI:  (43 TYR C)-(44 LEU N)-(44 LEU CA)-(44 LEU C) -135.0  75.0
 &rst     iat =   635,   637,   639,   654,
	  r1 = -136.0, r2 = -135.0, r3 =  75.0, r4 =  76.0,
	&end

# 2 LYS CHI1:  (2 LYS N)-(2 LYS CA)-(2 LYS CB)-(2 LYS CG) -90.0 210.0
 &rst     iat =    13,    15,    17,    20,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 2 LYS CHI1:  (2 LYS N)-(2 LYS CA)-(2 LYS CB)-(2 LYS CG) -330.0 -30.0
 &rst     iat =    13,    15,    17,    20,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 2 LYS CHI1:  (2 LYS N)-(2 LYS CA)-(2 LYS CB)-(2 LYS CG) -210.0  90.0
 &rst     iat =    13,    15,    17,    20,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 2 LYS CHI2:  (2 LYS CA)-(2 LYS CB)-(2 LYS CG)-(2 LYS CD) -90.0 210.0
 &rst     iat =    15,    17,    20,    23,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 2 LYS CHI2:  (2 LYS CA)-(2 LYS CB)-(2 LYS CG)-(2 LYS CD) -330.0 -30.0
 &rst     iat =    15,    17,    20,    23,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 2 LYS CHI2:  (2 LYS CA)-(2 LYS CB)-(2 LYS CG)-(2 LYS CD) -210.0  90.0
 &rst     iat =    15,    17,    20,    23,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 2 LYS CHI3:  (2 LYS CB)-(2 LYS CG)-(2 LYS CD)-(2 LYS CE) -90.0 210.0
 &rst     iat =    17,    20,    23,    26,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 2 LYS CHI3:  (2 LYS CB)-(2 LYS CG)-(2 LYS CD)-(2 LYS CE) -330.0 -30.0
 &rst     iat =    17,    20,    23,    26,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 2 LYS CHI3:  (2 LYS CB)-(2 LYS CG)-(2 LYS CD)-(2 LYS CE) -210.0  90.0
 &rst     iat =    17,    20,    23,    26,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 2 LYS CHI4:  (2 LYS CG)-(2 LYS CD)-(2 LYS CE)-(2 LYS NZ) -90.0 210.0
 &rst     iat =    20,    23,    26,    29,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 2 LYS CHI4:  (2 LYS CG)-(2 LYS CD)-(2 LYS CE)-(2 LYS NZ) -330.0 -30.0
 &rst     iat =    20,    23,    26,    29,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 2 LYS CHI4:  (2 LYS CG)-(2 LYS CD)-(2 LYS CE)-(2 LYS NZ) -210.0  90.0
 &rst     iat =    20,    23,    26,    29,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 3 ASN CHI1:  (3 ASN N)-(3 ASN CA)-(3 ASN CB)-(3 ASN CG) -90.0 210.0
 &rst     iat =    35,    37,    39,    42,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 3 ASN CHI1:  (3 ASN N)-(3 ASN CA)-(3 ASN CB)-(3 ASN CG) -330.0 -30.0
 &rst     iat =    35,    37,    39,    42,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 3 ASN CHI1:  (3 ASN N)-(3 ASN CA)-(3 ASN CB)-(3 ASN CG) -210.0  90.0
 &rst     iat =    35,    37,    39,    42,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 4 GLN CHI1:  (4 GLN N)-(4 GLN CA)-(4 GLN CB)-(4 GLN CG) -90.0 210.0
 &rst     iat =    49,    51,    53,    56,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 4 GLN CHI1:  (4 GLN N)-(4 GLN CA)-(4 GLN CB)-(4 GLN CG) -330.0 -30.0
 &rst     iat =    49,    51,    53,    56,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 4 GLN CHI1:  (4 GLN N)-(4 GLN CA)-(4 GLN CB)-(4 GLN CG) -210.0  90.0
 &rst     iat =    49,    51,    53,    56,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 4 GLN CHI2:  (4 GLN CA)-(4 GLN CB)-(4 GLN CG)-(4 GLN CD) -90.0 210.0
 &rst     iat =    51,    53,    56,    59,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 4 GLN CHI2:  (4 GLN CA)-(4 GLN CB)-(4 GLN CG)-(4 GLN CD) -330.0 -30.0
 &rst     iat =    51,    53,    56,    59,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 4 GLN CHI2:  (4 GLN CA)-(4 GLN CB)-(4 GLN CG)-(4 GLN CD) -210.0  90.0
 &rst     iat =    51,    53,    56,    59,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 5 PHE CHI1:  (5 PHE N)-(5 PHE CA)-(5 PHE CB)-(5 PHE CG) -90.0 210.0
 &rst     iat =    66,    68,    70,    73,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 5 PHE CHI1:  (5 PHE N)-(5 PHE CA)-(5 PHE CB)-(5 PHE CG) -330.0 -30.0
 &rst     iat =    66,    68,    70,    73,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 5 PHE CHI1:  (5 PHE N)-(5 PHE CA)-(5 PHE CB)-(5 PHE CG) -210.0  90.0
 &rst     iat =    66,    68,    70,    73,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 7 CYS CHI1:  (7 CYX N)-(7 CYX CA)-(7 CYX CB)-(7 CYX SG) -90.0 210.0
 &rst     iat =    93,    95,    97,   100,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 7 CYS CHI1:  (7 CYX N)-(7 CYX CA)-(7 CYX CB)-(7 CYX SG) -330.0 -30.0
 &rst     iat =    93,    95,    97,   100,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 7 CYS CHI1:  (7 CYX N)-(7 CYX CA)-(7 CYX CB)-(7 CYX SG) -210.0  90.0
 &rst     iat =    93,    95,    97,   100,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 8 PHE CHI1:  (8 PHE N)-(8 PHE CA)-(8 PHE CB)-(8 PHE CG) -90.0 210.0
 &rst     iat =   103,   105,   107,   110,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 8 PHE CHI1:  (8 PHE N)-(8 PHE CA)-(8 PHE CB)-(8 PHE CG) -330.0 -30.0
 &rst     iat =   103,   105,   107,   110,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 8 PHE CHI1:  (8 PHE N)-(8 PHE CA)-(8 PHE CB)-(8 PHE CG) -210.0  90.0
 &rst     iat =   103,   105,   107,   110,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 10 ASN CHI1:  (10 ASN N)-(10 ASN CA)-(10 ASN CB)-(10 ASN CG) -90.0 210.0
 &rst     iat =   133,   135,   137,   140,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 10 ASN CHI1:  (10 ASN N)-(10 ASN CA)-(10 ASN CB)-(10 ASN CG) -330.0 -30.0
 &rst     iat =   133,   135,   137,   140,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 10 ASN CHI1:  (10 ASN N)-(10 ASN CA)-(10 ASN CB)-(10 ASN CG) -210.0  90.0
 &rst     iat =   133,   135,   137,   140,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 11 VAL CHI1:  (11 VAL N)-(11 VAL CA)-(11 VAL CB)-(11 VAL CG1) -90.0 210.0
 &rst     iat =   147,   149,   151,   153,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 11 VAL CHI1:  (11 VAL N)-(11 VAL CA)-(11 VAL CB)-(11 VAL CG1) -330.0 -30.0
 &rst     iat =   147,   149,   151,   153,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 11 VAL CHI1:  (11 VAL N)-(11 VAL CA)-(11 VAL CB)-(11 VAL CG1) -210.0  90.0
 &rst     iat =   147,   149,   151,   153,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 12 ASP CHI1:  (12 ASP N)-(12 ASP CA)-(12 ASP CB)-(12 ASP CG) -90.0 210.0
 &rst     iat =   163,   165,   167,   170,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 12 ASP CHI1:  (12 ASP N)-(12 ASP CA)-(12 ASP CB)-(12 ASP CG) -330.0 -30.0
 &rst     iat =   163,   165,   167,   170,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 12 ASP CHI1:  (12 ASP N)-(12 ASP CA)-(12 ASP CB)-(12 ASP CG) -210.0  90.0
 &rst     iat =   163,   165,   167,   170,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 13 VAL CHI1:  (13 VAL N)-(13 VAL CA)-(13 VAL CB)-(13 VAL CG1) -90.0 210.0
 &rst     iat =   175,   177,   179,   181,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 13 VAL CHI1:  (13 VAL N)-(13 VAL CA)-(13 VAL CB)-(13 VAL CG1) -330.0 -30.0
 &rst     iat =   175,   177,   179,   181,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 13 VAL CHI1:  (13 VAL N)-(13 VAL CA)-(13 VAL CB)-(13 VAL CG1) -210.0  90.0
 &rst     iat =   175,   177,   179,   181,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 14 LYS CHI1:  (14 LYS N)-(14 LYS CA)-(14 LYS CB)-(14 LYS CG) -90.0 210.0
 &rst     iat =   191,   193,   195,   198,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 14 LYS CHI1:  (14 LYS N)-(14 LYS CA)-(14 LYS CB)-(14 LYS CG) -330.0 -30.0
 &rst     iat =   191,   193,   195,   198,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 14 LYS CHI1:  (14 LYS N)-(14 LYS CA)-(14 LYS CB)-(14 LYS CG) -210.0  90.0
 &rst     iat =   191,   193,   195,   198,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 14 LYS CHI2:  (14 LYS CA)-(14 LYS CB)-(14 LYS CG)-(14 LYS CD) -90.0 210.0
 &rst     iat =   193,   195,   198,   201,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 14 LYS CHI2:  (14 LYS CA)-(14 LYS CB)-(14 LYS CG)-(14 LYS CD) -330.0 -30.0
 &rst     iat =   193,   195,   198,   201,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 14 LYS CHI2:  (14 LYS CA)-(14 LYS CB)-(14 LYS CG)-(14 LYS CD) -210.0  90.0
 &rst     iat =   193,   195,   198,   201,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 14 LYS CHI3:  (14 LYS CB)-(14 LYS CG)-(14 LYS CD)-(14 LYS CE) -90.0 210.0
 &rst     iat =   195,   198,   201,   204,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 14 LYS CHI3:  (14 LYS CB)-(14 LYS CG)-(14 LYS CD)-(14 LYS CE) -330.0 -30.0
 &rst     iat =   195,   198,   201,   204,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 14 LYS CHI3:  (14 LYS CB)-(14 LYS CG)-(14 LYS CD)-(14 LYS CE) -210.0  90.0
 &rst     iat =   195,   198,   201,   204,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 14 LYS CHI4:  (14 LYS CG)-(14 LYS CD)-(14 LYS CE)-(14 LYS NZ) -90.0 210.0
 &rst     iat =   198,   201,   204,   207,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 14 LYS CHI4:  (14 LYS CG)-(14 LYS CD)-(14 LYS CE)-(14 LYS NZ) -330.0 -30.0
 &rst     iat =   198,   201,   204,   207,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 14 LYS CHI4:  (14 LYS CG)-(14 LYS CD)-(14 LYS CE)-(14 LYS NZ) -210.0  90.0
 &rst     iat =   198,   201,   204,   207,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 16 ASP CHI1:  (16 ASP N)-(16 ASP CA)-(16 ASP CB)-(16 ASP CG) -90.0 210.0
 &rst     iat =   220,   222,   224,   227,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 16 ASP CHI1:  (16 ASP N)-(16 ASP CA)-(16 ASP CB)-(16 ASP CG) -330.0 -30.0
 &rst     iat =   220,   222,   224,   227,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 16 ASP CHI1:  (16 ASP N)-(16 ASP CA)-(16 ASP CB)-(16 ASP CG) -210.0  90.0
 &rst     iat =   220,   222,   224,   227,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 17 CYS CHI1:  (17 CYX N)-(17 CYX CA)-(17 CYX CB)-(17 CYX SG) -90.0 210.0
 &rst     iat =   232,   234,   236,   239,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 17 CYS CHI1:  (17 CYX N)-(17 CYX CA)-(17 CYX CB)-(17 CYX SG) -330.0 -30.0
 &rst     iat =   232,   234,   236,   239,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 17 CYS CHI1:  (17 CYX N)-(17 CYX CA)-(17 CYX CB)-(17 CYX SG) -210.0  90.0
 &rst     iat =   232,   234,   236,   239,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 18 LYS CHI1:  (18 LYS N)-(18 LYS CA)-(18 LYS CB)-(18 LYS CG) -90.0 210.0
 &rst     iat =   242,   244,   246,   249,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 18 LYS CHI1:  (18 LYS N)-(18 LYS CA)-(18 LYS CB)-(18 LYS CG) -330.0 -30.0
 &rst     iat =   242,   244,   246,   249,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 18 LYS CHI1:  (18 LYS N)-(18 LYS CA)-(18 LYS CB)-(18 LYS CG) -210.0  90.0
 &rst     iat =   242,   244,   246,   249,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 18 LYS CHI2:  (18 LYS CA)-(18 LYS CB)-(18 LYS CG)-(18 LYS CD) -90.0 210.0
 &rst     iat =   244,   246,   249,   252,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 18 LYS CHI2:  (18 LYS CA)-(18 LYS CB)-(18 LYS CG)-(18 LYS CD) -330.0 -30.0
 &rst     iat =   244,   246,   249,   252,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 18 LYS CHI2:  (18 LYS CA)-(18 LYS CB)-(18 LYS CG)-(18 LYS CD) -210.0  90.0
 &rst     iat =   244,   246,   249,   252,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 18 LYS CHI3:  (18 LYS CB)-(18 LYS CG)-(18 LYS CD)-(18 LYS CE) -90.0 210.0
 &rst     iat =   246,   249,   252,   255,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 18 LYS CHI3:  (18 LYS CB)-(18 LYS CG)-(18 LYS CD)-(18 LYS CE) -330.0 -30.0
 &rst     iat =   246,   249,   252,   255,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 18 LYS CHI3:  (18 LYS CB)-(18 LYS CG)-(18 LYS CD)-(18 LYS CE) -210.0  90.0
 &rst     iat =   246,   249,   252,   255,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 18 LYS CHI4:  (18 LYS CG)-(18 LYS CD)-(18 LYS CE)-(18 LYS NZ) -90.0 210.0
 &rst     iat =   249,   252,   255,   258,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 18 LYS CHI4:  (18 LYS CG)-(18 LYS CD)-(18 LYS CE)-(18 LYS NZ) -330.0 -30.0
 &rst     iat =   249,   252,   255,   258,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 18 LYS CHI4:  (18 LYS CG)-(18 LYS CD)-(18 LYS CE)-(18 LYS NZ) -210.0  90.0
 &rst     iat =   249,   252,   255,   258,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 19 ARG CHI1:  (19 ARG N)-(19 ARG CA)-(19 ARG CB)-(19 ARG CG) -90.0 210.0
 &rst     iat =   264,   266,   268,   271,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 19 ARG CHI1:  (19 ARG N)-(19 ARG CA)-(19 ARG CB)-(19 ARG CG) -330.0 -30.0
 &rst     iat =   264,   266,   268,   271,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 19 ARG CHI1:  (19 ARG N)-(19 ARG CA)-(19 ARG CB)-(19 ARG CG) -210.0  90.0
 &rst     iat =   264,   266,   268,   271,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 19 ARG CHI2:  (19 ARG CA)-(19 ARG CB)-(19 ARG CG)-(19 ARG CD) -90.0 210.0
 &rst     iat =   266,   268,   271,   274,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 19 ARG CHI2:  (19 ARG CA)-(19 ARG CB)-(19 ARG CG)-(19 ARG CD) -330.0 -30.0
 &rst     iat =   266,   268,   271,   274,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 19 ARG CHI2:  (19 ARG CA)-(19 ARG CB)-(19 ARG CG)-(19 ARG CD) -210.0  90.0
 &rst     iat =   266,   268,   271,   274,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 19 ARG CHI3:  (19 ARG CB)-(19 ARG CG)-(19 ARG CD)-(19 ARG NE) -90.0 210.0
 &rst     iat =   268,   271,   274,   277,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 19 ARG CHI3:  (19 ARG CB)-(19 ARG CG)-(19 ARG CD)-(19 ARG NE) -330.0 -30.0
 &rst     iat =   268,   271,   274,   277,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 19 ARG CHI3:  (19 ARG CB)-(19 ARG CG)-(19 ARG CD)-(19 ARG NE) -210.0  90.0
 &rst     iat =   268,   271,   274,   277,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 20 HIS CHI1:  (20 HIE N)-(20 HIE CA)-(20 HIE CB)-(20 HIE CG) -90.0 210.0
 &rst     iat =   288,   290,   292,   295,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 20 HIS CHI1:  (20 HIE N)-(20 HIE CA)-(20 HIE CB)-(20 HIE CG) -330.0 -30.0
 &rst     iat =   288,   290,   292,   295,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 20 HIS CHI1:  (20 HIE N)-(20 HIE CA)-(20 HIE CB)-(20 HIE CG) -210.0  90.0
 &rst     iat =   288,   290,   292,   295,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 21 CYS CHI1:  (21 CYX N)-(21 CYX CA)-(21 CYX CB)-(21 CYX SG) -90.0 210.0
 &rst     iat =   305,   307,   309,   312,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 21 CYS CHI1:  (21 CYX N)-(21 CYX CA)-(21 CYX CB)-(21 CYX SG) -330.0 -30.0
 &rst     iat =   305,   307,   309,   312,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 21 CYS CHI1:  (21 CYX N)-(21 CYX CA)-(21 CYX CB)-(21 CYX SG) -210.0  90.0
 &rst     iat =   305,   307,   309,   312,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 22 LYS CHI1:  (22 LYS N)-(22 LYS CA)-(22 LYS CB)-(22 LYS CG) -90.0 210.0
 &rst     iat =   315,   317,   319,   322,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 22 LYS CHI1:  (22 LYS N)-(22 LYS CA)-(22 LYS CB)-(22 LYS CG) -330.0 -30.0
 &rst     iat =   315,   317,   319,   322,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 22 LYS CHI1:  (22 LYS N)-(22 LYS CA)-(22 LYS CB)-(22 LYS CG) -210.0  90.0
 &rst     iat =   315,   317,   319,   322,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 22 LYS CHI2:  (22 LYS CA)-(22 LYS CB)-(22 LYS CG)-(22 LYS CD) -90.0 210.0
 &rst     iat =   317,   319,   322,   325,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 22 LYS CHI2:  (22 LYS CA)-(22 LYS CB)-(22 LYS CG)-(22 LYS CD) -330.0 -30.0
 &rst     iat =   317,   319,   322,   325,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 22 LYS CHI2:  (22 LYS CA)-(22 LYS CB)-(22 LYS CG)-(22 LYS CD) -210.0  90.0
 &rst     iat =   317,   319,   322,   325,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 22 LYS CHI3:  (22 LYS CB)-(22 LYS CG)-(22 LYS CD)-(22 LYS CE) -90.0 210.0
 &rst     iat =   319,   322,   325,   328,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 22 LYS CHI3:  (22 LYS CB)-(22 LYS CG)-(22 LYS CD)-(22 LYS CE) -330.0 -30.0
 &rst     iat =   319,   322,   325,   328,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 22 LYS CHI3:  (22 LYS CB)-(22 LYS CG)-(22 LYS CD)-(22 LYS CE) -210.0  90.0
 &rst     iat =   319,   322,   325,   328,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 22 LYS CHI4:  (22 LYS CG)-(22 LYS CD)-(22 LYS CE)-(22 LYS NZ) -90.0 210.0
 &rst     iat =   322,   325,   328,   331,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 22 LYS CHI4:  (22 LYS CG)-(22 LYS CD)-(22 LYS CE)-(22 LYS NZ) -330.0 -30.0
 &rst     iat =   322,   325,   328,   331,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 22 LYS CHI4:  (22 LYS CG)-(22 LYS CD)-(22 LYS CE)-(22 LYS NZ) -210.0  90.0
 &rst     iat =   322,   325,   328,   331,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 24 GLU CHI1:  (24 GLU N)-(24 GLU CA)-(24 GLU CB)-(24 GLU CG) -90.0 210.0
 &rst     iat =   347,   349,   351,   354,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 24 GLU CHI1:  (24 GLU N)-(24 GLU CA)-(24 GLU CB)-(24 GLU CG) -330.0 -30.0
 &rst     iat =   347,   349,   351,   354,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 24 GLU CHI1:  (24 GLU N)-(24 GLU CA)-(24 GLU CB)-(24 GLU CG) -210.0  90.0
 &rst     iat =   347,   349,   351,   354,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 24 GLU CHI2:  (24 GLU CA)-(24 GLU CB)-(24 GLU CG)-(24 GLU CD) -90.0 210.0
 &rst     iat =   349,   351,   354,   357,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 24 GLU CHI2:  (24 GLU CA)-(24 GLU CB)-(24 GLU CG)-(24 GLU CD) -330.0 -30.0
 &rst     iat =   349,   351,   354,   357,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 24 GLU CHI2:  (24 GLU CA)-(24 GLU CB)-(24 GLU CG)-(24 GLU CD) -210.0  90.0
 &rst     iat =   349,   351,   354,   357,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 25 ASP CHI1:  (25 ASP N)-(25 ASP CA)-(25 ASP CB)-(25 ASP CG) -90.0 210.0
 &rst     iat =   362,   364,   366,   369,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 25 ASP CHI1:  (25 ASP N)-(25 ASP CA)-(25 ASP CB)-(25 ASP CG) -330.0 -30.0
 &rst     iat =   362,   364,   366,   369,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 25 ASP CHI1:  (25 ASP N)-(25 ASP CA)-(25 ASP CB)-(25 ASP CG) -210.0  90.0
 &rst     iat =   362,   364,   366,   369,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 26 LYS CHI1:  (26 LYS N)-(26 LYS CA)-(26 LYS CB)-(26 LYS CG) -90.0 210.0
 &rst     iat =   374,   376,   378,   381,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 26 LYS CHI1:  (26 LYS N)-(26 LYS CA)-(26 LYS CB)-(26 LYS CG) -330.0 -30.0
 &rst     iat =   374,   376,   378,   381,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 26 LYS CHI1:  (26 LYS N)-(26 LYS CA)-(26 LYS CB)-(26 LYS CG) -210.0  90.0
 &rst     iat =   374,   376,   378,   381,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 26 LYS CHI2:  (26 LYS CA)-(26 LYS CB)-(26 LYS CG)-(26 LYS CD) -90.0 210.0
 &rst     iat =   376,   378,   381,   384,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 26 LYS CHI2:  (26 LYS CA)-(26 LYS CB)-(26 LYS CG)-(26 LYS CD) -330.0 -30.0
 &rst     iat =   376,   378,   381,   384,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 26 LYS CHI2:  (26 LYS CA)-(26 LYS CB)-(26 LYS CG)-(26 LYS CD) -210.0  90.0
 &rst     iat =   376,   378,   381,   384,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 26 LYS CHI3:  (26 LYS CB)-(26 LYS CG)-(26 LYS CD)-(26 LYS CE) -90.0 210.0
 &rst     iat =   378,   381,   384,   387,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 26 LYS CHI3:  (26 LYS CB)-(26 LYS CG)-(26 LYS CD)-(26 LYS CE) -330.0 -30.0
 &rst     iat =   378,   381,   384,   387,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 26 LYS CHI3:  (26 LYS CB)-(26 LYS CG)-(26 LYS CD)-(26 LYS CE) -210.0  90.0
 &rst     iat =   378,   381,   384,   387,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 26 LYS CHI4:  (26 LYS CG)-(26 LYS CD)-(26 LYS CE)-(26 LYS NZ) -90.0 210.0
 &rst     iat =   381,   384,   387,   390,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 26 LYS CHI4:  (26 LYS CG)-(26 LYS CD)-(26 LYS CE)-(26 LYS NZ) -330.0 -30.0
 &rst     iat =   381,   384,   387,   390,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 26 LYS CHI4:  (26 LYS CG)-(26 LYS CD)-(26 LYS CE)-(26 LYS NZ) -210.0  90.0
 &rst     iat =   381,   384,   387,   390,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 27 GLU CHI1:  (27 GLU N)-(27 GLU CA)-(27 GLU CB)-(27 GLU CG) -90.0 210.0
 &rst     iat =   396,   398,   400,   403,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 27 GLU CHI1:  (27 GLU N)-(27 GLU CA)-(27 GLU CB)-(27 GLU CG) -330.0 -30.0
 &rst     iat =   396,   398,   400,   403,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 27 GLU CHI1:  (27 GLU N)-(27 GLU CA)-(27 GLU CB)-(27 GLU CG) -210.0  90.0
 &rst     iat =   396,   398,   400,   403,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 27 GLU CHI2:  (27 GLU CA)-(27 GLU CB)-(27 GLU CG)-(27 GLU CD) -90.0 210.0
 &rst     iat =   398,   400,   403,   406,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 27 GLU CHI2:  (27 GLU CA)-(27 GLU CB)-(27 GLU CG)-(27 GLU CD) -330.0 -30.0
 &rst     iat =   398,   400,   403,   406,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 27 GLU CHI2:  (27 GLU CA)-(27 GLU CB)-(27 GLU CG)-(27 GLU CD) -210.0  90.0
 &rst     iat =   398,   400,   403,   406,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -90.0 210.0
 &rst     iat =   418,   420,   422,   428,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -330.0 -30.0
 &rst     iat =   418,   420,   422,   428,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 29 ILE CHI1:  (29 ILE N)-(29 ILE CA)-(29 ILE CB)-(29 ILE CG1) -210.0  90.0
 &rst     iat =   418,   420,   422,   428,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -90.0 210.0
 &rst     iat =   420,   422,   428,   431,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -330.0 -30.0
 &rst     iat =   420,   422,   428,   431,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 29 ILE CHI21:  (29 ILE CA)-(29 ILE CB)-(29 ILE CG1)-(29 ILE CD1) -210.0  90.0
 &rst     iat =   420,   422,   428,   431,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 30 CYS CHI1:  (30 CYX N)-(30 CYX CA)-(30 CYX CB)-(30 CYX SG) -90.0 210.0
 &rst     iat =   437,   439,   441,   444,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 30 CYS CHI1:  (30 CYX N)-(30 CYX CA)-(30 CYX CB)-(30 CYX SG) -330.0 -30.0
 &rst     iat =   437,   439,   441,   444,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 30 CYS CHI1:  (30 CYX N)-(30 CYX CA)-(30 CYX CB)-(30 CYX SG) -210.0  90.0
 &rst     iat =   437,   439,   441,   444,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 31 HIS CHI1:  (31 HIE N)-(31 HIE CA)-(31 HIE CB)-(31 HIE CG) -90.0 210.0
 &rst     iat =   447,   449,   451,   454,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 31 HIS CHI1:  (31 HIE N)-(31 HIE CA)-(31 HIE CB)-(31 HIE CG) -330.0 -30.0
 &rst     iat =   447,   449,   451,   454,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 31 HIS CHI1:  (31 HIE N)-(31 HIE CA)-(31 HIE CB)-(31 HIE CG) -210.0  90.0
 &rst     iat =   447,   449,   451,   454,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 33 THR CHI1:  (33 THR N)-(33 THR CA)-(33 THR CB)-(33 THR OG1) -90.0 210.0
 &rst     iat =   471,   473,   475,   481,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 33 THR CHI1:  (33 THR N)-(33 THR CA)-(33 THR CB)-(33 THR OG1) -330.0 -30.0
 &rst     iat =   471,   473,   475,   481,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 33 THR CHI1:  (33 THR N)-(33 THR CA)-(33 THR CB)-(33 THR OG1) -210.0  90.0
 &rst     iat =   471,   473,   475,   481,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 34 LYS CHI1:  (34 LYS N)-(34 LYS CA)-(34 LYS CB)-(34 LYS CG) -90.0 210.0
 &rst     iat =   485,   487,   489,   492,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 34 LYS CHI1:  (34 LYS N)-(34 LYS CA)-(34 LYS CB)-(34 LYS CG) -330.0 -30.0
 &rst     iat =   485,   487,   489,   492,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 34 LYS CHI1:  (34 LYS N)-(34 LYS CA)-(34 LYS CB)-(34 LYS CG) -210.0  90.0
 &rst     iat =   485,   487,   489,   492,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 34 LYS CHI2:  (34 LYS CA)-(34 LYS CB)-(34 LYS CG)-(34 LYS CD) -90.0 210.0
 &rst     iat =   487,   489,   492,   495,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 34 LYS CHI2:  (34 LYS CA)-(34 LYS CB)-(34 LYS CG)-(34 LYS CD) -330.0 -30.0
 &rst     iat =   487,   489,   492,   495,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 34 LYS CHI2:  (34 LYS CA)-(34 LYS CB)-(34 LYS CG)-(34 LYS CD) -210.0  90.0
 &rst     iat =   487,   489,   492,   495,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 34 LYS CHI3:  (34 LYS CB)-(34 LYS CG)-(34 LYS CD)-(34 LYS CE) -90.0 210.0
 &rst     iat =   489,   492,   495,   498,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 34 LYS CHI3:  (34 LYS CB)-(34 LYS CG)-(34 LYS CD)-(34 LYS CE) -330.0 -30.0
 &rst     iat =   489,   492,   495,   498,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 34 LYS CHI3:  (34 LYS CB)-(34 LYS CG)-(34 LYS CD)-(34 LYS CE) -210.0  90.0
 &rst     iat =   489,   492,   495,   498,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 34 LYS CHI4:  (34 LYS CG)-(34 LYS CD)-(34 LYS CE)-(34 LYS NZ) -90.0 210.0
 &rst     iat =   492,   495,   498,   501,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 34 LYS CHI4:  (34 LYS CG)-(34 LYS CD)-(34 LYS CE)-(34 LYS NZ) -330.0 -30.0
 &rst     iat =   492,   495,   498,   501,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 34 LYS CHI4:  (34 LYS CG)-(34 LYS CD)-(34 LYS CE)-(34 LYS NZ) -210.0  90.0
 &rst     iat =   492,   495,   498,   501,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 35 CYS CHI1:  (35 CYX N)-(35 CYX CA)-(35 CYX CB)-(35 CYX SG) -90.0 210.0
 &rst     iat =   507,   509,   511,   514,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 35 CYS CHI1:  (35 CYX N)-(35 CYX CA)-(35 CYX CB)-(35 CYX SG) -330.0 -30.0
 &rst     iat =   507,   509,   511,   514,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 35 CYS CHI1:  (35 CYX N)-(35 CYX CA)-(35 CYX CB)-(35 CYX SG) -210.0  90.0
 &rst     iat =   507,   509,   511,   514,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 36 LYS CHI1:  (36 LYS N)-(36 LYS CA)-(36 LYS CB)-(36 LYS CG) -90.0 210.0
 &rst     iat =   517,   519,   521,   524,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 36 LYS CHI1:  (36 LYS N)-(36 LYS CA)-(36 LYS CB)-(36 LYS CG) -330.0 -30.0
 &rst     iat =   517,   519,   521,   524,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 36 LYS CHI1:  (36 LYS N)-(36 LYS CA)-(36 LYS CB)-(36 LYS CG) -210.0  90.0
 &rst     iat =   517,   519,   521,   524,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 36 LYS CHI2:  (36 LYS CA)-(36 LYS CB)-(36 LYS CG)-(36 LYS CD) -90.0 210.0
 &rst     iat =   519,   521,   524,   527,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 36 LYS CHI2:  (36 LYS CA)-(36 LYS CB)-(36 LYS CG)-(36 LYS CD) -330.0 -30.0
 &rst     iat =   519,   521,   524,   527,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 36 LYS CHI2:  (36 LYS CA)-(36 LYS CB)-(36 LYS CG)-(36 LYS CD) -210.0  90.0
 &rst     iat =   519,   521,   524,   527,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 36 LYS CHI3:  (36 LYS CB)-(36 LYS CG)-(36 LYS CD)-(36 LYS CE) -90.0 210.0
 &rst     iat =   521,   524,   527,   530,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 36 LYS CHI3:  (36 LYS CB)-(36 LYS CG)-(36 LYS CD)-(36 LYS CE) -330.0 -30.0
 &rst     iat =   521,   524,   527,   530,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 36 LYS CHI3:  (36 LYS CB)-(36 LYS CG)-(36 LYS CD)-(36 LYS CE) -210.0  90.0
 &rst     iat =   521,   524,   527,   530,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 36 LYS CHI4:  (36 LYS CG)-(36 LYS CD)-(36 LYS CE)-(36 LYS NZ) -90.0 210.0
 &rst     iat =   524,   527,   530,   533,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 36 LYS CHI4:  (36 LYS CG)-(36 LYS CD)-(36 LYS CE)-(36 LYS NZ) -330.0 -30.0
 &rst     iat =   524,   527,   530,   533,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 36 LYS CHI4:  (36 LYS CG)-(36 LYS CD)-(36 LYS CE)-(36 LYS NZ) -210.0  90.0
 &rst     iat =   524,   527,   530,   533,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 37 CYS CHI1:  (37 CYX N)-(37 CYX CA)-(37 CYX CB)-(37 CYX SG) -90.0 210.0
 &rst     iat =   539,   541,   543,   546,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 37 CYS CHI1:  (37 CYX N)-(37 CYX CA)-(37 CYX CB)-(37 CYX SG) -330.0 -30.0
 &rst     iat =   539,   541,   543,   546,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 37 CYS CHI1:  (37 CYX N)-(37 CYX CA)-(37 CYX CB)-(37 CYX SG) -210.0  90.0
 &rst     iat =   539,   541,   543,   546,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 39 VAL CHI1:  (39 VAL N)-(39 VAL CA)-(39 VAL CB)-(39 VAL CG1) -90.0 210.0
 &rst     iat =   556,   558,   560,   562,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 39 VAL CHI1:  (39 VAL N)-(39 VAL CA)-(39 VAL CB)-(39 VAL CG1) -330.0 -30.0
 &rst     iat =   556,   558,   560,   562,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 39 VAL CHI1:  (39 VAL N)-(39 VAL CA)-(39 VAL CB)-(39 VAL CG1) -210.0  90.0
 &rst     iat =   556,   558,   560,   562,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 41 ILE CHI1:  (41 ILE N)-(41 ILE CA)-(41 ILE CB)-(41 ILE CG1) -90.0 210.0
 &rst     iat =   586,   588,   590,   596,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 41 ILE CHI1:  (41 ILE N)-(41 ILE CA)-(41 ILE CB)-(41 ILE CG1) -330.0 -30.0
 &rst     iat =   586,   588,   590,   596,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 41 ILE CHI1:  (41 ILE N)-(41 ILE CA)-(41 ILE CB)-(41 ILE CG1) -210.0  90.0
 &rst     iat =   586,   588,   590,   596,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 41 ILE CHI21:  (41 ILE CA)-(41 ILE CB)-(41 ILE CG1)-(41 ILE CD1) -90.0 210.0
 &rst     iat =   588,   590,   596,   599,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 41 ILE CHI21:  (41 ILE CA)-(41 ILE CB)-(41 ILE CG1)-(41 ILE CD1) -330.0 -30.0
 &rst     iat =   588,   590,   596,   599,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 41 ILE CHI21:  (41 ILE CA)-(41 ILE CB)-(41 ILE CG1)-(41 ILE CD1) -210.0  90.0
 &rst     iat =   588,   590,   596,   599,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 42 SER CHI1:  (42 SER N)-(42 SER CA)-(42 SER CB)-(42 SER OG) -90.0 210.0
 &rst     iat =   605,   607,   609,   612,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 42 SER CHI1:  (42 SER N)-(42 SER CA)-(42 SER CB)-(42 SER OG) -330.0 -30.0
 &rst     iat =   605,   607,   609,   612,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 42 SER CHI1:  (42 SER N)-(42 SER CA)-(42 SER CB)-(42 SER OG) -210.0  90.0
 &rst     iat =   605,   607,   609,   612,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 43 TYR CHI1:  (43 TYR N)-(43 TYR CA)-(43 TYR CB)-(43 TYR CG) -90.0 210.0
 &rst     iat =   616,   618,   620,   623,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 43 TYR CHI1:  (43 TYR N)-(43 TYR CA)-(43 TYR CB)-(43 TYR CG) -330.0 -30.0
 &rst     iat =   616,   618,   620,   623,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 43 TYR CHI1:  (43 TYR N)-(43 TYR CA)-(43 TYR CB)-(43 TYR CG) -210.0  90.0
 &rst     iat =   616,   618,   620,   623,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 44 LEU CHI1:  (44 LEU N)-(44 LEU CA)-(44 LEU CB)-(44 LEU CG) -90.0 210.0
 &rst     iat =   637,   639,   641,   644,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 44 LEU CHI1:  (44 LEU N)-(44 LEU CA)-(44 LEU CB)-(44 LEU CG) -330.0 -30.0
 &rst     iat =   637,   639,   641,   644,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 44 LEU CHI1:  (44 LEU N)-(44 LEU CA)-(44 LEU CB)-(44 LEU CG) -210.0  90.0
 &rst     iat =   637,   639,   641,   644,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

# 44 LEU CHI2:  (44 LEU CA)-(44 LEU CB)-(44 LEU CG)-(44 LEU CD1) -90.0 210.0
 &rst     iat =   639,   641,   644,   646,
	  r1 = -91.0, r2 = -90.0, r3 = 210.0, r4 = 211.0,
	&end

# 44 LEU CHI2:  (44 LEU CA)-(44 LEU CB)-(44 LEU CG)-(44 LEU CD1) -330.0 -30.0
 &rst     iat =   639,   641,   644,   646,
	  r1 = -331.0, r2 = -330.0, r3 = -30.0, r4 = -29.0,
	&end

# 44 LEU CHI2:  (44 LEU CA)-(44 LEU CB)-(44 LEU CG)-(44 LEU CD1) -210.0  90.0
 &rst     iat =   639,   641,   644,   646,
	  r1 = -211.0, r2 = -210.0, r3 =  90.0, r4 =  91.0,
	&end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H1       ALA   1  27.654  19.704  37.500
    2    H2   ALA   1           H2       ALA   1  27.781  21.341  37.444
    3    H3   ALA   1           H3       ALA   1  28.075  20.451  36.097
    4    HA   ALA   1           HA       ALA   1  25.468  20.610  37.455
    5    HB1  ALA   1           HB1      ALA   1  24.784  21.964  35.430
    6    HB2  ALA   1           HB2      ALA   1  25.959  22.783  36.449
    7    HB3  ALA   1           HB3      ALA   1  26.482  22.014  34.935
    8    H    LYS   2           H        LYS   2  24.011  19.015  36.816
    9    HA   LYS   2           HA       LYS   2  24.427  17.622  34.239
   10    HB2  LYS   2           HB2      LYS   2  24.612  15.426  35.147
   11    HB3  LYS   2           HB3      LYS   2  25.892  16.431  35.807
   12    HG2  LYS   2           HG2      LYS   2  24.584  16.659  37.944
   13    HG3  LYS   2           HG3      LYS   2  23.312  15.656  37.255
   14    HD2  LYS   2           HD2      LYS   2  24.672  14.281  38.694
   15    HD3  LYS   2           HD3      LYS   2  24.932  13.753  37.028
   16    HE2  LYS   2           HE2      LYS   2  27.078  14.970  36.962
   17    HE3  LYS   2           HE3      LYS   2  26.742  15.668  38.550
   18    HZ1  LYS   2           HZ1      LYS   2  27.280  12.793  38.007
   19    HZ2  LYS   2           HZ2      LYS   2  28.234  13.848  38.801
   20    HZ3  LYS   2           HZ3      LYS   2  26.810  13.363  39.464
   21    H    ASN   3           H        ASN   3  22.206  18.568  36.738
   22    HA   ASN   3           HA       ASN   3  20.053  16.908  35.703
   23    HB2  ASN   3           HB2      ASN   3  18.666  17.883  37.241
   24    HB3  ASN   3           HB3      ASN   3  20.235  17.836  38.048
   25   HD21  ASN   3          HD21      ASN   3  20.342  21.337  38.513
   26   HD22  ASN   3          HD22      ASN   3  21.271  19.821  38.520
   27    H    GLN   4           H        GLN   4  21.058  20.261  35.162
   28    HA   GLN   4           HA       GLN   4  19.599  20.137  32.554
   29    HB2  GLN   4           HB2      GLN   4  18.705  22.339  32.761
   30    HB3  GLN   4           HB3      GLN   4  18.160  21.363  34.114
   31    HG2  GLN   4           HG2      GLN   4  19.876  22.457  35.574
   32    HG3  GLN   4           HG3      GLN   4  20.377  23.457  34.193
   33   HE21  GLN   4          HE21      GLN   4  18.450  24.687  33.084
   34   HE22  GLN   4          HE22      GLN   4  17.282  25.364  34.227
   35    H    PHE   5           H        PHE   5  22.575  20.563  33.945
   36    HA   PHE   5           HA       PHE   5  24.570  21.378  33.246
   37    HB2  PHE   5           HB2      PHE   5  23.373  21.358  30.476
   38    HB3  PHE   5           HB3      PHE   5  25.073  21.347  30.889
   39    HD1  PHE   5           HD1      PHE   5  26.101  19.313  31.991
   40    HD2  PHE   5           HD2      PHE   5  22.062  19.327  30.485
   41    HE1  PHE   5           HE1      PHE   5  26.082  16.836  32.015
   42    HE2  PHE   5           HE2      PHE   5  22.057  16.830  30.493
   43    HZ   PHE   5           HZ       PHE   5  24.064  15.593  31.258
   44    H    GLY   6           H        GLY   6  22.464  23.382  34.002
   45    HA2  GLY   6           HA2      GLY   6  22.415  25.706  34.219
   46    HA3  GLY   6           HA3      GLY   6  23.841  25.825  33.187
   47    H    CYS   7           H        CYS   7  21.823  24.037  31.336
   48    HA   CYS   7           HA       CYS   7  21.095  26.278  29.638
   49    HB2  CYS   7           HB2      CYS   7  20.599  23.288  29.404
   50    HB3  CYS   7           HB3      CYS   7  20.302  24.456  28.147
   51    H    PHE   8           H        PHE   8  19.084  27.016  29.152
   52    HA   PHE   8           HA       PHE   8  16.701  25.456  29.823
   53    HB2  PHE   8           HB2      PHE   8  17.059  26.779  31.900
   54    HB3  PHE   8           HB3      PHE   8  17.008  28.254  30.955
   55    HD1  PHE   8           HD1      PHE   8  14.901  29.153  30.091
   56    HD2  PHE   8           HD2      PHE   8  15.019  25.448  32.296
   57    HE1  PHE   8           HE1      PHE   8  12.428  29.212  30.334
   58    HE2  PHE   8           HE2      PHE   8  12.547  25.527  32.557
   59    HZ   PHE   8           HZ       PHE   8  11.253  27.403  31.569
   60    H    ALA   9           H        ALA   9  14.998  25.891  28.415
   61    HA   ALA   9           HA       ALA   9  14.113  26.409  26.399
   62    HB1  ALA   9           HB1      ALA   9  14.768  29.212  27.373
   63    HB2  ALA   9           HB2      ALA   9  13.536  28.778  26.174
   64    HB3  ALA   9           HB3      ALA   9  13.365  28.223  27.847
   65    H    ASN  10           H        ASN  10  16.814  25.646  26.050
   66    HA   ASN  10           HA       ASN  10  18.335  25.418  24.403
   67    HB2  ASN  10           HB2      ASN  10  16.712  27.312  22.660
   68    HB3  ASN  10           HB3      ASN  10  18.009  26.279  22.136
   69   HD21  ASN  10          HD21      ASN  10  14.646  26.377  22.978
   70   HD22  ASN  10          HD22      ASN  10  14.349  24.647  22.751
   71    H    VAL  11           H        VAL  11  18.407  27.800  26.420
   72    HA   VAL  11           HA       VAL  11  20.716  29.215  25.153
   73    HB   VAL  11           HB       VAL  11  18.560  30.436  26.923
   74   HG11  VAL  11          HG11      VAL  11  20.684  31.643  27.176
   75   HG12  VAL  11          HG12      VAL  11  20.897  31.703  25.410
   76   HG13  VAL  11          HG13      VAL  11  19.588  32.603  26.202
   77   HG21  VAL  11          HG21      VAL  11  19.031  30.714  23.914
   78   HG22  VAL  11          HG22      VAL  11  17.611  29.998  24.706
   79   HG23  VAL  11          HG23      VAL  11  17.914  31.716  24.872
   80    H    ASP  12           H        ASP  12  22.412  29.780  26.408
   81    HA   ASP  12           HA       ASP  12  22.980  28.441  28.892
   82    HB2  ASP  12           HB2      ASP  12  24.452  30.695  27.442
   83    HB3  ASP  12           HB3      ASP  12  25.115  29.710  28.740
   84    H    VAL  13           H        VAL  13  20.683  29.917  29.428
   85    HA   VAL  13           HA       VAL  13  21.199  32.576  30.427
   86    HB   VAL  13           HB       VAL  13  18.945  32.098  31.719
   87   HG11  VAL  13          HG11      VAL  13  19.062  32.322  28.697
   88   HG12  VAL  13          HG12      VAL  13  17.704  32.776  29.737
   89   HG13  VAL  13          HG13      VAL  13  19.234  33.664  29.848
   90   HG21  VAL  13          HG21      VAL  13  18.933  29.609  31.232
   91   HG22  VAL  13          HG22      VAL  13  17.497  30.492  30.688
   92   HG23  VAL  13          HG23      VAL  13  18.723  30.008  29.512
   93    H    LYS  14           H        LYS  14  20.737  29.497  32.243
   94    HA   LYS  14           HA       LYS  14  21.417  30.884  34.751
   95    HB2  LYS  14           HB2      LYS  14  20.684  27.970  34.375
   96    HB3  LYS  14           HB3      LYS  14  20.704  28.927  35.854
   97    HG2  LYS  14           HG2      LYS  14  18.992  30.491  34.546
   98    HG3  LYS  14           HG3      LYS  14  18.801  29.081  33.497
   99    HD2  LYS  14           HD2      LYS  14  17.072  28.995  35.080
  100    HD3  LYS  14           HD3      LYS  14  18.232  27.732  35.552
  101    HE2  LYS  14           HE2      LYS  14  19.147  29.161  37.311
  102    HE3  LYS  14           HE3      LYS  14  18.240  30.556  36.714
  103    HZ1  LYS  14           HZ1      LYS  14  17.215  29.591  38.664
  104    HZ2  LYS  14           HZ2      LYS  14  16.190  29.430  37.363
  105    HZ3  LYS  14           HZ3      LYS  14  17.024  28.140  37.938
  106    H    GLY  15           H        GLY  15  23.082  28.831  32.470
  107    HA2  GLY  15           HA2      GLY  15  25.638  29.514  33.480
  108    HA3  GLY  15           HA3      GLY  15  25.235  27.889  34.054
  109    H    ASP  16           H        ASP  16  27.303  27.756  32.676
  110    HA   ASP  16           HA       ASP  16  26.742  27.260  29.807
  111    HB2  ASP  16           HB2      ASP  16  29.059  27.218  29.451
  112    HB3  ASP  16           HB3      ASP  16  28.798  28.552  30.567
  113    H    CYS  17           H        CYS  17  27.129  25.320  28.783
  114    HA   CYS  17           HA       CYS  17  27.317  22.852  30.461
  115    HB2  CYS  17           HB2      CYS  17  25.430  22.969  28.933
  116    HB3  CYS  17           HB3      CYS  17  26.506  23.336  27.580
  117    H    LYS  18           H        LYS  18  29.255  24.987  28.573
  118    HA   LYS  18           HA       LYS  18  30.986  23.263  27.206
  119    HB2  LYS  18           HB2      LYS  18  30.824  25.754  27.040
  120    HB3  LYS  18           HB3      LYS  18  31.765  25.906  28.523
  121    HG2  LYS  18           HG2      LYS  18  32.863  24.154  26.324
  122    HG3  LYS  18           HG3      LYS  18  32.810  25.873  25.991
  123    HD2  LYS  18           HD2      LYS  18  34.111  24.829  28.527
  124    HD3  LYS  18           HD3      LYS  18  34.973  24.882  26.975
  125    HE2  LYS  18           HE2      LYS  18  34.340  27.322  26.779
  126    HE3  LYS  18           HE3      LYS  18  33.725  27.255  28.430
  127    HZ1  LYS  18           HZ1      LYS  18  35.995  26.691  29.167
  128    HZ2  LYS  18           HZ2      LYS  18  36.548  26.715  27.621
  129    HZ3  LYS  18           HZ3      LYS  18  36.007  28.089  28.322
  130    H    ARG  19           H        ARG  19  31.150  24.132  30.692
  131    HA   ARG  19           HA       ARG  19  33.586  22.674  31.170
  132    HB2  ARG  19           HB2      ARG  19  31.447  23.946  32.784
  133    HB3  ARG  19           HB3      ARG  19  32.080  22.495  33.550
  134    HG2  ARG  19           HG2      ARG  19  33.315  24.465  34.286
  135    HG3  ARG  19           HG3      ARG  19  34.355  23.339  33.426
  136    HD2  ARG  19           HD2      ARG  19  34.940  25.524  32.790
  137    HD3  ARG  19           HD3      ARG  19  34.201  24.768  31.378
  138    HE   ARG  19           HE       ARG  19  32.053  26.067  32.162
  139   HH11  ARG  19          HH11      ARG  19  35.310  27.327  31.955
  140   HH12  ARG  19          HH12      ARG  19  34.755  28.976  32.274
  141   HH21  ARG  19          HH21      ARG  19  31.491  28.165  32.643
  142   HH22  ARG  19          HH22      ARG  19  32.733  29.419  32.669
  143    H    HIS  20           H        HIS  20  30.347  21.332  30.827
  144    HA   HIS  20           HA       HIS  20  31.188  18.666  31.776
  145    HB2  HIS  20           HB2      HIS  20  28.895  19.146  32.069
  146    HB3  HIS  20           HB3      HIS  20  28.712  19.789  30.445
  147    HD2  HIS  20           HD2      HIS  20  27.761  18.245  28.656
  148    HE1  HIS  20           HE1      HIS  20  28.071  14.506  30.662
  149    HE2  HIS  20           HE2      HIS  20  27.191  15.681  28.587
  150    H    CYS  21           H        CYS  21  30.720  20.240  28.557
  151    HA   CYS  21           HA       CYS  21  31.556  17.795  27.200
  152    HB2  CYS  21           HB2      CYS  21  30.940  20.577  26.211
  153    HB3  CYS  21           HB3      CYS  21  31.359  19.240  25.155
  154    H    LYS  22           H        LYS  22  33.339  20.738  28.170
  155    HA   LYS  22           HA       LYS  22  35.689  20.310  26.643
  156    HB2  LYS  22           HB2      LYS  22  35.146  22.360  27.953
  157    HB3  LYS  22           HB3      LYS  22  35.326  21.454  29.449
  158    HG2  LYS  22           HG2      LYS  22  37.242  22.752  29.245
  159    HG3  LYS  22           HG3      LYS  22  37.770  21.122  28.881
  160    HD2  LYS  22           HD2      LYS  22  37.108  23.214  26.755
  161    HD3  LYS  22           HD3      LYS  22  38.702  23.034  27.458
  162    HE2  LYS  22           HE2      LYS  22  37.727  20.448  26.523
  163    HE3  LYS  22           HE3      LYS  22  37.615  21.660  25.229
  164    HZ1  LYS  22           HZ1      LYS  22  39.784  20.503  25.293
  165    HZ2  LYS  22           HZ2      LYS  22  39.966  22.137  25.566
  166    HZ3  LYS  22           HZ3      LYS  22  40.058  21.094  26.822
  167    H    ALA  23           H        ALA  23  34.590  18.735  29.645
  168    HA   ALA  23           HA       ALA  23  37.004  17.256  30.197
  169    HB1  ALA  23           HB1      ALA  23  34.092  16.716  30.911
  170    HB2  ALA  23           HB2      ALA  23  35.505  15.953  31.664
  171    HB3  ALA  23           HB3      ALA  23  35.234  17.696  31.857
  172    H    GLU  24           H        GLU  24  34.549  16.857  27.776
  173    HA   GLU  24           HA       GLU  24  35.488  14.148  26.984
  174    HB2  GLU  24           HB2      GLU  24  33.231  15.803  25.830
  175    HB3  GLU  24           HB3      GLU  24  33.554  14.115  25.518
  176    HG2  GLU  24           HG2      GLU  24  32.739  15.152  28.272
  177    HG3  GLU  24           HG3      GLU  24  31.594  14.718  27.024
  178    H    ASP  25           H        ASP  25  36.649  17.138  26.674
  179    HA   ASP  25           HA       ASP  25  37.628  18.506  25.250
  180    HB2  ASP  25           HB2      ASP  25  39.128  16.459  25.171
  181    HB3  ASP  25           HB3      ASP  25  38.457  16.146  23.571
  182    H    LYS  26           H        LYS  26  34.875  18.204  24.821
  183    HA   LYS  26           HA       LYS  26  34.504  18.742  21.902
  184    HB2  LYS  26           HB2      LYS  26  32.595  17.562  23.952
  185    HB3  LYS  26           HB3      LYS  26  32.191  17.949  22.286
  186    HG2  LYS  26           HG2      LYS  26  34.500  16.300  22.099
  187    HG3  LYS  26           HG3      LYS  26  33.515  15.582  23.387
  188    HD2  LYS  26           HD2      LYS  26  31.552  15.562  21.851
  189    HD3  LYS  26           HD3      LYS  26  32.545  16.354  20.621
  190    HE2  LYS  26           HE2      LYS  26  32.427  14.024  20.085
  191    HE3  LYS  26           HE3      LYS  26  34.080  14.431  20.553
  192    HZ1  LYS  26           HZ1      LYS  26  33.270  12.338  21.481
  193    HZ2  LYS  26           HZ2      LYS  26  33.718  13.336  22.680
  194    HZ3  LYS  26           HZ3      LYS  26  32.118  13.133  22.379
  195    H    GLU  27           H        GLU  27  32.729  20.074  21.280
  196    HA   GLU  27           HA       GLU  27  32.454  22.522  22.900
  197    HB2  GLU  27           HB2      GLU  27  31.151  21.607  20.297
  198    HB3  GLU  27           HB3      GLU  27  30.720  23.077  21.164
  199    HG2  GLU  27           HG2      GLU  27  33.240  23.697  21.017
  200    HG3  GLU  27           HG3      GLU  27  33.329  22.456  19.766
  201    H    GLY  28           H        GLY  28  30.615  23.124  23.961
  202    HA2  GLY  28           HA2      GLY  28  28.481  21.056  24.472
  203    HA3  GLY  28           HA3      GLY  28  28.938  22.285  25.649
  204    H    ILE  29           H        ILE  29  26.331  21.571  24.013
  205    HA   ILE  29           HA       ILE  29  25.654  24.360  23.415
  206    HB   ILE  29           HB       ILE  29  26.533  23.472  21.393
  207   HG12  ILE  29          HG12      ILE  29  24.596  25.112  21.526
  208   HG13  ILE  29          HG13      ILE  29  25.067  24.424  19.981
  209   HG21  ILE  29          HG21      ILE  29  26.182  21.128  21.464
  210   HG22  ILE  29          HG22      ILE  29  24.418  21.311  21.459
  211   HG23  ILE  29          HG23      ILE  29  25.377  21.765  20.034
  212   HD11  ILE  29          HD11      ILE  29  22.615  24.577  20.255
  213   HD12  ILE  29          HD12      ILE  29  23.176  22.931  19.956
  214   HD13  ILE  29          HD13      ILE  29  22.699  23.421  21.599
  215    H    CYS  30           H        CYS  30  23.836  24.953  24.250
  216    HA   CYS  30           HA       CYS  30  22.210  23.120  25.744
  217    HB2  CYS  30           HB2      CYS  30  21.866  26.062  25.065
  218    HB3  CYS  30           HB3      CYS  30  20.819  25.161  26.160
  219    H    HIS  31           H        HIS  31  20.809  21.757  24.923
  220    HA   HIS  31           HA       HIS  31  18.846  22.642  22.827
  221    HB2  HIS  31           HB2      HIS  31  19.967  19.894  23.410
  222    HB3  HIS  31           HB3      HIS  31  18.420  20.135  22.607
  223    HD2  HIS  31           HD2      HIS  31  22.198  20.745  21.985
  224    HE1  HIS  31           HE1      HIS  31  20.241  20.657  18.212
  225    HE2  HIS  31           HE2      HIS  31  22.488  20.560  19.402
  226    H    GLY  32           H        GLY  32  17.257  23.458  23.891
  227    HA2  GLY  32           HA2      GLY  32  15.382  23.683  25.206
  228    HA3  GLY  32           HA3      GLY  32  15.483  21.951  25.504
  229    H    THR  33           H        THR  33  15.422  21.532  27.548
  230    HA   THR  33           HA       THR  33  16.703  23.242  29.620
  231    HB   THR  33           HB       THR  33  15.337  21.896  31.197
  232    HG1  THR  33           HG1      THR  33  13.910  20.478  30.424
  233   HG21  THR  33          HG21      THR  33  13.633  23.046  28.940
  234   HG22  THR  33          HG22      THR  33  13.173  22.836  30.638
  235   HG23  THR  33          HG23      THR  33  14.422  24.014  30.204
  236    H    LYS  34           H        LYS  34  17.892  21.126  27.716
  237    HA   LYS  34           HA       LYS  34  19.766  19.875  29.640
  238    HB2  LYS  34           HB2      LYS  34  18.361  18.649  27.207
  239    HB3  LYS  34           HB3      LYS  34  19.684  17.870  28.061
  240    HG2  LYS  34           HG2      LYS  34  16.975  18.533  29.272
  241    HG3  LYS  34           HG3      LYS  34  17.540  16.946  28.719
  242    HD2  LYS  34           HD2      LYS  34  19.511  17.246  30.370
  243    HD3  LYS  34           HD3      LYS  34  18.568  18.555  31.098
  244    HE2  LYS  34           HE2      LYS  34  17.693  15.695  30.683
  245    HE3  LYS  34           HE3      LYS  34  18.262  16.383  32.215
  246    HZ1  LYS  34           HZ1      LYS  34  15.879  16.364  32.232
  247    HZ2  LYS  34           HZ2      LYS  34  16.329  17.923  32.084
  248    HZ3  LYS  34           HZ3      LYS  34  15.769  17.112  30.770
  249    H    CYS  35           H        CYS  35  21.447  18.701  27.970
  250    HA   CYS  35           HA       CYS  35  22.416  20.712  26.021
  251    HB2  CYS  35           HB2      CYS  35  23.520  21.116  28.185
  252    HB3  CYS  35           HB3      CYS  35  24.056  19.433  28.227
  253    H    LYS  36           H        LYS  36  23.989  19.876  24.546
  254    HA   LYS  36           HA       LYS  36  24.318  16.967  24.201
  255    HB2  LYS  36           HB2      LYS  36  23.064  19.046  22.437
  256    HB3  LYS  36           HB3      LYS  36  24.155  18.014  21.636
  257    HG2  LYS  36           HG2      LYS  36  22.832  16.031  22.548
  258    HG3  LYS  36           HG3      LYS  36  21.714  17.202  23.282
  259    HD2  LYS  36           HD2      LYS  36  21.241  18.108  20.977
  260    HD3  LYS  36           HD3      LYS  36  22.260  16.809  20.311
  261    HE2  LYS  36           HE2      LYS  36  20.797  15.140  21.476
  262    HE3  LYS  36           HE3      LYS  36  19.769  16.458  22.051
  263    HZ1  LYS  36           HZ1      LYS  36  20.288  15.894  19.178
  264    HZ2  LYS  36           HZ2      LYS  36  18.968  15.354  19.987
  265    HZ3  LYS  36           HZ3      LYS  36  19.184  16.971  19.776
  266    H    CYS  37           H        CYS  37  26.401  16.560  23.554
  267    HA   CYS  37           HA       CYS  37  28.258  18.874  23.418
  268    HB2  CYS  37           HB2      CYS  37  28.944  15.948  23.360
  269    HB3  CYS  37           HB3      CYS  37  30.066  17.293  23.330
  270    H    GLY  38           H        GLY  38  29.190  19.571  21.631
  271    HA2  GLY  38           HA2      GLY  38  28.104  18.727  19.002
  272    HA3  GLY  38           HA3      GLY  38  29.028  20.198  19.360
  273    H    VAL  39           H        VAL  39  30.621  19.914  17.831
  274    HA   VAL  39           HA       VAL  39  32.087  17.468  17.528
  275    HB   VAL  39           HB       VAL  39  33.720  18.936  16.206
  276   HG11  VAL  39          HG11      VAL  39  32.216  19.139  14.326
  277   HG12  VAL  39          HG12      VAL  39  31.898  17.633  15.196
  278   HG13  VAL  39          HG13      VAL  39  30.794  19.016  15.385
  279   HG21  VAL  39          HG21      VAL  39  31.617  21.098  16.660
  280   HG22  VAL  39          HG22      VAL  39  33.249  21.074  17.355
  281   HG23  VAL  39          HG23      VAL  39  33.023  21.175  15.601
  282    HA   PRO  40           HA       PRO  40  35.431  17.791  20.463
  283    HB2  PRO  40           HB2      PRO  40  37.530  16.737  19.042
  284    HB3  PRO  40           HB3      PRO  40  36.239  15.784  19.828
  285    HG2  PRO  40           HG2      PRO  40  36.474  16.579  16.930
  286    HG3  PRO  40           HG3      PRO  40  35.959  15.008  17.615
  287    HD2  PRO  40           HD2      PRO  40  34.198  16.902  16.701
  288    HD3  PRO  40           HD3      PRO  40  33.779  15.846  18.070
  289    H    ILE  41           H        ILE  41  36.901  19.409  21.014
  290    HA   ILE  41           HA       ILE  41  36.859  21.718  19.280
  291    HB   ILE  41           HB       ILE  41  37.775  22.936  21.056
  292   HG12  ILE  41          HG12      ILE  41  38.432  21.575  23.256
  293   HG13  ILE  41          HG13      ILE  41  38.855  20.324  22.092
  294   HG21  ILE  41          HG21      ILE  41  36.268  22.562  22.849
  295   HG22  ILE  41          HG22      ILE  41  35.426  22.007  21.389
  296   HG23  ILE  41          HG23      ILE  41  36.149  20.838  22.530
  297   HD11  ILE  41          HD11      ILE  41  40.437  21.972  21.000
  298   HD12  ILE  41          HD12      ILE  41  39.938  23.181  22.192
  299   HD13  ILE  41          HD13      ILE  41  40.790  21.712  22.711
  300    H    SER  42           H        SER  42  39.243  19.294  20.109
  301    HA   SER  42           HA       SER  42  41.552  20.628  19.135
  302    HB2  SER  42           HB2      SER  42  40.976  17.705  19.757
  303    HB3  SER  42           HB3      SER  42  42.580  18.340  19.340
  304    HG   SER  42           HG       SER  42  41.222  18.486  21.711
  305    H    TYR  43           H        TYR  43  42.399  20.794  17.153
  306    HA   TYR  43           HA       TYR  43  42.002  18.688  15.178
  307    HB2  TYR  43           HB2      TYR  43  41.174  19.984  13.405
  308    HB3  TYR  43           HB3      TYR  43  40.078  20.147  14.754
  309    HD1  TYR  43           HD1      TYR  43  42.172  21.938  12.384
  310    HD2  TYR  43           HD2      TYR  43  40.279  22.191  16.242
  311    HE1  TYR  43           HE1      TYR  43  42.398  24.405  12.337
  312    HE2  TYR  43           HE2      TYR  43  40.581  24.606  16.258
  313    HH   TYR  43           HH       TYR  43  41.672  26.424  13.356
  314    H    LEU  44           H        LEU  44  43.519  18.540  13.620
  315    HA   LEU  44           HA       LEU  44  46.095  19.905  14.112
  316    HB2  LEU  44           HB2      LEU  44  46.026  17.467  14.168
  317    HB3  LEU  44           HB3      LEU  44  45.278  17.412  12.577
  318    HG   LEU  44           HG       LEU  44  47.335  18.361  11.564
  319   HD11  LEU  44          HD11      LEU  44  48.458  18.084  14.389
  320   HD12  LEU  44          HD12      LEU  44  49.424  18.377  12.928
  321   HD13  LEU  44          HD13      LEU  44  48.268  19.597  13.473
  322   HD21  LEU  44          HD21      LEU  44  46.964  15.924  11.712
  323   HD22  LEU  44          HD22      LEU  44  47.791  15.891  13.286
  324   HD23  LEU  44          HD23      LEU  44  48.682  16.330  11.815
  Start of MODEL    2
    1    H1   ALA   1           H1       ALA   1  23.350  24.378  40.408
    2    H2   ALA   1           H2       ALA   1  22.267  25.590  40.148
    3    H3   ALA   1           H3       ALA   1  23.574  25.439  39.162
    4    HA   ALA   1           HA       ALA   1  21.375  23.516  39.387
    5    HB1  ALA   1           HB1      ALA   1  20.707  24.199  37.168
    6    HB2  ALA   1           HB2      ALA   1  20.765  25.636  38.201
    7    HB3  ALA   1           HB3      ALA   1  22.072  25.329  37.038
    8    H    LYS   2           H        LYS   2  21.758  21.527  38.544
    9    HA   LYS   2           HA       LYS   2  24.157  21.021  36.852
   10    HB2  LYS   2           HB2      LYS   2  24.805  19.119  38.144
   11    HB3  LYS   2           HB3      LYS   2  24.843  20.560  39.152
   12    HG2  LYS   2           HG2      LYS   2  22.838  19.868  40.346
   13    HG3  LYS   2           HG3      LYS   2  22.546  18.553  39.200
   14    HD2  LYS   2           HD2      LYS   2  23.461  17.482  41.064
   15    HD3  LYS   2           HD3      LYS   2  24.782  17.567  39.897
   16    HE2  LYS   2           HE2      LYS   2  25.508  19.725  41.123
   17    HE3  LYS   2           HE3      LYS   2  24.331  19.290  42.372
   18    HZ1  LYS   2           HZ1      LYS   2  26.543  18.427  42.906
   19    HZ2  LYS   2           HZ2      LYS   2  25.550  17.147  42.621
   20    HZ3  LYS   2           HZ3      LYS   2  26.636  17.632  41.493
   21    H    ASN   3           H        ASN   3  20.971  19.974  37.950
   22    HA   ASN   3           HA       ASN   3  20.769  17.615  36.365
   23    HB2  ASN   3           HB2      ASN   3  18.329  17.853  36.914
   24    HB3  ASN   3           HB3      ASN   3  19.429  17.838  38.287
   25   HD21  ASN   3          HD21      ASN   3  17.594  20.485  39.591
   26   HD22  ASN   3          HD22      ASN   3  17.878  18.758  39.659
   27    H    GLN   4           H        GLN   4  19.695  20.914  35.715
   28    HA   GLN   4           HA       GLN   4  18.941  20.284  32.948
   29    HB2  GLN   4           HB2      GLN   4  18.155  22.519  32.831
   30    HB3  GLN   4           HB3      GLN   4  17.702  21.894  34.413
   31    HG2  GLN   4           HG2      GLN   4  19.765  23.089  35.345
   32    HG3  GLN   4           HG3      GLN   4  19.951  23.824  33.737
   33   HE21  GLN   4          HE21      GLN   4  17.843  24.932  32.866
   34   HE22  GLN   4          HE22      GLN   4  16.970  25.866  34.097
   35    H    PHE   5           H        PHE   5  21.918  20.390  34.274
   36    HA   PHE   5           HA       PHE   5  24.025  21.003  33.717
   37    HB2  PHE   5           HB2      PHE   5  22.921  21.046  30.897
   38    HB3  PHE   5           HB3      PHE   5  24.619  21.133  31.292
   39    HD1  PHE   5           HD1      PHE   5  25.921  19.273  31.802
   40    HD2  PHE   5           HD2      PHE   5  21.639  18.879  31.458
   41    HE1  PHE   5           HE1      PHE   5  26.142  16.795  31.726
   42    HE2  PHE   5           HE2      PHE   5  21.877  16.404  31.355
   43    HZ   PHE   5           HZ       PHE   5  24.136  15.370  31.486
   44    H    GLY   6           H        GLY   6  21.784  23.197  33.957
   45    HA2  GLY   6           HA2      GLY   6  22.016  25.545  34.326
   46    HA3  GLY   6           HA3      GLY   6  23.505  25.527  33.382
   47    H    CYS   7           H        CYS   7  21.390  23.820  31.471
   48    HA   CYS   7           HA       CYS   7  21.050  26.069  29.653
   49    HB2  CYS   7           HB2      CYS   7  20.207  23.155  29.484
   50    HB3  CYS   7           HB3      CYS   7  20.016  24.318  28.201
   51    H    PHE   8           H        PHE   8  19.232  27.134  29.163
   52    HA   PHE   8           HA       PHE   8  16.628  25.826  29.452
   53    HB2  PHE   8           HB2      PHE   8  16.876  26.904  31.676
   54    HB3  PHE   8           HB3      PHE   8  17.089  28.449  30.895
   55    HD1  PHE   8           HD1      PHE   8  15.220  29.739  30.104
   56    HD2  PHE   8           HD2      PHE   8  14.679  25.703  31.531
   57    HE1  PHE   8           HE1      PHE   8  12.745  30.067  30.120
   58    HE2  PHE   8           HE2      PHE   8  12.212  26.004  31.470
   59    HZ   PHE   8           HZ       PHE   8  11.251  28.186  30.782
   60    H    ALA   9           H        ALA   9  15.126  26.546  27.917
   61    HA   ALA   9           HA       ALA   9  14.519  27.341  25.900
   62    HB1  ALA   9           HB1      ALA   9  14.296  29.756  25.743
   63    HB2  ALA   9           HB2      ALA   9  13.912  29.194  27.383
   64    HB3  ALA   9           HB3      ALA   9  15.476  29.977  27.055
   65    H    ASN  10           H        ASN  10  16.994  26.097  25.736
   66    HA   ASN  10           HA       ASN  10  18.788  25.769  24.484
   67    HB2  ASN  10           HB2      ASN  10  17.442  27.616  22.460
   68    HB3  ASN  10           HB3      ASN  10  18.804  26.569  22.139
   69   HD21  ASN  10          HD21      ASN  10  16.978  24.258  21.144
   70   HD22  ASN  10          HD22      ASN  10  18.530  24.519  21.868
   71    H    VAL  11           H        VAL  11  18.881  28.089  26.407
   72    HA   VAL  11           HA       VAL  11  21.388  29.367  25.403
   73    HB   VAL  11           HB       VAL  11  19.176  30.597  27.093
   74   HG11  VAL  11          HG11      VAL  11  21.762  31.820  26.035
   75   HG12  VAL  11          HG12      VAL  11  20.458  32.708  26.846
   76   HG13  VAL  11          HG13      VAL  11  21.381  31.515  27.750
   77   HG21  VAL  11          HG21      VAL  11  20.113  31.209  24.252
   78   HG22  VAL  11          HG22      VAL  11  18.557  30.493  24.700
   79   HG23  VAL  11          HG23      VAL  11  18.922  32.155  25.166
   80    H    ASP  12           H        ASP  12  23.031  29.712  26.829
   81    HA   ASP  12           HA       ASP  12  23.305  27.890  29.074
   82    HB2  ASP  12           HB2      ASP  12  25.183  30.108  28.161
   83    HB3  ASP  12           HB3      ASP  12  25.609  28.699  29.120
   84    H    VAL  13           H        VAL  13  21.219  29.532  29.775
   85    HA   VAL  13           HA       VAL  13  21.983  32.012  31.009
   86    HB   VAL  13           HB       VAL  13  19.622  31.833  32.078
   87   HG11  VAL  13          HG11      VAL  13  20.341  33.166  30.004
   88   HG12  VAL  13          HG12      VAL  13  19.602  31.858  29.067
   89   HG13  VAL  13          HG13      VAL  13  18.623  32.786  30.203
   90   HG21  VAL  13          HG21      VAL  13  19.271  29.382  31.666
   91   HG22  VAL  13          HG22      VAL  13  18.043  30.434  30.942
   92   HG23  VAL  13          HG23      VAL  13  19.299  29.716  29.916
   93    H    LYS  14           H        LYS  14  20.930  28.968  32.684
   94    HA   LYS  14           HA       LYS  14  21.771  30.121  35.272
   95    HB2  LYS  14           HB2      LYS  14  20.367  27.543  34.495
   96    HB3  LYS  14           HB3      LYS  14  20.886  27.939  36.144
   97    HG2  LYS  14           HG2      LYS  14  19.639  30.117  35.973
   98    HG3  LYS  14           HG3      LYS  14  18.962  29.567  34.425
   99    HD2  LYS  14           HD2      LYS  14  17.876  27.688  35.509
  100    HD3  LYS  14           HD3      LYS  14  18.694  28.051  37.051
  101    HE2  LYS  14           HE2      LYS  14  17.683  30.422  36.795
  102    HE3  LYS  14           HE3      LYS  14  16.585  29.700  35.609
  103    HZ1  LYS  14           HZ1      LYS  14  15.604  29.743  37.824
  104    HZ2  LYS  14           HZ2      LYS  14  15.809  28.188  37.368
  105    HZ3  LYS  14           HZ3      LYS  14  16.857  28.874  38.452
  106    H    GLY  15           H        GLY  15  23.288  28.257  32.828
  107    HA2  GLY  15           HA2      GLY  15  25.797  28.322  34.142
  108    HA3  GLY  15           HA3      GLY  15  25.146  26.693  34.332
  109    H    ASP  16           H        ASP  16  27.401  26.760  33.026
  110    HA   ASP  16           HA       ASP  16  27.009  27.332  30.146
  111    HB2  ASP  16           HB2      ASP  16  28.865  28.385  31.399
  112    HB3  ASP  16           HB3      ASP  16  29.517  26.774  31.758
  113    H    CYS  17           H        CYS  17  26.384  25.697  28.844
  114    HA   CYS  17           HA       CYS  17  26.746  22.904  29.481
  115    HB2  CYS  17           HB2      CYS  17  24.930  23.663  28.176
  116    HB3  CYS  17           HB3      CYS  17  25.956  24.490  27.019
  117    H    LYS  18           H        LYS  18  28.751  25.194  27.633
  118    HA   LYS  18           HA       LYS  18  30.587  23.373  26.445
  119    HB2  LYS  18           HB2      LYS  18  30.440  25.651  25.835
  120    HB3  LYS  18           HB3      LYS  18  30.842  26.234  27.423
  121    HG2  LYS  18           HG2      LYS  18  32.712  24.674  25.641
  122    HG3  LYS  18           HG3      LYS  18  32.556  26.438  25.665
  123    HD2  LYS  18           HD2      LYS  18  33.579  24.801  27.997
  124    HD3  LYS  18           HD3      LYS  18  34.550  25.663  26.808
  125    HE2  LYS  18           HE2      LYS  18  32.964  27.710  27.554
  126    HE3  LYS  18           HE3      LYS  18  32.839  26.738  29.028
  127    HZ1  LYS  18           HZ1      LYS  18  35.328  27.716  27.778
  128    HZ2  LYS  18           HZ2      LYS  18  34.664  28.323  29.126
  129    HZ3  LYS  18           HZ3      LYS  18  35.275  26.784  29.168
  130    H    ARG  19           H        ARG  19  30.547  24.590  29.876
  131    HA   ARG  19           HA       ARG  19  32.956  23.406  30.656
  132    HB2  ARG  19           HB2      ARG  19  31.259  25.038  31.785
  133    HB3  ARG  19           HB3      ARG  19  30.444  23.584  32.378
  134    HG2  ARG  19           HG2      ARG  19  32.548  22.892  33.515
  135    HG3  ARG  19           HG3      ARG  19  33.363  24.339  32.885
  136    HD2  ARG  19           HD2      ARG  19  30.942  24.302  34.745
  137    HD3  ARG  19           HD3      ARG  19  32.624  24.631  35.192
  138    HE   ARG  19           HE       ARG  19  31.932  26.482  33.175
  139   HH11  ARG  19          HH11      ARG  19  31.050  25.972  36.565
  140   HH12  ARG  19          HH12      ARG  19  30.726  27.678  36.746
  141   HH21  ARG  19          HH21      ARG  19  31.346  28.462  33.463
  142   HH22  ARG  19          HH22      ARG  19  30.577  28.994  34.958
  143    H    HIS  20           H        HIS  20  29.816  21.762  30.337
  144    HA   HIS  20           HA       HIS  20  30.773  19.249  31.518
  145    HB2  HIS  20           HB2      HIS  20  28.437  19.533  31.590
  146    HB3  HIS  20           HB3      HIS  20  28.344  20.079  29.924
  147    HD2  HIS  20           HD2      HIS  20  27.476  18.414  28.257
  148    HE1  HIS  20           HE1      HIS  20  28.318  14.741  30.235
  149    HE2  HIS  20           HE2      HIS  20  27.254  15.785  28.178
  150    H    CYS  21           H        CYS  21  30.459  20.488  28.132
  151    HA   CYS  21           HA       CYS  21  31.537  18.031  27.066
  152    HB2  CYS  21           HB2      CYS  21  30.909  20.739  25.881
  153    HB3  CYS  21           HB3      CYS  21  31.470  19.378  24.914
  154    H    LYS  22           H        LYS  22  33.080  21.069  28.022
  155    HA   LYS  22           HA       LYS  22  35.632  20.686  26.840
  156    HB2  LYS  22           HB2      LYS  22  34.941  22.796  27.857
  157    HB3  LYS  22           HB3      LYS  22  34.777  22.038  29.434
  158    HG2  LYS  22           HG2      LYS  22  36.789  23.382  29.370
  159    HG3  LYS  22           HG3      LYS  22  37.172  21.691  29.603
  160    HD2  LYS  22           HD2      LYS  22  38.798  22.530  28.107
  161    HD3  LYS  22           HD3      LYS  22  37.725  21.550  27.125
  162    HE2  LYS  22           HE2      LYS  22  38.054  23.447  25.815
  163    HE3  LYS  22           HE3      LYS  22  36.481  23.753  26.559
  164    HZ1  LYS  22           HZ1      LYS  22  39.063  24.842  27.559
  165    HZ2  LYS  22           HZ2      LYS  22  38.049  25.666  26.606
  166    HZ3  LYS  22           HZ3      LYS  22  37.596  25.261  28.134
  167    H    ALA  23           H        ALA  23  34.247  19.262  29.793
  168    HA   ALA  23           HA       ALA  23  36.669  17.949  30.668
  169    HB1  ALA  23           HB1      ALA  23  33.749  17.256  31.144
  170    HB2  ALA  23           HB2      ALA  23  35.130  16.642  32.072
  171    HB3  ALA  23           HB3      ALA  23  34.723  18.369  32.119
  172    H    GLU  24           H        GLU  24  34.376  17.146  28.111
  173    HA   GLU  24           HA       GLU  24  35.677  14.507  27.628
  174    HB2  GLU  24           HB2      GLU  24  33.250  15.791  26.316
  175    HB3  GLU  24           HB3      GLU  24  33.934  14.203  25.937
  176    HG2  GLU  24           HG2      GLU  24  33.557  13.523  28.335
  177    HG3  GLU  24           HG3      GLU  24  32.725  15.063  28.594
  178    H    ASP  25           H        ASP  25  36.597  17.512  27.096
  179    HA   ASP  25           HA       ASP  25  37.598  18.787  25.562
  180    HB2  ASP  25           HB2      ASP  25  38.774  16.122  24.751
  181    HB3  ASP  25           HB3      ASP  25  39.364  17.686  24.196
  182    H    LYS  26           H        LYS  26  34.996  18.366  24.985
  183    HA   LYS  26           HA       LYS  26  34.805  18.553  21.994
  184    HB2  LYS  26           HB2      LYS  26  32.811  17.405  23.989
  185    HB3  LYS  26           HB3      LYS  26  32.435  17.823  22.323
  186    HG2  LYS  26           HG2      LYS  26  34.623  16.239  21.898
  187    HG3  LYS  26           HG3      LYS  26  33.978  15.510  23.387
  188    HD2  LYS  26           HD2      LYS  26  31.788  15.230  22.321
  189    HD3  LYS  26           HD3      LYS  26  32.376  16.089  20.872
  190    HE2  LYS  26           HE2      LYS  26  33.974  14.338  20.385
  191    HE3  LYS  26           HE3      LYS  26  33.623  13.508  21.909
  192    HZ1  LYS  26           HZ1      LYS  26  32.527  12.625  19.822
  193    HZ2  LYS  26           HZ2      LYS  26  31.503  12.889  21.110
  194    HZ3  LYS  26           HZ3      LYS  26  31.539  13.897  19.820
  195    H    GLU  27           H        GLU  27  32.905  19.790  21.260
  196    HA   GLU  27           HA       GLU  27  32.542  22.341  22.728
  197    HB2  GLU  27           HB2      GLU  27  31.572  21.315  20.036
  198    HB3  GLU  27           HB3      GLU  27  31.299  22.927  20.666
  199    HG2  GLU  27           HG2      GLU  27  34.173  22.053  20.479
  200    HG3  GLU  27           HG3      GLU  27  33.293  22.294  18.980
  201    H    GLY  28           H        GLY  28  30.374  23.032  23.233
  202    HA2  GLY  28           HA2      GLY  28  28.448  20.806  23.859
  203    HA3  GLY  28           HA3      GLY  28  28.686  22.187  24.894
  204    H    ILE  29           H        ILE  29  26.124  21.321  24.067
  205    HA   ILE  29           HA       ILE  29  25.088  23.701  22.727
  206    HB   ILE  29           HB       ILE  29  25.479  22.188  20.907
  207   HG12  ILE  29          HG12      ILE  29  23.413  23.713  21.104
  208   HG13  ILE  29          HG13      ILE  29  23.632  22.647  19.725
  209   HG21  ILE  29          HG21      ILE  29  25.449  20.009  21.849
  210   HG22  ILE  29          HG22      ILE  29  23.703  20.118  22.167
  211   HG23  ILE  29          HG23      ILE  29  24.311  20.115  20.505
  212   HD11  ILE  29          HD11      ILE  29  21.983  21.102  20.502
  213   HD12  ILE  29          HD12      ILE  29  21.922  21.863  22.096
  214   HD13  ILE  29          HD13      ILE  29  21.290  22.727  20.679
  215    H    CYS  30           H        CYS  30  23.376  24.437  23.804
  216    HA   CYS  30           HA       CYS  30  21.906  22.717  25.703
  217    HB2  CYS  30           HB2      CYS  30  21.705  25.663  25.026
  218    HB3  CYS  30           HB3      CYS  30  20.606  24.822  26.124
  219    H    HIS  31           H        HIS  31  20.596  21.273  24.667
  220    HA   HIS  31           HA       HIS  31  18.677  22.272  22.609
  221    HB2  HIS  31           HB2      HIS  31  18.063  19.934  22.309
  222    HB3  HIS  31           HB3      HIS  31  19.741  20.291  21.910
  223    HD2  HIS  31           HD2      HIS  31  21.659  19.492  23.766
  224    HE1  HIS  31           HE1      HIS  31  19.118  16.537  25.572
  225    HE2  HIS  31           HE2      HIS  31  21.480  17.467  25.502
  226    H    GLY  32           H        GLY  32  17.285  23.445  23.603
  227    HA2  GLY  32           HA2      GLY  32  15.481  24.097  24.898
  228    HA3  GLY  32           HA3      GLY  32  15.229  22.401  25.325
  229    H    THR  33           H        THR  33  15.770  21.730  27.283
  230    HA   THR  33           HA       THR  33  17.052  23.593  29.228
  231    HB   THR  33           HB       THR  33  15.622  22.700  30.954
  232    HG1  THR  33           HG1      THR  33  13.797  21.376  30.152
  233   HG21  THR  33          HG21      THR  33  13.552  23.669  30.312
  234   HG22  THR  33          HG22      THR  33  14.770  24.540  29.366
  235   HG23  THR  33          HG23      THR  33  13.798  23.278  28.596
  236    H    LYS  34           H        LYS  34  18.129  21.192  27.523
  237    HA   LYS  34           HA       LYS  34  19.798  20.120  29.753
  238    HB2  LYS  34           HB2      LYS  34  18.760  18.426  27.455
  239    HB3  LYS  34           HB3      LYS  34  19.715  17.860  28.821
  240    HG2  LYS  34           HG2      LYS  34  16.855  18.911  28.959
  241    HG3  LYS  34           HG3      LYS  34  17.298  17.225  28.883
  242    HD2  LYS  34           HD2      LYS  34  18.374  18.891  31.175
  243    HD3  LYS  34           HD3      LYS  34  16.683  18.383  31.155
  244    HE2  LYS  34           HE2      LYS  34  17.460  16.017  30.769
  245    HE3  LYS  34           HE3      LYS  34  19.114  16.561  31.074
  246    HZ1  LYS  34           HZ1      LYS  34  18.042  15.672  33.060
  247    HZ2  LYS  34           HZ2      LYS  34  18.381  17.276  33.295
  248    HZ3  LYS  34           HZ3      LYS  34  16.851  16.810  32.995
  249    H    CYS  35           H        CYS  35  21.855  19.185  28.969
  250    HA   CYS  35           HA       CYS  35  22.967  20.751  26.684
  251    HB2  CYS  35           HB2      CYS  35  23.929  21.181  28.891
  252    HB3  CYS  35           HB3      CYS  35  24.289  19.455  29.051
  253    H    LYS  36           H        LYS  36  24.463  19.697  25.246
  254    HA   LYS  36           HA       LYS  36  24.943  16.833  25.312
  255    HB2  LYS  36           HB2      LYS  36  22.942  17.960  23.555
  256    HB3  LYS  36           HB3      LYS  36  24.269  17.655  22.568
  257    HG2  LYS  36           HG2      LYS  36  24.292  15.278  23.679
  258    HG3  LYS  36           HG3      LYS  36  22.738  15.766  24.389
  259    HD2  LYS  36           HD2      LYS  36  23.309  15.663  21.389
  260    HD3  LYS  36           HD3      LYS  36  22.570  14.356  22.322
  261    HE2  LYS  36           HE2      LYS  36  20.823  16.126  23.065
  262    HE3  LYS  36           HE3      LYS  36  21.462  17.131  21.750
  263    HZ1  LYS  36           HZ1      LYS  36  20.884  15.338  20.210
  264    HZ2  LYS  36           HZ2      LYS  36  20.314  14.411  21.473
  265    HZ3  LYS  36           HZ3      LYS  36  19.566  15.814  21.063
  266    H    CYS  37           H        CYS  37  26.616  16.405  23.585
  267    HA   CYS  37           HA       CYS  37  28.327  18.794  23.201
  268    HB2  CYS  37           HB2      CYS  37  29.256  15.925  23.138
  269    HB3  CYS  37           HB3      CYS  37  30.215  17.387  23.029
  270    H    GLY  38           H        GLY  38  29.517  19.072  21.388
  271    HA2  GLY  38           HA2      GLY  38  28.198  18.371  18.790
  272    HA3  GLY  38           HA3      GLY  38  29.136  19.833  19.157
  273    H    VAL  39           H        VAL  39  30.808  19.647  17.729
  274    HA   VAL  39           HA       VAL  39  32.275  17.206  17.432
  275    HB   VAL  39           HB       VAL  39  33.755  18.531  15.943
  276   HG11  VAL  39          HG11      VAL  39  32.132  18.922  14.198
  277   HG12  VAL  39          HG12      VAL  39  31.661  17.478  15.114
  278   HG13  VAL  39          HG13      VAL  39  30.806  19.012  15.372
  279   HG21  VAL  39          HG21      VAL  39  33.660  20.713  17.090
  280   HG22  VAL  39          HG22      VAL  39  33.241  20.839  15.376
  281   HG23  VAL  39          HG23      VAL  39  31.962  20.900  16.602
  282    HA   PRO  40           HA       PRO  40  35.698  17.534  20.309
  283    HB2  PRO  40           HB2      PRO  40  37.347  17.201  17.806
  284    HB3  PRO  40           HB3      PRO  40  37.512  16.361  19.388
  285    HG2  PRO  40           HG2      PRO  40  36.348  15.119  17.274
  286    HG3  PRO  40           HG3      PRO  40  35.664  14.961  18.927
  287    HD2  PRO  40           HD2      PRO  40  34.665  16.699  16.658
  288    HD3  PRO  40           HD3      PRO  40  33.769  15.766  17.880
  289    H    ILE  41           H        ILE  41  37.187  19.165  21.013
  290    HA   ILE  41           HA       ILE  41  36.598  21.718  20.020
  291    HB   ILE  41           HB       ILE  41  38.269  22.600  21.597
  292   HG12  ILE  41          HG12      ILE  41  39.056  20.921  23.380
  293   HG13  ILE  41          HG13      ILE  41  38.881  19.677  22.147
  294   HG21  ILE  41          HG21      ILE  41  35.916  22.149  22.163
  295   HG22  ILE  41          HG22      ILE  41  36.374  20.528  22.721
  296   HG23  ILE  41          HG23      ILE  41  36.992  21.966  23.549
  297   HD11  ILE  41          HD11      ILE  41  41.200  20.626  22.484
  298   HD12  ILE  41          HD12      ILE  41  40.635  20.682  20.821
  299   HD13  ILE  41          HD13      ILE  41  40.615  22.162  21.811
  300    H    SER  42           H        SER  42  39.316  19.779  19.010
  301    HA   SER  42           HA       SER  42  39.869  21.637  16.882
  302    HB2  SER  42           HB2      SER  42  41.122  22.373  19.126
  303    HB3  SER  42           HB3      SER  42  42.271  21.118  18.651
  304    HG   SER  42           HG       SER  42  42.459  23.448  17.934
  305    H    TYR  43           H        TYR  43  39.024  18.995  17.036
  306    HA   TYR  43           HA       TYR  43  41.262  17.401  15.852
  307    HB2  TYR  43           HB2      TYR  43  39.416  16.190  17.907
  308    HB3  TYR  43           HB3      TYR  43  40.891  15.528  17.246
  309    HD1  TYR  43           HD1      TYR  43  43.031  17.214  17.579
  310    HD2  TYR  43           HD2      TYR  43  39.571  16.951  20.145
  311    HE1  TYR  43           HE1      TYR  43  44.295  18.295  19.422
  312    HE2  TYR  43           HE2      TYR  43  40.861  18.010  21.986
  313    HH   TYR  43           HH       TYR  43  42.911  18.796  22.654
  314    H    LEU  44           H        LEU  44  38.646  18.693  14.886
  315    HA   LEU  44           HA       LEU  44  38.167  16.749  12.810
  316    HB2  LEU  44           HB2      LEU  44  36.600  15.894  14.558
  317    HB3  LEU  44           HB3      LEU  44  35.869  17.498  14.677
  318    HG   LEU  44           HG       LEU  44  35.075  17.315  12.336
  319   HD11  LEU  44          HD11      LEU  44  36.769  15.798  11.375
  320   HD12  LEU  44          HD12      LEU  44  35.165  15.099  11.200
  321   HD13  LEU  44          HD13      LEU  44  36.245  14.498  12.469
  322   HD21  LEU  44          HD21      LEU  44  33.699  16.548  14.251
  323   HD22  LEU  44          HD22      LEU  44  34.346  14.908  14.028
  324   HD23  LEU  44          HD23      LEU  44  33.359  15.663  12.760
  Start of MODEL    3
    1    H1   ALA   1           H1       ALA   1  27.774  20.383  37.251
    2    H2   ALA   1           H2       ALA   1  26.655  21.574  37.314
    3    H3   ALA   1           H3       ALA   1  27.431  21.252  35.902
    4    HA   ALA   1           HA       ALA   1  25.271  20.367  35.713
    5    HB1  ALA   1           HB1      ALA   1  27.059  18.997  34.687
    6    HB2  ALA   1           HB2      ALA   1  27.295  18.136  36.218
    7    HB3  ALA   1           HB3      ALA   1  25.768  17.978  35.332
    8    H    LYS   2           H        LYS   2  23.634  20.554  37.110
    9    HA   LYS   2           HA       LYS   2  23.577  18.809  39.562
   10    HB2  LYS   2           HB2      LYS   2  23.707  21.115  40.241
   11    HB3  LYS   2           HB3      LYS   2  22.470  21.593  39.070
   12    HG2  LYS   2           HG2      LYS   2  20.770  20.285  40.341
   13    HG3  LYS   2           HG3      LYS   2  22.024  19.791  41.490
   14    HD2  LYS   2           HD2      LYS   2  20.603  21.605  42.345
   15    HD3  LYS   2           HD3      LYS   2  22.296  22.114  42.219
   16    HE2  LYS   2           HE2      LYS   2  21.881  23.418  40.268
   17    HE3  LYS   2           HE3      LYS   2  20.286  22.688  40.002
   18    HZ1  LYS   2           HZ1      LYS   2  20.346  24.976  41.078
   19    HZ2  LYS   2           HZ2      LYS   2  19.391  23.856  41.784
   20    HZ3  LYS   2           HZ3      LYS   2  20.845  24.224  42.464
   21    H    ASN   3           H        ASN   3  21.588  20.302  37.008
   22    HA   ASN   3           HA       ASN   3  19.966  17.875  36.761
   23    HB2  ASN   3           HB2      ASN   3  17.828  19.074  37.172
   24    HB3  ASN   3           HB3      ASN   3  18.806  18.862  38.623
   25   HD21  ASN   3          HD21      ASN   3  17.466  22.249  38.891
   26   HD22  ASN   3          HD22      ASN   3  16.978  20.589  39.218
   27    H    GLN   4           H        GLN   4  20.445  21.224  35.772
   28    HA   GLN   4           HA       GLN   4  19.321  20.591  33.079
   29    HB2  GLN   4           HB2      GLN   4  18.441  22.793  33.004
   30    HB3  GLN   4           HB3      GLN   4  18.006  22.105  34.566
   31    HG2  GLN   4           HG2      GLN   4  19.988  23.342  35.580
   32    HG3  GLN   4           HG3      GLN   4  20.232  24.116  34.009
   33   HE21  GLN   4          HE21      GLN   4  18.169  25.243  33.096
   34   HE22  GLN   4          HE22      GLN   4  17.307  26.179  34.325
   35    H    PHE   5           H        PHE   5  22.328  20.892  34.287
   36    HA   PHE   5           HA       PHE   5  24.345  21.626  33.595
   37    HB2  PHE   5           HB2      PHE   5  23.140  21.375  30.823
   38    HB3  PHE   5           HB3      PHE   5  24.853  21.464  31.195
   39    HD1  PHE   5           HD1      PHE   5  26.086  19.593  32.081
   40    HD2  PHE   5           HD2      PHE   5  21.814  19.348  31.552
   41    HE1  PHE   5           HE1      PHE   5  26.167  17.142  32.463
   42    HE2  PHE   5           HE2      PHE   5  21.898  16.916  32.019
   43    HZ   PHE   5           HZ       PHE   5  24.083  15.801  32.439
   44    H    GLY   6           H        GLY   6  22.288  23.750  34.128
   45    HA2  GLY   6           HA2      GLY   6  22.357  26.065  34.207
   46    HA3  GLY   6           HA3      GLY   6  23.775  26.073  33.167
   47    H    CYS   7           H        CYS   7  21.636  24.197  31.501
   48    HA   CYS   7           HA       CYS   7  20.976  26.293  29.588
   49    HB2  CYS   7           HB2      CYS   7  20.381  23.311  29.688
   50    HB3  CYS   7           HB3      CYS   7  19.943  24.356  28.365
   51    H    PHE   8           H        PHE   8  19.047  27.220  29.241
   52    HA   PHE   8           HA       PHE   8  16.595  25.729  29.858
   53    HB2  PHE   8           HB2      PHE   8  16.961  27.000  31.914
   54    HB3  PHE   8           HB3      PHE   8  17.042  28.505  31.000
   55    HD1  PHE   8           HD1      PHE   8  15.039  29.633  30.280
   56    HD2  PHE   8           HD2      PHE   8  14.837  25.693  32.031
   57    HE1  PHE   8           HE1      PHE   8  12.538  29.752  30.293
   58    HE2  PHE   8           HE2      PHE   8  12.360  25.811  32.030
   59    HZ   PHE   8           HZ       PHE   8  11.216  27.806  31.130
   60    H    ALA   9           H        ALA   9  15.070  25.993  28.284
   61    HA   ALA   9           HA       ALA   9  14.312  26.459  26.216
   62    HB1  ALA   9           HB1      ALA   9  13.249  28.174  27.605
   63    HB2  ALA   9           HB2      ALA   9  14.576  29.302  27.244
   64    HB3  ALA   9           HB3      ALA   9  13.499  28.745  25.943
   65    H    ASN  10           H        ASN  10  16.695  25.649  25.759
   66    HA   ASN  10           HA       ASN  10  18.537  25.606  24.477
   67    HB2  ASN  10           HB2      ASN  10  17.018  27.577  22.732
   68    HB3  ASN  10           HB3      ASN  10  18.405  26.630  22.222
   69   HD21  ASN  10          HD21      ASN  10  15.618  25.014  20.903
   70   HD22  ASN  10          HD22      ASN  10  16.437  26.568  20.724
   71    H    VAL  11           H        VAL  11  18.284  28.208  26.427
   72    HA   VAL  11           HA       VAL  11  20.818  29.444  25.414
   73    HB   VAL  11           HB       VAL  11  18.709  30.728  27.179
   74   HG11  VAL  11          HG11      VAL  11  20.967  31.681  27.545
   75   HG12  VAL  11          HG12      VAL  11  21.184  31.869  25.790
   76   HG13  VAL  11          HG13      VAL  11  19.959  32.817  26.654
   77   HG21  VAL  11          HG21      VAL  11  18.223  32.149  25.202
   78   HG22  VAL  11          HG22      VAL  11  19.334  31.163  24.223
   79   HG23  VAL  11          HG23      VAL  11  17.847  30.460  24.877
   80    H    ASP  12           H        ASP  12  22.555  29.573  26.676
   81    HA   ASP  12           HA       ASP  12  22.635  28.271  29.298
   82    HB2  ASP  12           HB2      ASP  12  25.031  28.946  29.189
   83    HB3  ASP  12           HB3      ASP  12  24.482  27.869  27.915
   84    H    VAL  13           H        VAL  13  20.837  29.780  29.958
   85    HA   VAL  13           HA       VAL  13  21.612  32.493  30.816
   86    HB   VAL  13           HB       VAL  13  19.290  32.250  32.071
   87   HG11  VAL  13          HG11      VAL  13  19.445  32.457  29.059
   88   HG12  VAL  13          HG12      VAL  13  18.157  33.079  30.106
   89   HG13  VAL  13          HG13      VAL  13  19.784  33.774  30.204
   90   HG21  VAL  13          HG21      VAL  13  19.028  29.792  31.582
   91   HG22  VAL  13          HG22      VAL  13  17.693  30.826  31.053
   92   HG23  VAL  13          HG23      VAL  13  18.847  30.218  29.860
   93    H    LYS  14           H        LYS  14  21.070  29.371  32.440
   94    HA   LYS  14           HA       LYS  14  21.826  30.565  35.070
   95    HB2  LYS  14           HB2      LYS  14  21.044  27.696  34.490
   96    HB3  LYS  14           HB3      LYS  14  21.147  28.484  36.053
   97    HG2  LYS  14           HG2      LYS  14  19.095  29.000  33.862
   98    HG3  LYS  14           HG3      LYS  14  18.838  28.108  35.345
   99    HD2  LYS  14           HD2      LYS  14  19.397  31.085  35.102
  100    HD3  LYS  14           HD3      LYS  14  17.854  30.335  35.493
  101    HE2  LYS  14           HE2      LYS  14  20.372  30.364  37.185
  102    HE3  LYS  14           HE3      LYS  14  18.886  31.251  37.503
  103    HZ1  LYS  14           HZ1      LYS  14  17.771  29.078  37.798
  104    HZ2  LYS  14           HZ2      LYS  14  19.205  28.293  37.598
  105    HZ3  LYS  14           HZ3      LYS  14  18.988  29.290  38.874
  106    H    GLY  15           H        GLY  15  23.319  28.791  32.501
  107    HA2  GLY  15           HA2      GLY  15  25.925  29.452  33.216
  108    HA3  GLY  15           HA3      GLY  15  25.655  27.869  33.962
  109    H    ASP  16           H        ASP  16  27.608  28.169  32.006
  110    HA   ASP  16           HA       ASP  16  26.510  27.301  29.440
  111    HB2  ASP  16           HB2      ASP  16  28.661  27.292  28.570
  112    HB3  ASP  16           HB3      ASP  16  28.552  28.700  29.610
  113    H    CYS  17           H        CYS  17  26.497  25.403  28.497
  114    HA   CYS  17           HA       CYS  17  26.782  22.930  30.126
  115    HB2  CYS  17           HB2      CYS  17  24.888  22.496  29.051
  116    HB3  CYS  17           HB3      CYS  17  25.014  23.974  28.142
  117    H    LYS  18           H        LYS  18  28.365  24.687  27.527
  118    HA   LYS  18           HA       LYS  18  29.927  22.629  26.422
  119    HB2  LYS  18           HB2      LYS  18  29.702  24.926  25.556
  120    HB3  LYS  18           HB3      LYS  18  30.775  25.518  26.820
  121    HG2  LYS  18           HG2      LYS  18  31.744  23.194  25.154
  122    HG3  LYS  18           HG3      LYS  18  31.567  24.730  24.322
  123    HD2  LYS  18           HD2      LYS  18  33.076  24.635  26.940
  124    HD3  LYS  18           HD3      LYS  18  33.864  24.043  25.478
  125    HE2  LYS  18           HE2      LYS  18  32.500  26.760  25.503
  126    HE3  LYS  18           HE3      LYS  18  34.126  26.572  26.160
  127    HZ1  LYS  18           HZ1      LYS  18  34.907  25.776  24.095
  128    HZ2  LYS  18           HZ2      LYS  18  33.416  25.762  23.381
  129    HZ3  LYS  18           HZ3      LYS  18  34.169  27.182  23.815
  130    H    ARG  19           H        ARG  19  30.614  24.280  29.539
  131    HA   ARG  19           HA       ARG  19  33.083  23.004  30.073
  132    HB2  ARG  19           HB2      ARG  19  31.175  24.552  31.534
  133    HB3  ARG  19           HB3      ARG  19  31.306  23.060  32.421
  134    HG2  ARG  19           HG2      ARG  19  32.895  24.593  33.335
  135    HG3  ARG  19           HG3      ARG  19  33.791  23.328  32.500
  136    HD2  ARG  19           HD2      ARG  19  34.812  25.455  32.055
  137    HD3  ARG  19           HD3      ARG  19  34.122  24.863  30.550
  138    HE   ARG  19           HE       ARG  19  32.161  26.413  30.987
  139   HH11  ARG  19          HH11      ARG  19  35.317  27.286  32.342
  140   HH12  ARG  19          HH12      ARG  19  34.843  28.977  32.409
  141   HH21  ARG  19          HH21      ARG  19  31.688  28.517  31.318
  142   HH22  ARG  19          HH22      ARG  19  32.948  29.638  31.842
  143    H    HIS  20           H        HIS  20  29.885  21.433  30.263
  144    HA   HIS  20           HA       HIS  20  31.015  19.025  31.507
  145    HB2  HIS  20           HB2      HIS  20  28.781  19.407  32.065
  146    HB3  HIS  20           HB3      HIS  20  28.325  19.846  30.424
  147    HD2  HIS  20           HD2      HIS  20  27.462  18.064  28.826
  148    HE1  HIS  20           HE1      HIS  20  28.158  14.572  31.176
  149    HE2  HIS  20           HE2      HIS  20  27.168  15.439  28.993
  150    H    CYS  21           H        CYS  21  30.497  20.122  28.214
  151    HA   CYS  21           HA       CYS  21  31.239  17.562  26.986
  152    HB2  CYS  21           HB2      CYS  21  30.706  20.392  26.028
  153    HB3  CYS  21           HB3      CYS  21  31.163  19.155  24.913
  154    H    LYS  22           H        LYS  22  32.967  20.598  27.746
  155    HA   LYS  22           HA       LYS  22  35.354  20.170  26.372
  156    HB2  LYS  22           HB2      LYS  22  34.458  22.213  27.588
  157    HB3  LYS  22           HB3      LYS  22  34.979  21.480  29.114
  158    HG2  LYS  22           HG2      LYS  22  37.337  21.527  28.293
  159    HG3  LYS  22           HG3      LYS  22  36.759  22.190  26.748
  160    HD2  LYS  22           HD2      LYS  22  35.701  24.091  28.154
  161    HD3  LYS  22           HD3      LYS  22  36.707  23.506  29.502
  162    HE2  LYS  22           HE2      LYS  22  38.731  23.807  28.121
  163    HE3  LYS  22           HE3      LYS  22  37.718  24.198  26.724
  164    HZ1  LYS  22           HZ1      LYS  22  36.899  26.156  27.994
  165    HZ2  LYS  22           HZ2      LYS  22  38.012  25.879  29.160
  166    HZ3  LYS  22           HZ3      LYS  22  38.521  26.238  27.657
  167    H    ALA  23           H        ALA  23  34.377  18.825  29.474
  168    HA   ALA  23           HA       ALA  23  36.903  17.726  30.259
  169    HB1  ALA  23           HB1      ALA  23  35.036  18.146  31.783
  170    HB2  ALA  23           HB2      ALA  23  34.032  16.964  30.917
  171    HB3  ALA  23           HB3      ALA  23  35.473  16.428  31.822
  172    H    GLU  24           H        GLU  24  34.745  16.691  27.749
  173    HA   GLU  24           HA       GLU  24  36.218  14.093  27.467
  174    HB2  GLU  24           HB2      GLU  24  33.358  14.692  26.632
  175    HB3  GLU  24           HB3      GLU  24  34.252  13.195  26.338
  176    HG2  GLU  24           HG2      GLU  24  34.554  12.997  28.866
  177    HG3  GLU  24           HG3      GLU  24  33.400  14.321  29.027
  178    H    ASP  25           H        ASP  25  36.725  16.943  26.429
  179    HA   ASP  25           HA       ASP  25  37.441  18.006  24.573
  180    HB2  ASP  25           HB2      ASP  25  39.174  16.389  24.493
  181    HB3  ASP  25           HB3      ASP  25  38.136  15.176  23.762
  182    H    LYS  26           H        LYS  26  35.026  18.371  24.659
  183    HA   LYS  26           HA       LYS  26  33.975  18.267  21.879
  184    HB2  LYS  26           HB2      LYS  26  32.383  17.585  24.384
  185    HB3  LYS  26           HB3      LYS  26  31.728  17.755  22.762
  186    HG2  LYS  26           HG2      LYS  26  33.691  15.633  23.677
  187    HG3  LYS  26           HG3      LYS  26  31.951  15.423  23.610
  188    HD2  LYS  26           HD2      LYS  26  31.827  15.662  21.283
  189    HD3  LYS  26           HD3      LYS  26  33.474  16.269  21.109
  190    HE2  LYS  26           HE2      LYS  26  32.699  13.451  21.999
  191    HE3  LYS  26           HE3      LYS  26  33.333  13.906  20.411
  192    HZ1  LYS  26           HZ1      LYS  26  35.163  13.114  21.698
  193    HZ2  LYS  26           HZ2      LYS  26  35.353  14.742  21.628
  194    HZ3  LYS  26           HZ3      LYS  26  34.808  14.080  22.990
  195    H    GLU  27           H        GLU  27  32.762  19.982  21.270
  196    HA   GLU  27           HA       GLU  27  32.414  22.324  23.014
  197    HB2  GLU  27           HB2      GLU  27  31.528  21.602  20.201
  198    HB3  GLU  27           HB3      GLU  27  31.031  23.086  20.994
  199    HG2  GLU  27           HG2      GLU  27  33.950  22.305  20.572
  200    HG3  GLU  27           HG3      GLU  27  33.013  23.259  19.423
  201    H    GLY  28           H        GLY  28  30.221  23.014  23.572
  202    HA2  GLY  28           HA2      GLY  28  28.120  20.888  23.630
  203    HA3  GLY  28           HA3      GLY  28  28.548  21.690  25.128
  204    H    ILE  29           H        ILE  29  25.949  21.588  23.770
  205    HA   ILE  29           HA       ILE  29  25.343  24.453  23.542
  206    HB   ILE  29           HB       ILE  29  26.095  23.825  21.342
  207   HG12  ILE  29          HG12      ILE  29  24.133  25.403  21.752
  208   HG13  ILE  29          HG13      ILE  29  24.573  24.928  20.121
  209   HG21  ILE  29          HG21      ILE  29  24.889  22.273  19.857
  210   HG22  ILE  29          HG22      ILE  29  25.740  21.475  21.175
  211   HG23  ILE  29          HG23      ILE  29  23.978  21.672  21.259
  212   HD11  ILE  29          HD11      ILE  29  22.293  23.598  21.620
  213   HD12  ILE  29          HD12      ILE  29  22.102  24.995  20.541
  214   HD13  ILE  29          HD13      ILE  29  22.701  23.455  19.902
  215    H    CYS  30           H        CYS  30  23.152  24.938  24.000
  216    HA   CYS  30           HA       CYS  30  21.897  22.867  25.624
  217    HB2  CYS  30           HB2      CYS  30  21.112  25.724  25.048
  218    HB3  CYS  30           HB3      CYS  30  20.307  24.665  26.206
  219    H    HIS  31           H        HIS  31  20.533  21.423  24.919
  220    HA   HIS  31           HA       HIS  31  18.532  22.086  22.776
  221    HB2  HIS  31           HB2      HIS  31  19.905  19.481  23.459
  222    HB3  HIS  31           HB3      HIS  31  18.299  19.496  22.739
  223    HD2  HIS  31           HD2      HIS  31  21.764  21.095  21.849
  224    HE1  HIS  31           HE1      HIS  31  19.842  20.035  18.207
  225    HE2  HIS  31           HE2      HIS  31  21.944  21.030  19.204
  226    H    GLY  32           H        GLY  32  16.984  23.016  23.940
  227    HA2  GLY  32           HA2      GLY  32  15.161  23.204  25.328
  228    HA3  GLY  32           HA3      GLY  32  15.352  21.521  25.807
  229    H    THR  33           H        THR  33  15.897  21.194  27.797
  230    HA   THR  33           HA       THR  33  17.303  23.224  29.495
  231    HB   THR  33           HB       THR  33  16.110  22.357  31.410
  232    HG1  THR  33           HG1      THR  33  14.966  20.601  29.493
  233   HG21  THR  33          HG21      THR  33  13.883  23.208  30.938
  234   HG22  THR  33          HG22      THR  33  15.068  24.212  30.110
  235   HG23  THR  33          HG23      THR  33  14.135  23.025  29.190
  236    H    LYS  34           H        LYS  34  18.294  20.930  27.760
  237    HA   LYS  34           HA       LYS  34  20.203  19.716  29.692
  238    HB2  LYS  34           HB2      LYS  34  18.567  18.422  27.464
  239    HB3  LYS  34           HB3      LYS  34  19.960  17.635  28.182
  240    HG2  LYS  34           HG2      LYS  34  17.479  18.494  29.748
  241    HG3  LYS  34           HG3      LYS  34  17.798  16.876  29.105
  242    HD2  LYS  34           HD2      LYS  34  19.994  16.926  30.442
  243    HD3  LYS  34           HD3      LYS  34  19.334  18.319  31.316
  244    HE2  LYS  34           HE2      LYS  34  17.593  15.903  30.979
  245    HE3  LYS  34           HE3      LYS  34  19.010  15.708  32.029
  246    HZ1  LYS  34           HZ1      LYS  34  17.081  16.368  33.287
  247    HZ2  LYS  34           HZ2      LYS  34  18.200  17.561  33.377
  248    HZ3  LYS  34           HZ3      LYS  34  16.876  17.732  32.415
  249    H    CYS  35           H        CYS  35  22.030  18.609  28.438
  250    HA   CYS  35           HA       CYS  35  23.167  20.646  26.576
  251    HB2  CYS  35           HB2      CYS  35  24.158  20.318  28.864
  252    HB3  CYS  35           HB3      CYS  35  24.552  18.666  28.402
  253    H    LYS  36           H        LYS  36  24.053  20.061  24.648
  254    HA   LYS  36           HA       LYS  36  24.142  17.193  23.797
  255    HB2  LYS  36           HB2      LYS  36  22.232  18.425  22.793
  256    HB3  LYS  36           HB3      LYS  36  23.328  19.729  22.352
  257    HG2  LYS  36           HG2      LYS  36  22.928  18.595  20.345
  258    HG3  LYS  36           HG3      LYS  36  24.552  18.155  20.834
  259    HD2  LYS  36           HD2      LYS  36  23.541  16.190  20.024
  260    HD3  LYS  36           HD3      LYS  36  23.575  16.008  21.785
  261    HE2  LYS  36           HE2      LYS  36  21.183  16.644  21.903
  262    HE3  LYS  36           HE3      LYS  36  21.156  16.916  20.150
  263    HZ1  LYS  36           HZ1      LYS  36  21.739  14.332  21.472
  264    HZ2  LYS  36           HZ2      LYS  36  20.304  14.696  20.779
  265    HZ3  LYS  36           HZ3      LYS  36  21.667  14.548  19.846
  266    H    CYS  37           H        CYS  37  26.207  16.658  23.452
  267    HA   CYS  37           HA       CYS  37  28.279  18.670  23.017
  268    HB2  CYS  37           HB2      CYS  37  28.494  15.688  23.120
  269    HB3  CYS  37           HB3      CYS  37  29.834  16.808  22.993
  270    H    GLY  38           H        GLY  38  29.506  19.112  21.360
  271    HA2  GLY  38           HA2      GLY  38  28.620  18.330  18.610
  272    HA3  GLY  38           HA3      GLY  38  29.302  19.888  19.103
  273    H    VAL  39           H        VAL  39  30.941  19.819  17.560
  274    HA   VAL  39           HA       VAL  39  32.853  17.734  17.278
  275    HB   VAL  39           HB       VAL  39  34.292  19.540  16.257
  276   HG11  VAL  39          HG11      VAL  39  31.480  19.207  15.195
  277   HG12  VAL  39          HG12      VAL  39  32.892  19.750  14.264
  278   HG13  VAL  39          HG13      VAL  39  32.852  18.109  14.942
  279   HG21  VAL  39          HG21      VAL  39  33.474  21.494  17.496
  280   HG22  VAL  39          HG22      VAL  39  33.322  21.710  15.747
  281   HG23  VAL  39          HG23      VAL  39  31.888  21.343  16.713
  282    HA   PRO  40           HA       PRO  40  35.627  18.150  20.613
  283    HB2  PRO  40           HB2      PRO  40  38.104  17.574  19.527
  284    HB3  PRO  40           HB3      PRO  40  36.824  16.359  19.826
  285    HG2  PRO  40           HG2      PRO  40  37.443  17.825  17.263
  286    HG3  PRO  40           HG3      PRO  40  37.171  16.066  17.489
  287    HD2  PRO  40           HD2      PRO  40  35.176  17.662  16.613
  288    HD3  PRO  40           HD3      PRO  40  34.819  16.403  17.818
  289    H    ILE  41           H        ILE  41  37.124  19.446  21.689
  290    HA   ILE  41           HA       ILE  41  37.278  22.174  20.639
  291    HB   ILE  41           HB       ILE  41  38.183  22.773  22.816
  292   HG12  ILE  41          HG12      ILE  41  37.856  21.112  24.728
  293   HG13  ILE  41          HG13      ILE  41  37.875  19.848  23.504
  294   HG21  ILE  41          HG21      ILE  41  36.092  22.510  24.033
  295   HG22  ILE  41          HG22      ILE  41  35.751  22.766  22.315
  296   HG23  ILE  41          HG23      ILE  41  35.641  21.134  23.008
  297   HD11  ILE  41          HD11      ILE  41  40.051  20.203  24.711
  298   HD12  ILE  41          HD12      ILE  41  40.217  20.380  22.965
  299   HD13  ILE  41          HD13      ILE  41  40.152  21.824  23.998
  300    H    SER  42           H        SER  42  39.239  19.492  20.488
  301    HA   SER  42           HA       SER  42  41.803  20.765  20.461
  302    HB2  SER  42           HB2      SER  42  40.952  18.040  19.443
  303    HB3  SER  42           HB3      SER  42  42.612  18.603  19.740
  304    HG   SER  42           HG       SER  42  40.510  18.209  21.637
  305    H    TYR  43           H        TYR  43  41.251  22.519  18.981
  306    HA   TYR  43           HA       TYR  43  40.882  21.994  16.099
  307    HB2  TYR  43           HB2      TYR  43  41.458  24.598  17.570
  308    HB3  TYR  43           HB3      TYR  43  40.980  24.449  15.890
  309    HD1  TYR  43           HD1      TYR  43  38.649  23.730  15.294
  310    HD2  TYR  43           HD2      TYR  43  39.846  24.555  19.346
  311    HE1  TYR  43           HE1      TYR  43  36.263  23.833  15.975
  312    HE2  TYR  43           HE2      TYR  43  37.459  24.627  20.030
  313    HH   TYR  43           HH       TYR  43  35.265  24.435  19.367
  314    H    LEU  44           H        LEU  44  43.509  23.175  18.182
  315    HA   LEU  44           HA       LEU  44  45.594  22.751  16.158
  316    HB2  LEU  44           HB2      LEU  44  46.250  25.127  16.059
  317    HB3  LEU  44           HB3      LEU  44  44.672  24.824  15.386
  318    HG   LEU  44           HG       LEU  44  43.627  25.746  17.490
  319   HD11  LEU  44          HD11      LEU  44  45.425  25.572  19.102
  320   HD12  LEU  44          HD12      LEU  44  46.517  26.526  18.069
  321   HD13  LEU  44          HD13      LEU  44  45.097  27.278  18.828
  322   HD21  LEU  44          HD21      LEU  44  43.890  27.056  15.434
  323   HD22  LEU  44          HD22      LEU  44  44.093  28.075  16.860
  324   HD23  LEU  44          HD23      LEU  44  45.521  27.551  15.934
  Start of MODEL    4
    1    H1   ALA   1           H1       ALA   1  28.480  20.586  36.003
    2    H2   ALA   1           H2       ALA   1  28.313  18.977  36.311
    3    H3   ALA   1           H3       ALA   1  28.092  20.058  37.526
    4    HA   ALA   1           HA       ALA   1  26.173  20.986  36.416
    5    HB1  ALA   1           HB1      ALA   1  26.837  20.400  34.108
    6    HB2  ALA   1           HB2      ALA   1  26.592  18.677  34.471
    7    HB3  ALA   1           HB3      ALA   1  25.220  19.790  34.500
    8    H    LYS   2           H        LYS   2  24.086  20.235  37.067
    9    HA   LYS   2           HA       LYS   2  24.153  17.708  38.693
   10    HB2  LYS   2           HB2      LYS   2  24.753  19.803  39.941
   11    HB3  LYS   2           HB3      LYS   2  23.164  20.460  39.533
   12    HG2  LYS   2           HG2      LYS   2  22.079  18.639  40.827
   13    HG3  LYS   2           HG3      LYS   2  23.656  17.896  41.106
   14    HD2  LYS   2           HD2      LYS   2  23.002  19.125  43.106
   15    HD3  LYS   2           HD3      LYS   2  24.397  19.897  42.362
   16    HE2  LYS   2           HE2      LYS   2  22.930  21.641  43.027
   17    HE3  LYS   2           HE3      LYS   2  22.850  21.564  41.269
   18    HZ1  LYS   2           HZ1      LYS   2  20.876  20.204  43.025
   19    HZ2  LYS   2           HZ2      LYS   2  20.641  21.730  42.454
   20    HZ3  LYS   2           HZ3      LYS   2  20.746  20.444  41.435
   21    H    ASN   3           H        ASN   3  22.095  20.032  36.954
   22    HA   ASN   3           HA       ASN   3  19.922  17.962  36.896
   23    HB2  ASN   3           HB2      ASN   3  19.623  20.899  37.674
   24    HB3  ASN   3           HB3      ASN   3  18.278  19.856  37.216
   25   HD21  ASN   3          HD21      ASN   3  18.275  18.002  40.271
   26   HD22  ASN   3          HD22      ASN   3  17.899  17.891  38.545
   27    H    GLN   4           H        GLN   4  20.936  21.150  35.526
   28    HA   GLN   4           HA       GLN   4  19.653  20.328  32.951
   29    HB2  GLN   4           HB2      GLN   4  18.742  22.460  32.749
   30    HB3  GLN   4           HB3      GLN   4  18.330  21.817  34.329
   31    HG2  GLN   4           HG2      GLN   4  20.266  23.276  35.257
   32    HG3  GLN   4           HG3      GLN   4  20.272  24.044  33.640
   33   HE21  GLN   4          HE21      GLN   4  16.776  24.726  33.972
   34   HE22  GLN   4          HE22      GLN   4  18.043  24.590  32.788
   35    H    PHE   5           H        PHE   5  22.679  20.795  34.082
   36    HA   PHE   5           HA       PHE   5  24.666  21.520  33.272
   37    HB2  PHE   5           HB2      PHE   5  23.421  21.287  30.537
   38    HB3  PHE   5           HB3      PHE   5  25.134  21.273  30.927
   39    HD1  PHE   5           HD1      PHE   5  21.991  19.334  30.964
   40    HD2  PHE   5           HD2      PHE   5  26.209  19.251  31.835
   41    HE1  PHE   5           HE1      PHE   5  21.923  16.850  31.148
   42    HE2  PHE   5           HE2      PHE   5  26.111  16.784  32.061
   43    HZ   PHE   5           HZ       PHE   5  23.933  15.586  31.712
   44    H    GLY   6           H        GLY   6  22.789  23.544  34.057
   45    HA2  GLY   6           HA2      GLY   6  22.552  25.842  34.026
   46    HA3  GLY   6           HA3      GLY   6  23.910  25.907  32.903
   47    H    CYS   7           H        CYS   7  21.851  23.976  31.240
   48    HA   CYS   7           HA       CYS   7  21.045  26.120  29.469
   49    HB2  CYS   7           HB2      CYS   7  20.499  23.133  29.423
   50    HB3  CYS   7           HB3      CYS   7  20.030  24.236  28.159
   51    H    PHE   8           H        PHE   8  19.145  27.033  29.145
   52    HA   PHE   8           HA       PHE   8  16.687  25.474  29.567
   53    HB2  PHE   8           HB2      PHE   8  16.947  26.644  31.752
   54    HB3  PHE   8           HB3      PHE   8  16.968  28.181  30.911
   55    HD1  PHE   8           HD1      PHE   8  14.954  29.147  29.934
   56    HD2  PHE   8           HD2      PHE   8  14.894  25.305  31.888
   57    HE1  PHE   8           HE1      PHE   8  12.460  29.097  29.786
   58    HE2  PHE   8           HE2      PHE   8  12.410  25.270  31.765
   59    HZ   PHE   8           HZ       PHE   8  11.203  27.144  30.693
   60    H    ALA   9           H        ALA   9  15.079  25.985  28.053
   61    HA   ALA   9           HA       ALA   9  14.354  26.648  26.028
   62    HB1  ALA   9           HB1      ALA   9  13.786  29.029  25.874
   63    HB2  ALA   9           HB2      ALA   9  13.425  28.367  27.474
   64    HB3  ALA   9           HB3      ALA   9  14.870  29.388  27.237
   65    H    ASN  10           H        ASN  10  16.730  25.680  25.593
   66    HA   ASN  10           HA       ASN  10  18.616  25.624  24.373
   67    HB2  ASN  10           HB2      ASN  10  17.118  27.557  22.559
   68    HB3  ASN  10           HB3      ASN  10  18.498  26.564  22.095
   69   HD21  ASN  10          HD21      ASN  10  15.852  24.881  20.732
   70   HD22  ASN  10          HD22      ASN  10  16.591  26.463  20.525
   71    H    VAL  11           H        VAL  11  18.597  27.962  26.460
   72    HA   VAL  11           HA       VAL  11  21.006  29.354  25.343
   73    HB   VAL  11           HB       VAL  11  18.761  30.555  26.997
   74   HG11  VAL  11          HG11      VAL  11  21.317  31.855  25.915
   75   HG12  VAL  11          HG12      VAL  11  19.945  32.725  26.627
   76   HG13  VAL  11          HG13      VAL  11  20.892  31.642  27.630
   77   HG21  VAL  11          HG21      VAL  11  18.208  30.306  24.577
   78   HG22  VAL  11          HG22      VAL  11  18.422  31.999  25.006
   79   HG23  VAL  11          HG23      VAL  11  19.714  31.137  24.141
   80    H    ASP  12           H        ASP  12  22.619  29.919  26.698
   81    HA   ASP  12           HA       ASP  12  23.119  28.319  29.069
   82    HB2  ASP  12           HB2      ASP  12  24.683  30.625  27.789
   83    HB3  ASP  12           HB3      ASP  12  25.281  29.580  29.071
   84    H    VAL  13           H        VAL  13  20.889  29.591  29.827
   85    HA   VAL  13           HA       VAL  13  21.392  32.250  30.948
   86    HB   VAL  13           HB       VAL  13  19.074  31.713  32.124
   87   HG11  VAL  13          HG11      VAL  13  19.497  33.428  30.397
   88   HG12  VAL  13          HG12      VAL  13  19.296  32.187  29.140
   89   HG13  VAL  13          HG13      VAL  13  17.934  32.614  30.192
   90   HG21  VAL  13          HG21      VAL  13  18.908  29.826  29.749
   91   HG22  VAL  13          HG22      VAL  13  19.004  29.305  31.455
   92   HG23  VAL  13          HG23      VAL  13  17.637  30.286  30.886
   93    H    LYS  14           H        LYS  14  20.921  29.041  32.473
   94    HA   LYS  14           HA       LYS  14  21.490  30.192  35.152
   95    HB2  LYS  14           HB2      LYS  14  20.819  27.362  34.240
   96    HB3  LYS  14           HB3      LYS  14  21.085  27.819  35.909
   97    HG2  LYS  14           HG2      LYS  14  18.901  28.966  34.102
   98    HG3  LYS  14           HG3      LYS  14  18.678  27.647  35.236
   99    HD2  LYS  14           HD2      LYS  14  19.468  30.491  36.024
  100    HD3  LYS  14           HD3      LYS  14  17.843  29.802  36.105
  101    HE2  LYS  14           HE2      LYS  14  18.612  28.065  37.673
  102    HE3  LYS  14           HE3      LYS  14  20.261  28.706  37.615
  103    HZ1  LYS  14           HZ1      LYS  14  18.920  29.450  39.538
  104    HZ2  LYS  14           HZ2      LYS  14  19.513  30.719  38.656
  105    HZ3  LYS  14           HZ3      LYS  14  17.933  30.274  38.524
  106    H    GLY  15           H        GLY  15  23.231  28.406  32.700
  107    HA2  GLY  15           HA2      GLY  15  25.793  29.079  33.798
  108    HA3  GLY  15           HA3      GLY  15  25.407  27.402  34.197
  109    H    ASP  16           H        ASP  16  27.541  27.452  32.765
  110    HA   ASP  16           HA       ASP  16  26.896  27.386  29.877
  111    HB2  ASP  16           HB2      ASP  16  29.271  27.529  29.499
  112    HB3  ASP  16           HB3      ASP  16  28.620  28.892  30.395
  113    H    CYS  17           H        CYS  17  26.089  25.521  29.328
  114    HA   CYS  17           HA       CYS  17  26.716  22.945  30.295
  115    HB2  CYS  17           HB2      CYS  17  24.851  22.624  29.115
  116    HB3  CYS  17           HB3      CYS  17  24.984  24.224  28.460
  117    H    LYS  18           H        LYS  18  28.221  24.745  27.646
  118    HA   LYS  18           HA       LYS  18  29.755  22.610  26.607
  119    HB2  LYS  18           HB2      LYS  18  29.387  24.816  25.559
  120    HB3  LYS  18           HB3      LYS  18  30.530  25.550  26.679
  121    HG2  LYS  18           HG2      LYS  18  31.444  23.112  25.169
  122    HG3  LYS  18           HG3      LYS  18  31.158  24.548  24.206
  123    HD2  LYS  18           HD2      LYS  18  32.935  24.541  26.680
  124    HD3  LYS  18           HD3      LYS  18  33.538  24.146  25.069
  125    HE2  LYS  18           HE2      LYS  18  32.281  26.808  25.904
  126    HE3  LYS  18           HE3      LYS  18  33.999  26.483  25.653
  127    HZ1  LYS  18           HZ1      LYS  18  31.886  26.703  23.636
  128    HZ2  LYS  18           HZ2      LYS  18  33.421  27.275  23.568
  129    HZ3  LYS  18           HZ3      LYS  18  33.157  25.702  23.308
  130    H    ARG  19           H        ARG  19  30.266  24.204  29.718
  131    HA   ARG  19           HA       ARG  19  32.941  23.323  30.104
  132    HB2  ARG  19           HB2      ARG  19  31.328  24.887  31.533
  133    HB3  ARG  19           HB3      ARG  19  30.887  23.395  32.336
  134    HG2  ARG  19           HG2      ARG  19  32.619  24.476  33.612
  135    HG3  ARG  19           HG3      ARG  19  33.300  23.014  32.905
  136    HD2  ARG  19           HD2      ARG  19  34.867  24.873  32.772
  137    HD3  ARG  19           HD3      ARG  19  34.426  24.375  31.149
  138    HE   ARG  19           HE       ARG  19  32.622  26.391  31.624
  139   HH11  ARG  19          HH11      ARG  19  36.174  26.445  31.839
  140   HH12  ARG  19          HH12      ARG  19  36.125  28.211  31.763
  141   HH21  ARG  19          HH21      ARG  19  32.777  28.456  31.368
  142   HH22  ARG  19          HH22      ARG  19  34.363  29.276  31.460
  143    H    HIS  20           H        HIS  20  29.889  21.542  30.455
  144    HA   HIS  20           HA       HIS  20  31.117  19.125  31.543
  145    HB2  HIS  20           HB2      HIS  20  28.875  19.162  32.044
  146    HB3  HIS  20           HB3      HIS  20  28.413  19.940  30.540
  147    HD2  HIS  20           HD2      HIS  20  27.582  18.495  28.567
  148    HE1  HIS  20           HE1      HIS  20  28.182  14.632  30.257
  149    HE2  HIS  20           HE2      HIS  20  27.165  15.898  28.314
  150    H    CYS  21           H        CYS  21  30.214  20.160  28.208
  151    HA   CYS  21           HA       CYS  21  31.228  17.747  26.986
  152    HB2  CYS  21           HB2      CYS  21  30.759  20.537  25.898
  153    HB3  CYS  21           HB3      CYS  21  31.089  19.140  24.902
  154    H    LYS  22           H        LYS  22  32.844  20.875  27.718
  155    HA   LYS  22           HA       LYS  22  35.265  20.307  26.353
  156    HB2  LYS  22           HB2      LYS  22  34.577  22.529  27.114
  157    HB3  LYS  22           HB3      LYS  22  34.788  22.058  28.806
  158    HG2  LYS  22           HG2      LYS  22  37.177  21.792  28.516
  159    HG3  LYS  22           HG3      LYS  22  37.056  21.985  26.763
  160    HD2  LYS  22           HD2      LYS  22  36.310  24.175  28.749
  161    HD3  LYS  22           HD3      LYS  22  37.925  23.991  28.046
  162    HE2  LYS  22           HE2      LYS  22  37.005  24.191  25.771
  163    HE3  LYS  22           HE3      LYS  22  35.371  24.364  26.427
  164    HZ1  LYS  22           HZ1      LYS  22  35.996  26.400  27.459
  165    HZ2  LYS  22           HZ2      LYS  22  37.572  26.253  27.025
  166    HZ3  LYS  22           HZ3      LYS  22  36.423  26.519  25.877
  167    H    ALA  23           H        ALA  23  34.188  19.260  29.535
  168    HA   ALA  23           HA       ALA  23  36.677  18.111  30.407
  169    HB1  ALA  23           HB1      ALA  23  33.798  17.417  31.127
  170    HB2  ALA  23           HB2      ALA  23  35.243  16.975  32.053
  171    HB3  ALA  23           HB3      ALA  23  34.777  18.680  31.901
  172    H    GLU  24           H        GLU  24  34.258  16.988  28.092
  173    HA   GLU  24           HA       GLU  24  35.528  14.304  27.895
  174    HB2  GLU  24           HB2      GLU  24  33.173  15.333  26.283
  175    HB3  GLU  24           HB3      GLU  24  33.755  13.679  26.469
  176    HG2  GLU  24           HG2      GLU  24  33.211  14.086  29.031
  177    HG3  GLU  24           HG3      GLU  24  32.165  15.359  28.398
  178    H    ASP  25           H        ASP  25  36.426  17.202  26.928
  179    HA   ASP  25           HA       ASP  25  37.530  18.203  25.330
  180    HB2  ASP  25           HB2      ASP  25  38.695  15.735  25.467
  181    HB3  ASP  25           HB3      ASP  25  38.362  15.843  23.748
  182    H    LYS  26           H        LYS  26  34.803  18.050  25.005
  183    HA   LYS  26           HA       LYS  26  34.339  18.248  22.058
  184    HB2  LYS  26           HB2      LYS  26  32.804  16.999  24.367
  185    HB3  LYS  26           HB3      LYS  26  31.915  17.624  22.996
  186    HG2  LYS  26           HG2      LYS  26  34.213  15.687  22.540
  187    HG3  LYS  26           HG3      LYS  26  32.611  15.106  23.032
  188    HD2  LYS  26           HD2      LYS  26  31.544  16.232  21.174
  189    HD3  LYS  26           HD3      LYS  26  33.069  16.972  20.684
  190    HE2  LYS  26           HE2      LYS  26  32.869  15.270  19.151
  191    HE3  LYS  26           HE3      LYS  26  33.960  14.571  20.353
  192    HZ1  LYS  26           HZ1      LYS  26  32.186  13.036  19.695
  193    HZ2  LYS  26           HZ2      LYS  26  32.004  13.405  21.292
  194    HZ3  LYS  26           HZ3      LYS  26  31.022  14.092  20.195
  195    H    GLU  27           H        GLU  27  32.854  19.798  21.302
  196    HA   GLU  27           HA       GLU  27  32.378  22.177  22.958
  197    HB2  GLU  27           HB2      GLU  27  31.602  21.378  20.137
  198    HB3  GLU  27           HB3      GLU  27  31.074  22.878  20.884
  199    HG2  GLU  27           HG2      GLU  27  34.031  22.194  20.655
  200    HG3  GLU  27           HG3      GLU  27  33.130  22.940  19.348
  201    H    GLY  28           H        GLY  28  30.209  22.942  23.320
  202    HA2  GLY  28           HA2      GLY  28  28.047  20.887  23.485
  203    HA3  GLY  28           HA3      GLY  28  28.530  21.738  24.945
  204    H    ILE  29           H        ILE  29  25.922  21.593  23.419
  205    HA   ILE  29           HA       ILE  29  25.345  24.475  23.344
  206    HB   ILE  29           HB       ILE  29  26.020  23.915  21.120
  207   HG12  ILE  29          HG12      ILE  29  24.025  25.469  21.639
  208   HG13  ILE  29          HG13      ILE  29  24.466  25.075  19.987
  209   HG21  ILE  29          HG21      ILE  29  25.658  21.557  20.937
  210   HG22  ILE  29          HG22      ILE  29  23.901  21.757  21.055
  211   HG23  ILE  29          HG23      ILE  29  24.788  22.385  19.649
  212   HD11  ILE  29          HD11      ILE  29  22.221  23.639  21.441
  213   HD12  ILE  29          HD12      ILE  29  21.998  25.079  20.429
  214   HD13  ILE  29          HD13      ILE  29  22.616  23.581  19.714
  215    H    CYS  30           H        CYS  30  23.292  25.013  23.960
  216    HA   CYS  30           HA       CYS  30  21.918  22.998  25.486
  217    HB2  CYS  30           HB2      CYS  30  21.269  25.899  24.931
  218    HB3  CYS  30           HB3      CYS  30  20.388  24.861  26.072
  219    H    HIS  31           H        HIS  31  20.498  21.623  24.875
  220    HA   HIS  31           HA       HIS  31  18.404  22.298  22.816
  221    HB2  HIS  31           HB2      HIS  31  19.767  19.690  23.518
  222    HB3  HIS  31           HB3      HIS  31  18.159  19.730  22.787
  223    HD2  HIS  31           HD2      HIS  31  21.667  21.259  21.956
  224    HE1  HIS  31           HE1      HIS  31  19.936  19.802  18.346
  225    HE2  HIS  31           HE2      HIS  31  22.008  20.831  19.370
  226    H    GLY  32           H        GLY  32  16.871  23.168  24.016
  227    HA2  GLY  32           HA2      GLY  32  15.150  23.408  25.513
  228    HA3  GLY  32           HA3      GLY  32  15.251  21.677  25.858
  229    H    THR  33           H        THR  33  15.438  21.435  27.935
  230    HA   THR  33           HA       THR  33  16.982  23.211  29.698
  231    HB   THR  33           HB       THR  33  15.975  22.046  31.526
  232    HG1  THR  33           HG1      THR  33  15.528  20.054  31.260
  233   HG21  THR  33          HG21      THR  33  13.783  22.322  29.450
  234   HG22  THR  33          HG22      THR  33  13.666  22.532  31.208
  235   HG23  THR  33          HG23      THR  33  14.570  23.704  30.224
  236    H    LYS  34           H        LYS  34  18.305  21.259  27.753
  237    HA   LYS  34           HA       LYS  34  20.216  20.020  29.680
  238    HB2  LYS  34           HB2      LYS  34  18.797  18.624  27.377
  239    HB3  LYS  34           HB3      LYS  34  20.155  17.926  28.242
  240    HG2  LYS  34           HG2      LYS  34  17.423  18.552  29.450
  241    HG3  LYS  34           HG3      LYS  34  18.006  16.980  28.908
  242    HD2  LYS  34           HD2      LYS  34  19.911  17.215  30.579
  243    HD3  LYS  34           HD3      LYS  34  19.044  18.600  31.269
  244    HE2  LYS  34           HE2      LYS  34  17.028  17.068  31.508
  245    HE3  LYS  34           HE3      LYS  34  18.082  15.736  30.968
  246    HZ1  LYS  34           HZ1      LYS  34  19.418  15.972  32.857
  247    HZ2  LYS  34           HZ2      LYS  34  18.664  17.350  33.391
  248    HZ3  LYS  34           HZ3      LYS  34  17.872  15.905  33.390
  249    H    CYS  35           H        CYS  35  22.170  19.193  28.608
  250    HA   CYS  35           HA       CYS  35  23.169  21.032  26.504
  251    HB2  CYS  35           HB2      CYS  35  24.347  20.514  28.728
  252    HB3  CYS  35           HB3      CYS  35  24.682  18.920  28.081
  253    H    LYS  36           H        LYS  36  24.234  20.183  24.616
  254    HA   LYS  36           HA       LYS  36  24.082  17.269  24.031
  255    HB2  LYS  36           HB2      LYS  36  22.134  18.428  22.973
  256    HB3  LYS  36           HB3      LYS  36  23.231  19.587  22.252
  257    HG2  LYS  36           HG2      LYS  36  22.536  18.184  20.548
  258    HG3  LYS  36           HG3      LYS  36  24.217  17.762  20.843
  259    HD2  LYS  36           HD2      LYS  36  21.923  16.174  22.077
  260    HD3  LYS  36           HD3      LYS  36  22.432  15.897  20.407
  261    HE2  LYS  36           HE2      LYS  36  24.702  15.340  21.107
  262    HE3  LYS  36           HE3      LYS  36  24.304  15.739  22.784
  263    HZ1  LYS  36           HZ1      LYS  36  24.191  13.387  22.498
  264    HZ2  LYS  36           HZ2      LYS  36  22.666  13.917  22.753
  265    HZ3  LYS  36           HZ3      LYS  36  23.148  13.483  21.240
  266    H    CYS  37           H        CYS  37  26.189  16.667  23.665
  267    HA   CYS  37           HA       CYS  37  28.161  18.720  23.083
  268    HB2  CYS  37           HB2      CYS  37  28.581  15.769  23.448
  269    HB3  CYS  37           HB3      CYS  37  29.828  16.998  23.378
  270    H    GLY  38           H        GLY  38  29.320  19.100  21.377
  271    HA2  GLY  38           HA2      GLY  38  28.315  18.162  18.760
  272    HA3  GLY  38           HA3      GLY  38  29.099  19.702  19.157
  273    H    VAL  39           H        VAL  39  30.917  19.912  18.120
  274    HA   VAL  39           HA       VAL  39  32.570  17.640  17.304
  275    HB   VAL  39           HB       VAL  39  33.913  19.463  16.122
  276   HG11  VAL  39          HG11      VAL  39  32.322  19.613  14.316
  277   HG12  VAL  39          HG12      VAL  39  32.253  18.006  15.048
  278   HG13  VAL  39          HG13      VAL  39  30.974  19.193  15.402
  279   HG21  VAL  39          HG21      VAL  39  32.930  21.615  15.759
  280   HG22  VAL  39          HG22      VAL  39  31.546  21.241  16.798
  281   HG23  VAL  39          HG23      VAL  39  33.178  21.388  17.497
  282    HA   PRO  40           HA       PRO  40  35.722  17.839  20.317
  283    HB2  PRO  40           HB2      PRO  40  38.060  17.444  18.853
  284    HB3  PRO  40           HB3      PRO  40  36.883  16.173  19.304
  285    HG2  PRO  40           HG2      PRO  40  37.089  17.709  16.704
  286    HG3  PRO  40           HG3      PRO  40  36.860  15.946  16.943
  287    HD2  PRO  40           HD2      PRO  40  34.767  17.549  16.389
  288    HD3  PRO  40           HD3      PRO  40  34.570  16.260  17.596
  289    H    ILE  41           H        ILE  41  37.191  19.192  21.378
  290    HA   ILE  41           HA       ILE  41  36.973  21.958  20.545
  291    HB   ILE  41           HB       ILE  41  37.990  22.519  22.680
  292   HG12  ILE  41          HG12      ILE  41  38.067  20.498  24.372
  293   HG13  ILE  41          HG13      ILE  41  38.458  19.548  22.943
  294   HG21  ILE  41          HG21      ILE  41  35.576  22.182  22.439
  295   HG22  ILE  41          HG22      ILE  41  35.789  20.470  22.871
  296   HG23  ILE  41          HG23      ILE  41  36.131  21.745  24.057
  297   HD11  ILE  41          HD11      ILE  41  40.459  20.328  24.207
  298   HD12  ILE  41          HD12      ILE  41  40.460  20.961  22.560
  299   HD13  ILE  41          HD13      ILE  41  39.983  22.009  23.914
  300    H    SER  42           H        SER  42  39.564  19.725  20.087
  301    HA   SER  42           HA       SER  42  41.732  21.525  20.178
  302    HB2  SER  42           HB2      SER  42  42.769  19.849  18.475
  303    HB3  SER  42           HB3      SER  42  42.440  19.371  20.140
  304    HG   SER  42           HG       SER  42  40.671  18.260  19.535
  305    H    TYR  43           H        TYR  43  42.111  23.312  19.105
  306    HA   TYR  43           HA       TYR  43  40.914  23.815  16.466
  307    HB2  TYR  43           HB2      TYR  43  42.346  25.646  18.407
  308    HB3  TYR  43           HB3      TYR  43  41.747  26.139  16.827
  309    HD1  TYR  43           HD1      TYR  43  39.203  25.395  16.322
  310    HD2  TYR  43           HD2      TYR  43  40.892  26.128  20.224
  311    HE1  TYR  43           HE1      TYR  43  36.927  25.666  17.251
  312    HE2  TYR  43           HE2      TYR  43  38.596  26.410  21.155
  313    HH   TYR  43           HH       TYR  43  35.686  26.010  19.097
  314    H    LEU  44           H        LEU  44  42.244  22.016  15.753
  315    HA   LEU  44           HA       LEU  44  44.941  22.780  14.765
  316    HB2  LEU  44           HB2      LEU  44  45.199  20.391  14.250
  317    HB3  LEU  44           HB3      LEU  44  44.983  20.748  15.946
  318    HG   LEU  44           HG       LEU  44  42.670  19.907  15.872
  319   HD11  LEU  44          HD11      LEU  44  43.289  19.270  12.952
  320   HD12  LEU  44          HD12      LEU  44  41.923  18.606  13.872
  321   HD13  LEU  44          HD13      LEU  44  41.999  20.338  13.561
  322   HD21  LEU  44          HD21      LEU  44  44.742  18.030  14.649
  323   HD22  LEU  44          HD22      LEU  44  44.571  18.417  16.377
  324   HD23  LEU  44          HD23      LEU  44  43.284  17.553  15.531
  Start of MODEL    5
    1    H1   ALA   1           H1       ALA   1  25.855  23.731  39.234
    2    H2   ALA   1           H2       ALA   1  26.771  24.396  38.042
    3    H3   ALA   1           H3       ALA   1  27.044  22.843  38.491
    4    HA   ALA   1           HA       ALA   1  24.538  23.804  37.317
    5    HB1  ALA   1           HB1      ALA   1  26.295  24.024  35.653
    6    HB2  ALA   1           HB2      ALA   1  26.850  22.358  35.953
    7    HB3  ALA   1           HB3      ALA   1  25.251  22.653  35.237
    8    H    LYS   2           H        LYS   2  22.904  22.456  37.620
    9    HA   LYS   2           HA       LYS   2  23.300  19.572  38.246
   10    HB2  LYS   2           HB2      LYS   2  21.987  21.629  40.076
   11    HB3  LYS   2           HB3      LYS   2  21.726  19.889  40.222
   12    HG2  LYS   2           HG2      LYS   2  24.049  19.467  40.663
   13    HG3  LYS   2           HG3      LYS   2  24.474  21.170  40.435
   14    HD2  LYS   2           HD2      LYS   2  22.580  20.166  42.592
   15    HD3  LYS   2           HD3      LYS   2  24.312  20.449  42.830
   16    HE2  LYS   2           HE2      LYS   2  24.045  22.822  42.187
   17    HE3  LYS   2           HE3      LYS   2  22.319  22.578  41.936
   18    HZ1  LYS   2           HZ1      LYS   2  22.071  22.071  44.265
   19    HZ2  LYS   2           HZ2      LYS   2  23.694  22.183  44.537
   20    HZ3  LYS   2           HZ3      LYS   2  22.860  23.525  44.108
   21    H    ASN   3           H        ASN   3  21.832  18.398  37.355
   22    HA   ASN   3           HA       ASN   3  20.001  17.519  36.461
   23    HB2  ASN   3           HB2      ASN   3  18.345  19.776  37.607
   24    HB3  ASN   3           HB3      ASN   3  17.817  18.149  37.205
   25   HD21  ASN   3          HD21      ASN   3  19.400  18.938  40.856
   26   HD22  ASN   3          HD22      ASN   3  19.051  20.186  39.675
   27    H    GLN   4           H        GLN   4  20.532  20.889  35.581
   28    HA   GLN   4           HA       GLN   4  19.406  20.294  32.884
   29    HB2  GLN   4           HB2      GLN   4  18.559  22.454  32.781
   30    HB3  GLN   4           HB3      GLN   4  18.009  21.670  34.253
   31    HG2  GLN   4           HG2      GLN   4  19.951  22.938  35.459
   32    HG3  GLN   4           HG3      GLN   4  20.024  23.919  33.965
   33   HE21  GLN   4          HE21      GLN   4  16.550  24.718  34.314
   34   HE22  GLN   4          HE22      GLN   4  17.820  24.560  33.113
   35    H    PHE   5           H        PHE   5  22.417  20.479  34.139
   36    HA   PHE   5           HA       PHE   5  24.454  21.195  33.429
   37    HB2  PHE   5           HB2      PHE   5  23.174  21.432  30.696
   38    HB3  PHE   5           HB3      PHE   5  24.884  21.314  31.041
   39    HD1  PHE   5           HD1      PHE   5  21.703  19.415  30.937
   40    HD2  PHE   5           HD2      PHE   5  25.953  19.262  31.538
   41    HE1  PHE   5           HE1      PHE   5  21.653  16.936  30.623
   42    HE2  PHE   5           HE2      PHE   5  25.889  16.780  31.328
   43    HZ   PHE   5           HZ       PHE   5  23.759  15.626  30.812
   44    H    GLY   6           H        GLY   6  22.347  23.423  34.079
   45    HA2  GLY   6           HA2      GLY   6  22.466  25.747  34.235
   46    HA3  GLY   6           HA3      GLY   6  23.854  25.750  33.142
   47    H    CYS   7           H        CYS   7  21.639  23.955  31.466
   48    HA   CYS   7           HA       CYS   7  20.961  26.201  29.737
   49    HB2  CYS   7           HB2      CYS   7  20.314  23.243  29.507
   50    HB3  CYS   7           HB3      CYS   7  20.026  24.446  28.275
   51    H    PHE   8           H        PHE   8  19.018  27.083  29.390
   52    HA   PHE   8           HA       PHE   8  16.596  25.505  29.873
   53    HB2  PHE   8           HB2      PHE   8  16.776  26.636  32.046
   54    HB3  PHE   8           HB3      PHE   8  16.841  28.198  31.250
   55    HD1  PHE   8           HD1      PHE   8  14.875  29.150  30.113
   56    HD2  PHE   8           HD2      PHE   8  14.675  25.374  32.183
   57    HE1  PHE   8           HE1      PHE   8  12.388  29.147  29.878
   58    HE2  PHE   8           HE2      PHE   8  12.202  25.391  31.977
   59    HZ   PHE   8           HZ       PHE   8  11.060  27.259  30.818
   60    H    ALA   9           H        ALA   9  15.095  25.812  28.345
   61    HA   ALA   9           HA       ALA   9  14.347  26.326  26.282
   62    HB1  ALA   9           HB1      ALA   9  13.507  28.615  26.016
   63    HB2  ALA   9           HB2      ALA   9  13.141  27.943  27.611
   64    HB3  ALA   9           HB3      ALA   9  14.454  29.130  27.425
   65    H    ASN  10           H        ASN  10  16.741  25.582  25.902
   66    HA   ASN  10           HA       ASN  10  18.451  25.500  24.440
   67    HB2  ASN  10           HB2      ASN  10  17.036  27.682  22.885
   68    HB3  ASN  10           HB3      ASN  10  18.192  26.554  22.234
   69   HD21  ASN  10          HD21      ASN  10  14.848  25.697  21.363
   70   HD22  ASN  10          HD22      ASN  10  15.324  27.285  21.865
   71    H    VAL  11           H        VAL  11  18.444  27.927  26.593
   72    HA   VAL  11           HA       VAL  11  20.927  29.198  25.479
   73    HB   VAL  11           HB       VAL  11  18.758  30.490  27.175
   74   HG11  VAL  11          HG11      VAL  11  20.973  31.501  27.656
   75   HG12  VAL  11          HG12      VAL  11  21.282  31.681  25.915
   76   HG13  VAL  11          HG13      VAL  11  19.991  32.605  26.704
   77   HG21  VAL  11          HG21      VAL  11  18.359  31.898  25.167
   78   HG22  VAL  11          HG22      VAL  11  19.548  30.943  24.255
   79   HG23  VAL  11          HG23      VAL  11  18.039  30.204  24.813
   80    H    ASP  12           H        ASP  12  22.602  29.665  26.834
   81    HA   ASP  12           HA       ASP  12  23.025  28.044  29.209
   82    HB2  ASP  12           HB2      ASP  12  24.697  30.228  27.899
   83    HB3  ASP  12           HB3      ASP  12  25.251  29.181  29.195
   84    H    VAL  13           H        VAL  13  20.836  29.536  29.866
   85    HA   VAL  13           HA       VAL  13  21.423  32.144  30.975
   86    HB   VAL  13           HB       VAL  13  19.058  31.722  32.115
   87   HG11  VAL  13          HG11      VAL  13  19.570  33.334  30.339
   88   HG12  VAL  13          HG12      VAL  13  19.397  32.045  29.131
   89   HG13  VAL  13          HG13      VAL  13  18.004  32.543  30.102
   90   HG21  VAL  13          HG21      VAL  13  18.996  29.267  31.517
   91   HG22  VAL  13          HG22      VAL  13  17.628  30.243  30.950
   92   HG23  VAL  13          HG23      VAL  13  18.880  29.762  29.803
   93    H    LYS  14           H        LYS  14  21.127  28.980  32.524
   94    HA   LYS  14           HA       LYS  14  21.668  30.214  35.200
   95    HB2  LYS  14           HB2      LYS  14  20.636  27.481  34.427
   96    HB3  LYS  14           HB3      LYS  14  21.111  27.936  36.077
   97    HG2  LYS  14           HG2      LYS  14  19.452  29.749  36.092
   98    HG3  LYS  14           HG3      LYS  14  19.008  29.419  34.413
   99    HD2  LYS  14           HD2      LYS  14  17.333  28.480  35.810
  100    HD3  LYS  14           HD3      LYS  14  18.259  27.152  35.068
  101    HE2  LYS  14           HE2      LYS  14  19.517  26.839  37.191
  102    HE3  LYS  14           HE3      LYS  14  18.691  28.229  37.900
  103    HZ1  LYS  14           HZ1      LYS  14  17.387  25.699  37.068
  104    HZ2  LYS  14           HZ2      LYS  14  17.698  26.161  38.606
  105    HZ3  LYS  14           HZ3      LYS  14  16.594  27.008  37.719
  106    H    GLY  15           H        GLY  15  23.299  28.435  32.707
  107    HA2  GLY  15           HA2      GLY  15  25.870  28.880  33.864
  108    HA3  GLY  15           HA3      GLY  15  25.395  27.214  34.186
  109    H    ASP  16           H        ASP  16  27.609  27.680  32.686
  110    HA   ASP  16           HA       ASP  16  27.005  27.689  29.839
  111    HB2  ASP  16           HB2      ASP  16  29.437  27.719  29.573
  112    HB3  ASP  16           HB3      ASP  16  28.802  29.064  30.540
  113    H    CYS  17           H        CYS  17  26.343  25.925  28.868
  114    HA   CYS  17           HA       CYS  17  26.810  23.179  29.663
  115    HB2  CYS  17           HB2      CYS  17  24.932  23.567  28.468
  116    HB3  CYS  17           HB3      CYS  17  25.652  24.751  27.395
  117    H    LYS  18           H        LYS  18  28.825  25.373  27.712
  118    HA   LYS  18           HA       LYS  18  30.506  23.500  26.407
  119    HB2  LYS  18           HB2      LYS  18  30.622  25.940  26.147
  120    HB3  LYS  18           HB3      LYS  18  31.295  26.132  27.756
  121    HG2  LYS  18           HG2      LYS  18  32.656  24.298  25.762
  122    HG3  LYS  18           HG3      LYS  18  32.809  26.027  25.541
  123    HD2  LYS  18           HD2      LYS  18  33.553  24.686  28.167
  124    HD3  LYS  18           HD3      LYS  18  34.682  24.836  26.837
  125    HE2  LYS  18           HE2      LYS  18  33.213  27.236  27.982
  126    HE3  LYS  18           HE3      LYS  18  34.700  26.624  28.711
  127    HZ1  LYS  18           HZ1      LYS  18  35.895  27.082  26.724
  128    HZ2  LYS  18           HZ2      LYS  18  34.547  27.447  25.850
  129    HZ3  LYS  18           HZ3      LYS  18  35.042  28.424  27.074
  130    H    ARG  19           H        ARG  19  30.444  24.329  29.876
  131    HA   ARG  19           HA       ARG  19  32.901  23.258  30.705
  132    HB2  ARG  19           HB2      ARG  19  31.172  24.762  31.781
  133    HB3  ARG  19           HB3      ARG  19  30.213  23.333  32.150
  134    HG2  ARG  19           HG2      ARG  19  31.899  22.494  33.674
  135    HG3  ARG  19           HG3      ARG  19  33.050  23.755  33.171
  136    HD2  ARG  19           HD2      ARG  19  30.309  24.332  34.385
  137    HD3  ARG  19           HD3      ARG  19  31.788  24.263  35.318
  138    HE   ARG  19           HE       ARG  19  31.025  26.346  33.335
  139   HH11  ARG  19          HH11      ARG  19  33.411  25.458  35.738
  140   HH12  ARG  19          HH12      ARG  19  34.374  26.872  35.381
  141   HH21  ARG  19          HH21      ARG  19  32.377  27.799  32.693
  142   HH22  ARG  19          HH22      ARG  19  33.894  28.113  33.555
  143    H    HIS  20           H        HIS  20  29.780  21.600  30.372
  144    HA   HIS  20           HA       HIS  20  30.638  19.021  31.375
  145    HB2  HIS  20           HB2      HIS  20  28.314  19.504  31.381
  146    HB3  HIS  20           HB3      HIS  20  28.320  20.058  29.713
  147    HD2  HIS  20           HD2      HIS  20  27.395  18.450  28.008
  148    HE1  HIS  20           HE1      HIS  20  27.953  14.749  30.022
  149    HE2  HIS  20           HE2      HIS  20  26.959  15.872  27.948
  150    H    CYS  21           H        CYS  21  30.423  20.415  28.085
  151    HA   CYS  21           HA       CYS  21  31.410  17.982  26.843
  152    HB2  CYS  21           HB2      CYS  21  30.950  20.781  25.787
  153    HB3  CYS  21           HB3      CYS  21  31.367  19.399  24.783
  154    H    LYS  22           H        LYS  22  33.002  20.939  28.006
  155    HA   LYS  22           HA       LYS  22  35.593  20.436  26.923
  156    HB2  LYS  22           HB2      LYS  22  35.007  22.573  27.944
  157    HB3  LYS  22           HB3      LYS  22  34.663  21.791  29.477
  158    HG2  LYS  22           HG2      LYS  22  36.662  22.881  29.824
  159    HG3  LYS  22           HG3      LYS  22  37.119  21.203  29.676
  160    HD2  LYS  22           HD2      LYS  22  37.452  23.362  27.544
  161    HD3  LYS  22           HD3      LYS  22  38.701  22.738  28.622
  162    HE2  LYS  22           HE2      LYS  22  38.149  20.418  27.610
  163    HE3  LYS  22           HE3      LYS  22  37.344  21.319  26.312
  164    HZ1  LYS  22           HZ1      LYS  22  39.490  22.401  25.852
  165    HZ2  LYS  22           HZ2      LYS  22  40.189  21.593  27.121
  166    HZ3  LYS  22           HZ3      LYS  22  39.669  20.753  25.842
  167    H    ALA  23           H        ALA  23  33.991  19.114  29.837
  168    HA   ALA  23           HA       ALA  23  36.226  17.489  30.656
  169    HB1  ALA  23           HB1      ALA  23  33.250  17.182  31.184
  170    HB2  ALA  23           HB2      ALA  23  34.553  16.379  32.074
  171    HB3  ALA  23           HB3      ALA  23  34.387  18.141  32.147
  172    H    GLU  24           H        GLU  24  34.060  17.095  27.970
  173    HA   GLU  24           HA       GLU  24  34.944  14.282  27.496
  174    HB2  GLU  24           HB2      GLU  24  32.899  16.000  26.047
  175    HB3  GLU  24           HB3      GLU  24  33.245  14.317  25.698
  176    HG2  GLU  24           HG2      GLU  24  32.218  15.145  28.448
  177    HG3  GLU  24           HG3      GLU  24  31.137  14.969  27.077
  178    H    ASP  25           H        ASP  25  36.166  17.255  27.068
  179    HA   ASP  25           HA       ASP  25  37.327  18.475  25.682
  180    HB2  ASP  25           HB2      ASP  25  38.795  16.361  26.132
  181    HB3  ASP  25           HB3      ASP  25  38.635  16.085  24.400
  182    H    LYS  26           H        LYS  26  34.893  18.344  24.887
  183    HA   LYS  26           HA       LYS  26  34.854  18.543  21.903
  184    HB2  LYS  26           HB2      LYS  26  32.636  17.653  23.790
  185    HB3  LYS  26           HB3      LYS  26  32.473  17.887  22.057
  186    HG2  LYS  26           HG2      LYS  26  34.663  16.104  22.355
  187    HG3  LYS  26           HG3      LYS  26  33.441  15.577  23.529
  188    HD2  LYS  26           HD2      LYS  26  31.750  15.552  21.702
  189    HD3  LYS  26           HD3      LYS  26  33.021  16.041  20.559
  190    HE2  LYS  26           HE2      LYS  26  34.346  14.000  21.209
  191    HE3  LYS  26           HE3      LYS  26  33.019  13.513  22.269
  192    HZ1  LYS  26           HZ1      LYS  26  33.014  13.565  19.306
  193    HZ2  LYS  26           HZ2      LYS  26  32.632  12.325  20.292
  194    HZ3  LYS  26           HZ3      LYS  26  31.601  13.584  20.150
  195    H    GLU  27           H        GLU  27  32.947  19.853  21.161
  196    HA   GLU  27           HA       GLU  27  32.630  22.401  22.664
  197    HB2  GLU  27           HB2      GLU  27  31.857  21.465  19.883
  198    HB3  GLU  27           HB3      GLU  27  31.280  22.980  20.562
  199    HG2  GLU  27           HG2      GLU  27  34.252  22.333  20.326
  200    HG3  GLU  27           HG3      GLU  27  33.329  23.104  19.041
  201    H    GLY  28           H        GLY  28  30.552  23.169  23.201
  202    HA2  GLY  28           HA2      GLY  28  28.378  21.115  23.530
  203    HA3  GLY  28           HA3      GLY  28  28.886  22.134  24.871
  204    H    ILE  29           H        ILE  29  26.190  21.842  23.704
  205    HA   ILE  29           HA       ILE  29  25.534  24.644  23.246
  206    HB   ILE  29           HB       ILE  29  26.186  23.943  21.078
  207   HG12  ILE  29          HG12      ILE  29  24.080  25.379  21.498
  208   HG13  ILE  29          HG13      ILE  29  24.544  24.898  19.875
  209   HG21  ILE  29          HG21      ILE  29  24.243  21.645  21.196
  210   HG22  ILE  29          HG22      ILE  29  25.070  22.221  19.732
  211   HG23  ILE  29          HG23      ILE  29  26.008  21.567  21.074
  212   HD11  ILE  29          HD11      ILE  29  22.392  23.505  21.502
  213   HD12  ILE  29          HD12      ILE  29  22.134  24.725  20.238
  214   HD13  ILE  29          HD13      ILE  29  22.837  23.172  19.813
  215    H    CYS  30           H        CYS  30  23.488  25.155  23.993
  216    HA   CYS  30           HA       CYS  30  22.174  23.084  25.559
  217    HB2  CYS  30           HB2      CYS  30  21.601  26.023  25.137
  218    HB3  CYS  30           HB3      CYS  30  20.615  24.960  26.161
  219    H    HIS  31           H        HIS  31  20.694  21.773  24.907
  220    HA   HIS  31           HA       HIS  31  18.645  22.578  22.863
  221    HB2  HIS  31           HB2      HIS  31  19.943  19.908  23.405
  222    HB3  HIS  31           HB3      HIS  31  18.293  19.989  22.816
  223    HD2  HIS  31           HD2      HIS  31  21.848  21.056  21.675
  224    HE1  HIS  31           HE1      HIS  31  19.417  20.643  18.202
  225    HE2  HIS  31           HE2      HIS  31  21.786  21.022  19.030
  226    H    GLY  32           H        GLY  32  17.076  23.412  24.033
  227    HA2  GLY  32           HA2      GLY  32  15.270  23.556  25.433
  228    HA3  GLY  32           HA3      GLY  32  15.370  21.817  25.674
  229    H    THR  33           H        THR  33  15.778  21.179  27.694
  230    HA   THR  33           HA       THR  33  17.139  22.979  29.647
  231    HB   THR  33           HB       THR  33  16.077  21.679  31.424
  232    HG1  THR  33           HG1      THR  33  14.542  20.190  30.943
  233   HG21  THR  33          HG21      THR  33  14.930  23.702  30.430
  234   HG22  THR  33          HG22      THR  33  13.973  22.599  29.416
  235   HG23  THR  33          HG23      THR  33  13.832  22.531  31.186
  236    H    LYS  34           H        LYS  34  18.238  20.978  27.574
  237    HA   LYS  34           HA       LYS  34  20.127  19.558  29.404
  238    HB2  LYS  34           HB2      LYS  34  19.027  18.645  26.716
  239    HB3  LYS  34           HB3      LYS  34  20.211  17.773  27.670
  240    HG2  LYS  34           HG2      LYS  34  17.382  18.363  28.655
  241    HG3  LYS  34           HG3      LYS  34  17.860  16.899  27.788
  242    HD2  LYS  34           HD2      LYS  34  19.592  16.479  29.579
  243    HD3  LYS  34           HD3      LYS  34  18.882  17.805  30.517
  244    HE2  LYS  34           HE2      LYS  34  17.390  15.347  29.497
  245    HE3  LYS  34           HE3      LYS  34  18.079  15.488  31.120
  246    HZ1  LYS  34           HZ1      LYS  34  15.902  17.187  30.033
  247    HZ2  LYS  34           HZ2      LYS  34  15.776  16.012  31.170
  248    HZ3  LYS  34           HZ3      LYS  34  16.604  17.386  31.511
  249    H    CYS  35           H        CYS  35  22.200  19.066  28.490
  250    HA   CYS  35           HA       CYS  35  23.217  21.054  26.499
  251    HB2  CYS  35           HB2      CYS  35  24.268  21.071  28.729
  252    HB3  CYS  35           HB3      CYS  35  24.686  19.355  28.527
  253    H    LYS  36           H        LYS  36  24.353  20.321  24.687
  254    HA   LYS  36           HA       LYS  36  24.334  17.409  24.035
  255    HB2  LYS  36           HB2      LYS  36  22.394  18.587  23.012
  256    HB3  LYS  36           HB3      LYS  36  23.476  19.844  22.424
  257    HG2  LYS  36           HG2      LYS  36  22.938  18.517  20.558
  258    HG3  LYS  36           HG3      LYS  36  24.617  18.170  20.966
  259    HD2  LYS  36           HD2      LYS  36  23.548  16.121  20.402
  260    HD3  LYS  36           HD3      LYS  36  23.848  16.088  22.148
  261    HE2  LYS  36           HE2      LYS  36  21.478  16.659  22.588
  262    HE3  LYS  36           HE3      LYS  36  21.176  16.821  20.849
  263    HZ1  LYS  36           HZ1      LYS  36  20.495  14.620  21.623
  264    HZ2  LYS  36           HZ2      LYS  36  21.784  14.470  20.619
  265    HZ3  LYS  36           HZ3      LYS  36  21.997  14.340  22.240
  266    H    CYS  37           H        CYS  37  26.342  16.799  23.513
  267    HA   CYS  37           HA       CYS  37  28.385  18.861  22.988
  268    HB2  CYS  37           HB2      CYS  37  28.838  15.908  23.321
  269    HB3  CYS  37           HB3      CYS  37  30.049  17.177  23.179
  270    H    GLY  38           H        GLY  38  29.459  19.228  21.281
  271    HA2  GLY  38           HA2      GLY  38  28.515  18.244  18.645
  272    HA3  GLY  38           HA3      GLY  38  29.397  19.739  19.020
  273    H    VAL  39           H        VAL  39  31.160  19.496  17.660
  274    HA   VAL  39           HA       VAL  39  32.635  17.075  17.462
  275    HB   VAL  39           HB       VAL  39  34.272  18.401  16.153
  276   HG11  VAL  39          HG11      VAL  39  31.394  18.958  15.367
  277   HG12  VAL  39          HG12      VAL  39  32.812  18.925  14.302
  278   HG13  VAL  39          HG13      VAL  39  32.283  17.437  15.105
  279   HG21  VAL  39          HG21      VAL  39  34.220  20.539  17.319
  280   HG22  VAL  39          HG22      VAL  39  33.815  20.754  15.610
  281   HG23  VAL  39          HG23      VAL  39  32.535  20.799  16.837
  282    HA   PRO  40           HA       PRO  40  35.866  17.309  20.586
  283    HB2  PRO  40           HB2      PRO  40  37.681  16.850  18.222
  284    HB3  PRO  40           HB3      PRO  40  37.667  16.025  19.813
  285    HG2  PRO  40           HG2      PRO  40  36.615  14.825  17.629
  286    HG3  PRO  40           HG3      PRO  40  35.806  14.705  19.224
  287    HD2  PRO  40           HD2      PRO  40  35.042  16.479  16.884
  288    HD3  PRO  40           HD3      PRO  40  34.019  15.603  18.048
  289    H    ILE  41           H        ILE  41  37.386  18.948  21.313
  290    HA   ILE  41           HA       ILE  41  36.987  21.475  20.173
  291    HB   ILE  41           HB       ILE  41  38.674  22.359  21.706
  292   HG12  ILE  41          HG12      ILE  41  39.413  20.854  23.590
  293   HG13  ILE  41          HG13      ILE  41  39.073  19.475  22.552
  294   HG21  ILE  41          HG21      ILE  41  36.286  22.047  22.257
  295   HG22  ILE  41          HG22      ILE  41  36.670  20.465  22.965
  296   HG23  ILE  41          HG23      ILE  41  37.334  21.950  23.674
  297   HD11  ILE  41          HD11      ILE  41  41.039  21.703  21.848
  298   HD12  ILE  41          HD12      ILE  41  41.494  20.216  22.702
  299   HD13  ILE  41          HD13      ILE  41  40.885  20.115  21.056
  300    H    SER  42           H        SER  42  39.486  19.257  19.301
  301    HA   SER  42           HA       SER  42  41.069  19.263  17.692
  302    HB2  SER  42           HB2      SER  42  38.886  19.300  16.559
  303    HB3  SER  42           HB3      SER  42  39.077  21.019  16.270
  304    HG   SER  42           HG       SER  42  40.447  20.601  14.676
  305    H    TYR  43           H        TYR  43  42.988  20.096  17.932
  306    HA   TYR  43           HA       TYR  43  43.620  22.941  17.920
  307    HB2  TYR  43           HB2      TYR  43  45.345  20.447  17.762
  308    HB3  TYR  43           HB3      TYR  43  45.995  22.080  17.803
  309    HD1  TYR  43           HD1      TYR  43  44.895  19.346  19.856
  310    HD2  TYR  43           HD2      TYR  43  45.270  23.643  19.735
  311    HE1  TYR  43           HE1      TYR  43  44.727  19.426  22.332
  312    HE2  TYR  43           HE2      TYR  43  45.114  23.715  22.219
  313    HH   TYR  43           HH       TYR  43  44.737  20.765  24.186
  314    H    LEU  44           H        LEU  44  42.649  21.046  15.409
  315    HA   LEU  44           HA       LEU  44  43.889  22.863  13.395
  316    HB2  LEU  44           HB2      LEU  44  44.549  20.504  13.041
  317    HB3  LEU  44           HB3      LEU  44  42.852  20.029  13.025
  318    HG   LEU  44           HG       LEU  44  42.474  21.334  10.962
  319   HD11  LEU  44          HD11      LEU  44  44.445  22.191   9.695
  320   HD12  LEU  44          HD12      LEU  44  44.164  23.099  11.181
  321   HD13  LEU  44          HD13      LEU  44  45.471  21.892  11.116
  322   HD21  LEU  44          HD21      LEU  44  44.859  19.441  10.804
  323   HD22  LEU  44          HD22      LEU  44  43.149  18.958  10.851
  324   HD23  LEU  44          HD23      LEU  44  43.770  19.874   9.469
  Start of MODEL    6
    1    H1   ALA   1           H1       ALA   1  26.980  20.826  39.440
    2    H2   ALA   1           H2       ALA   1  27.775  21.046  38.017
    3    H3   ALA   1           H3       ALA   1  27.438  19.522  38.550
    4    HA   ALA   1           HA       ALA   1  25.400  21.500  37.828
    5    HB1  ALA   1           HB1      ALA   1  26.682  20.826  35.842
    6    HB2  ALA   1           HB2      ALA   1  26.389  19.117  36.215
    7    HB3  ALA   1           HB3      ALA   1  25.034  20.181  35.782
    8    H    LYS   2           H        LYS   2  23.169  20.569  37.688
    9    HA   LYS   2           HA       LYS   2  22.822  18.430  39.770
   10    HB2  LYS   2           HB2      LYS   2  22.609  20.598  40.785
   11    HB3  LYS   2           HB3      LYS   2  21.529  21.162  39.489
   12    HG2  LYS   2           HG2      LYS   2  19.766  19.656  40.251
   13    HG3  LYS   2           HG3      LYS   2  20.855  18.889  41.415
   14    HD2  LYS   2           HD2      LYS   2  19.262  20.440  42.460
   15    HD3  LYS   2           HD3      LYS   2  20.947  20.917  42.748
   16    HE2  LYS   2           HE2      LYS   2  20.797  22.671  41.065
   17    HE3  LYS   2           HE3      LYS   2  19.197  22.119  40.559
   18    HZ1  LYS   2           HZ1      LYS   2  19.092  24.041  42.017
   19    HZ2  LYS   2           HZ2      LYS   2  18.303  22.784  42.660
   20    HZ3  LYS   2           HZ3      LYS   2  19.787  23.209  43.267
   21    H    ASN   3           H        ASN   3  21.338  19.989  36.947
   22    HA   ASN   3           HA       ASN   3  19.881  17.562  36.305
   23    HB2  ASN   3           HB2      ASN   3  17.633  18.491  36.447
   24    HB3  ASN   3           HB3      ASN   3  18.359  18.339  38.045
   25   HD21  ASN   3          HD21      ASN   3  16.445  21.540  37.715
   26   HD22  ASN   3          HD22      ASN   3  16.039  19.862  37.371
   27    H    GLN   4           H        GLN   4  20.228  21.029  35.675
   28    HA   GLN   4           HA       GLN   4  19.350  20.568  32.852
   29    HB2  GLN   4           HB2      GLN   4  18.422  22.661  32.825
   30    HB3  GLN   4           HB3      GLN   4  17.921  21.885  34.324
   31    HG2  GLN   4           HG2      GLN   4  19.811  23.198  35.498
   32    HG3  GLN   4           HG3      GLN   4  19.942  24.122  33.970
   33   HE21  GLN   4          HE21      GLN   4  16.485  24.955  34.148
   34   HE22  GLN   4          HE22      GLN   4  17.817  24.828  33.032
   35    H    PHE   5           H        PHE   5  22.299  20.739  34.202
   36    HA   PHE   5           HA       PHE   5  24.319  21.646  33.775
   37    HB2  PHE   5           HB2      PHE   5  23.369  21.853  30.904
   38    HB3  PHE   5           HB3      PHE   5  25.021  21.728  31.478
   39    HD1  PHE   5           HD1      PHE   5  25.948  19.600  32.288
   40    HD2  PHE   5           HD2      PHE   5  21.909  19.895  30.842
   41    HE1  PHE   5           HE1      PHE   5  25.838  17.137  32.079
   42    HE2  PHE   5           HE2      PHE   5  21.808  17.403  30.624
   43    HZ   PHE   5           HZ       PHE   5  23.779  16.037  31.240
   44    H    GLY   6           H        GLY   6  22.055  23.685  34.248
   45    HA2  GLY   6           HA2      GLY   6  21.991  26.016  34.492
   46    HA3  GLY   6           HA3      GLY   6  23.498  26.154  33.582
   47    H    CYS   7           H        CYS   7  21.654  24.283  31.595
   48    HA   CYS   7           HA       CYS   7  20.994  26.444  29.785
   49    HB2  CYS   7           HB2      CYS   7  20.416  23.462  29.686
   50    HB3  CYS   7           HB3      CYS   7  20.144  24.574  28.376
   51    H    PHE   8           H        PHE   8  19.048  27.263  29.267
   52    HA   PHE   8           HA       PHE   8  16.621  25.728  29.710
   53    HB2  PHE   8           HB2      PHE   8  16.737  26.889  31.853
   54    HB3  PHE   8           HB3      PHE   8  16.888  28.441  31.041
   55    HD1  PHE   8           HD1      PHE   8  14.974  29.485  29.894
   56    HD2  PHE   8           HD2      PHE   8  14.581  25.740  31.997
   57    HE1  PHE   8           HE1      PHE   8  12.506  29.557  29.591
   58    HE2  PHE   8           HE2      PHE   8  12.123  25.822  31.674
   59    HZ   PHE   8           HZ       PHE   8  11.086  27.707  30.446
   60    H    ALA   9           H        ALA   9  15.230  25.921  28.113
   61    HA   ALA   9           HA       ALA   9  14.471  26.377  26.046
   62    HB1  ALA   9           HB1      ALA   9  14.466  29.198  27.162
   63    HB2  ALA   9           HB2      ALA   9  13.521  28.625  25.769
   64    HB3  ALA   9           HB3      ALA   9  13.209  27.957  27.381
   65    H    ASN  10           H        ASN  10  16.870  25.730  25.618
   66    HA   ASN  10           HA       ASN  10  18.671  25.785  24.297
   67    HB2  ASN  10           HB2      ASN  10  16.985  27.655  22.584
   68    HB3  ASN  10           HB3      ASN  10  18.428  26.813  22.043
   69   HD21  ASN  10          HD21      ASN  10  15.862  24.870  20.813
   70   HD22  ASN  10          HD22      ASN  10  16.368  26.530  20.559
   71    H    VAL  11           H        VAL  11  18.492  28.084  26.407
   72    HA   VAL  11           HA       VAL  11  20.956  29.490  25.465
   73    HB   VAL  11           HB       VAL  11  18.708  30.705  27.101
   74   HG11  VAL  11          HG11      VAL  11  20.879  31.733  27.647
   75   HG12  VAL  11          HG12      VAL  11  21.256  31.927  25.921
   76   HG13  VAL  11          HG13      VAL  11  19.933  32.840  26.674
   77   HG21  VAL  11          HG21      VAL  11  19.524  31.213  24.200
   78   HG22  VAL  11          HG22      VAL  11  18.018  30.445  24.733
   79   HG23  VAL  11          HG23      VAL  11  18.307  32.128  25.116
   80    H    ASP  12           H        ASP  12  22.492  29.982  26.986
   81    HA   ASP  12           HA       ASP  12  22.785  28.213  29.262
   82    HB2  ASP  12           HB2      ASP  12  25.060  29.201  29.299
   83    HB3  ASP  12           HB3      ASP  12  24.622  28.479  27.765
   84    H    VAL  13           H        VAL  13  20.635  30.060  29.665
   85    HA   VAL  13           HA       VAL  13  21.324  32.516  30.837
   86    HB   VAL  13           HB       VAL  13  18.969  32.201  32.050
   87   HG11  VAL  13          HG11      VAL  13  19.502  33.714  30.183
   88   HG12  VAL  13          HG12      VAL  13  19.218  32.376  29.050
   89   HG13  VAL  13          HG13      VAL  13  17.892  32.987  30.057
   90   HG21  VAL  13          HG21      VAL  13  18.716  30.128  29.838
   91   HG22  VAL  13          HG22      VAL  13  18.835  29.734  31.574
   92   HG23  VAL  13          HG23      VAL  13  17.476  30.697  30.963
   93    H    LYS  14           H        LYS  14  21.136  29.452  32.521
   94    HA   LYS  14           HA       LYS  14  21.923  30.833  35.080
   95    HB2  LYS  14           HB2      LYS  14  20.671  28.086  34.681
   96    HB3  LYS  14           HB3      LYS  14  21.128  28.772  36.233
   97    HG2  LYS  14           HG2      LYS  14  19.053  30.006  34.358
   98    HG3  LYS  14           HG3      LYS  14  18.665  28.896  35.650
   99    HD2  LYS  14           HD2      LYS  14  20.101  31.530  36.142
  100    HD3  LYS  14           HD3      LYS  14  18.340  31.358  36.140
  101    HE2  LYS  14           HE2      LYS  14  18.611  29.537  37.894
  102    HE3  LYS  14           HE3      LYS  14  20.313  29.987  38.021
  103    HZ1  LYS  14           HZ1      LYS  14  18.059  31.881  38.524
  104    HZ2  LYS  14           HZ2      LYS  14  18.871  31.091  39.690
  105    HZ3  LYS  14           HZ3      LYS  14  19.644  32.189  38.775
  106    H    GLY  15           H        GLY  15  23.200  28.959  32.576
  107    HA2  GLY  15           HA2      GLY  15  25.835  29.236  33.372
  108    HA3  GLY  15           HA3      GLY  15  25.365  27.641  33.973
  109    H    ASP  16           H        ASP  16  27.336  28.247  31.921
  110    HA   ASP  16           HA       ASP  16  26.182  27.282  29.389
  111    HB2  ASP  16           HB2      ASP  16  28.441  27.525  28.516
  112    HB3  ASP  16           HB3      ASP  16  27.916  29.007  29.319
  113    H    CYS  17           H        CYS  17  26.342  25.282  28.549
  114    HA   CYS  17           HA       CYS  17  27.267  23.162  30.362
  115    HB2  CYS  17           HB2      CYS  17  25.865  21.759  29.372
  116    HB3  CYS  17           HB3      CYS  17  24.998  23.280  29.386
  117    H    LYS  18           H        LYS  18  28.721  24.827  27.873
  118    HA   LYS  18           HA       LYS  18  30.089  22.732  26.515
  119    HB2  LYS  18           HB2      LYS  18  29.938  25.073  25.728
  120    HB3  LYS  18           HB3      LYS  18  31.139  25.560  26.928
  121    HG2  LYS  18           HG2      LYS  18  31.806  23.226  25.119
  122    HG3  LYS  18           HG3      LYS  18  31.719  24.806  24.365
  123    HD2  LYS  18           HD2      LYS  18  33.373  24.520  26.873
  124    HD3  LYS  18           HD3      LYS  18  34.005  23.832  25.384
  125    HE2  LYS  18           HE2      LYS  18  32.919  26.652  25.357
  126    HE3  LYS  18           HE3      LYS  18  34.510  26.361  26.073
  127    HZ1  LYS  18           HZ1      LYS  18  33.824  25.536  23.308
  128    HZ2  LYS  18           HZ2      LYS  18  34.568  26.953  23.687
  129    HZ3  LYS  18           HZ3      LYS  18  35.319  25.541  24.037
  130    H    ARG  19           H        ARG  19  30.818  24.025  29.741
  131    HA   ARG  19           HA       ARG  19  33.433  22.734  29.899
  132    HB2  ARG  19           HB2      ARG  19  31.624  24.204  31.747
  133    HB3  ARG  19           HB3      ARG  19  32.448  22.877  32.510
  134    HG2  ARG  19           HG2      ARG  19  33.904  24.658  32.846
  135    HG3  ARG  19           HG3      ARG  19  34.643  23.756  31.527
  136    HD2  ARG  19           HD2      ARG  19  34.738  26.112  30.965
  137    HD3  ARG  19           HD3      ARG  19  33.560  25.365  29.895
  138    HE   ARG  19           HE       ARG  19  31.872  26.622  30.896
  139   HH11  ARG  19          HH11      ARG  19  34.683  26.897  33.063
  140   HH12  ARG  19          HH12      ARG  19  33.819  28.114  34.011
  141   HH21  ARG  19          HH21      ARG  19  31.066  28.268  32.079
  142   HH22  ARG  19          HH22      ARG  19  31.985  28.849  33.482
  143    H    HIS  20           H        HIS  20  30.173  21.584  30.713
  144    HA   HIS  20           HA       HIS  20  30.957  18.947  31.551
  145    HB2  HIS  20           HB2      HIS  20  28.768  19.463  32.080
  146    HB3  HIS  20           HB3      HIS  20  28.443  20.266  30.559
  147    HD2  HIS  20           HD2      HIS  20  27.433  18.930  28.603
  148    HE1  HIS  20           HE1      HIS  20  27.399  15.063  30.363
  149    HE2  HIS  20           HE2      HIS  20  26.688  16.420  28.340
  150    H    CYS  21           H        CYS  21  30.380  20.257  28.251
  151    HA   CYS  21           HA       CYS  21  31.073  17.721  26.989
  152    HB2  CYS  21           HB2      CYS  21  30.654  20.540  26.009
  153    HB3  CYS  21           HB3      CYS  21  31.203  19.280  24.921
  154    H    LYS  22           H        LYS  22  33.022  20.548  27.975
  155    HA   LYS  22           HA       LYS  22  35.413  19.757  26.737
  156    HB2  LYS  22           HB2      LYS  22  34.753  21.980  27.863
  157    HB3  LYS  22           HB3      LYS  22  35.145  21.218  29.402
  158    HG2  LYS  22           HG2      LYS  22  37.005  22.525  28.691
  159    HG3  LYS  22           HG3      LYS  22  37.484  20.829  28.558
  160    HD2  LYS  22           HD2      LYS  22  37.104  20.892  26.092
  161    HD3  LYS  22           HD3      LYS  22  36.403  22.519  26.258
  162    HE2  LYS  22           HE2      LYS  22  38.555  22.956  25.560
  163    HE3  LYS  22           HE3      LYS  22  38.578  23.222  27.300
  164    HZ1  LYS  22           HZ1      LYS  22  39.641  21.033  27.578
  165    HZ2  LYS  22           HZ2      LYS  22  39.571  20.733  25.959
  166    HZ3  LYS  22           HZ3      LYS  22  40.500  21.954  26.528
  167    H    ALA  23           H        ALA  23  33.851  18.369  29.518
  168    HA   ALA  23           HA       ALA  23  36.102  16.901  30.555
  169    HB1  ALA  23           HB1      ALA  23  34.402  15.549  31.643
  170    HB2  ALA  23           HB2      ALA  23  33.905  17.251  31.707
  171    HB3  ALA  23           HB3      ALA  23  33.153  16.147  30.537
  172    H    GLU  24           H        GLU  24  34.312  16.582  27.586
  173    HA   GLU  24           HA       GLU  24  35.772  14.079  26.887
  174    HB2  GLU  24           HB2      GLU  24  33.238  15.159  25.594
  175    HB3  GLU  24           HB3      GLU  24  34.114  13.677  25.178
  176    HG2  GLU  24           HG2      GLU  24  33.685  12.922  27.604
  177    HG3  GLU  24           HG3      GLU  24  32.537  14.256  27.710
  178    H    ASP  25           H        ASP  25  36.535  17.053  26.880
  179    HA   ASP  25           HA       ASP  25  37.509  18.641  25.699
  180    HB2  ASP  25           HB2      ASP  25  39.104  16.713  25.554
  181    HB3  ASP  25           HB3      ASP  25  38.577  16.477  23.897
  182    H    LYS  26           H        LYS  26  34.777  18.062  24.857
  183    HA   LYS  26           HA       LYS  26  34.753  18.920  21.997
  184    HB2  LYS  26           HB2      LYS  26  32.743  17.437  23.727
  185    HB3  LYS  26           HB3      LYS  26  32.356  18.141  22.166
  186    HG2  LYS  26           HG2      LYS  26  34.576  16.704  21.453
  187    HG3  LYS  26           HG3      LYS  26  33.967  15.699  22.790
  188    HD2  LYS  26           HD2      LYS  26  31.747  15.602  21.721
  189    HD3  LYS  26           HD3      LYS  26  32.316  16.735  20.476
  190    HE2  LYS  26           HE2      LYS  26  33.999  15.059  19.735
  191    HE3  LYS  26           HE3      LYS  26  33.334  13.902  20.901
  192    HZ1  LYS  26           HZ1      LYS  26  31.240  13.982  19.767
  193    HZ2  LYS  26           HZ2      LYS  26  31.706  15.180  18.755
  194    HZ3  LYS  26           HZ3      LYS  26  32.384  13.676  18.639
  195    H    GLU  27           H        GLU  27  33.126  20.241  21.231
  196    HA   GLU  27           HA       GLU  27  32.439  22.599  22.841
  197    HB2  GLU  27           HB2      GLU  27  31.792  21.626  20.042
  198    HB3  GLU  27           HB3      GLU  27  31.072  23.079  20.704
  199    HG2  GLU  27           HG2      GLU  27  34.097  22.730  20.538
  200    HG3  GLU  27           HG3      GLU  27  33.139  23.316  19.186
  201    H    GLY  28           H        GLY  28  30.294  23.084  23.430
  202    HA2  GLY  28           HA2      GLY  28  28.338  20.825  23.581
  203    HA3  GLY  28           HA3      GLY  28  28.818  21.672  25.047
  204    H    ILE  29           H        ILE  29  26.208  21.286  23.624
  205    HA   ILE  29           HA       ILE  29  25.373  24.110  23.264
  206    HB   ILE  29           HB       ILE  29  25.860  23.253  21.136
  207   HG12  ILE  29          HG12      ILE  29  23.737  24.608  21.590
  208   HG13  ILE  29          HG13      ILE  29  24.068  23.961  19.990
  209   HG21  ILE  29          HG21      ILE  29  25.857  20.892  21.333
  210   HG22  ILE  29          HG22      ILE  29  24.115  20.852  21.667
  211   HG23  ILE  29          HG23      ILE  29  24.716  21.341  20.065
  212   HD11  ILE  29          HD11      ILE  29  22.436  22.210  20.258
  213   HD12  ILE  29          HD12      ILE  29  22.152  22.658  21.954
  214   HD13  ILE  29          HD13      ILE  29  21.689  23.764  20.647
  215    H    CYS  30           H        CYS  30  23.606  24.694  24.260
  216    HA   CYS  30           HA       CYS  30  22.111  22.905  25.952
  217    HB2  CYS  30           HB2      CYS  30  21.682  25.794  25.109
  218    HB3  CYS  30           HB3      CYS  30  20.660  24.948  26.270
  219    H    HIS  31           H        HIS  31  20.825  21.427  25.148
  220    HA   HIS  31           HA       HIS  31  18.785  21.976  23.022
  221    HB2  HIS  31           HB2      HIS  31  20.006  19.458  24.178
  222    HB3  HIS  31           HB3      HIS  31  18.379  19.418  23.515
  223    HD2  HIS  31           HD2      HIS  31  21.989  20.147  22.318
  224    HE1  HIS  31           HE1      HIS  31  19.653  19.049  18.923
  225    HE2  HIS  31           HE2      HIS  31  22.006  19.608  19.727
  226    H    GLY  32           H        GLY  32  17.365  23.261  24.139
  227    HA2  GLY  32           HA2      GLY  32  15.568  23.772  25.481
  228    HA3  GLY  32           HA3      GLY  32  15.380  22.052  25.786
  229    H    THR  33           H        THR  33  15.735  21.385  27.799
  230    HA   THR  33           HA       THR  33  17.356  23.021  29.711
  231    HB   THR  33           HB       THR  33  16.061  22.017  31.551
  232    HG1  THR  33           HG1      THR  33  14.002  21.219  31.008
  233   HG21  THR  33          HG21      THR  33  14.085  23.436  31.221
  234   HG22  THR  33          HG22      THR  33  15.560  24.222  30.668
  235   HG23  THR  33          HG23      THR  33  14.427  23.539  29.481
  236    H    LYS  34           H        LYS  34  18.322  20.993  27.812
  237    HA   LYS  34           HA       LYS  34  20.071  19.560  29.724
  238    HB2  LYS  34           HB2      LYS  34  18.671  18.296  27.321
  239    HB3  LYS  34           HB3      LYS  34  19.968  17.513  28.215
  240    HG2  LYS  34           HG2      LYS  34  17.309  18.334  29.439
  241    HG3  LYS  34           HG3      LYS  34  17.676  16.730  28.837
  242    HD2  LYS  34           HD2      LYS  34  19.379  16.354  30.481
  243    HD3  LYS  34           HD3      LYS  34  19.371  18.038  31.016
  244    HE2  LYS  34           HE2      LYS  34  16.863  16.358  31.168
  245    HE3  LYS  34           HE3      LYS  34  18.107  16.266  32.438
  246    HZ1  LYS  34           HZ1      LYS  34  17.018  18.879  31.605
  247    HZ2  LYS  34           HZ2      LYS  34  16.272  17.996  32.771
  248    HZ3  LYS  34           HZ3      LYS  34  17.806  18.499  32.980
  249    H    CYS  35           H        CYS  35  21.950  18.495  28.418
  250    HA   CYS  35           HA       CYS  35  22.939  20.430  26.363
  251    HB2  CYS  35           HB2      CYS  35  24.037  20.521  28.649
  252    HB3  CYS  35           HB3      CYS  35  24.635  18.895  28.337
  253    H    LYS  36           H        LYS  36  24.401  19.596  24.781
  254    HA   LYS  36           HA       LYS  36  24.803  16.729  24.417
  255    HB2  LYS  36           HB2      LYS  36  22.848  18.318  22.914
  256    HB3  LYS  36           HB3      LYS  36  24.183  17.919  21.863
  257    HG2  LYS  36           HG2      LYS  36  23.761  15.458  22.877
  258    HG3  LYS  36           HG3      LYS  36  22.192  16.167  23.296
  259    HD2  LYS  36           HD2      LYS  36  22.036  14.978  21.175
  260    HD3  LYS  36           HD3      LYS  36  21.825  16.717  20.877
  261    HE2  LYS  36           HE2      LYS  36  24.151  16.918  20.120
  262    HE3  LYS  36           HE3      LYS  36  24.496  15.266  20.649
  263    HZ1  LYS  36           HZ1      LYS  36  24.204  15.395  18.302
  264    HZ2  LYS  36           HZ2      LYS  36  22.983  14.470  18.932
  265    HZ3  LYS  36           HZ3      LYS  36  22.720  16.023  18.399
  266    H    CYS  37           H        CYS  37  26.645  16.409  23.052
  267    HA   CYS  37           HA       CYS  37  28.363  18.813  22.791
  268    HB2  CYS  37           HB2      CYS  37  29.291  15.952  22.866
  269    HB3  CYS  37           HB3      CYS  37  30.249  17.422  22.989
  270    H    GLY  38           H        GLY  38  29.670  19.226  21.102
  271    HA2  GLY  38           HA2      GLY  38  28.620  18.556  18.414
  272    HA3  GLY  38           HA3      GLY  38  29.646  19.887  18.910
  273    H    VAL  39           H        VAL  39  31.581  19.792  17.991
  274    HA   VAL  39           HA       VAL  39  33.022  17.225  17.733
  275    HB   VAL  39           HB       VAL  39  34.438  18.382  16.079
  276   HG11  VAL  39          HG11      VAL  39  31.487  18.492  15.373
  277   HG12  VAL  39          HG12      VAL  39  32.858  18.344  14.258
  278   HG13  VAL  39          HG13      VAL  39  32.497  17.027  15.381
  279   HG21  VAL  39          HG21      VAL  39  32.473  20.666  16.070
  280   HG22  VAL  39          HG22      VAL  39  34.051  20.735  16.886
  281   HG23  VAL  39          HG23      VAL  39  33.958  20.482  15.133
  282    HA   PRO  40           HA       PRO  40  36.209  18.269  20.638
  283    HB2  PRO  40           HB2      PRO  40  38.078  18.120  18.268
  284    HB3  PRO  40           HB3      PRO  40  38.309  17.483  19.934
  285    HG2  PRO  40           HG2      PRO  40  37.496  15.817  17.963
  286    HG3  PRO  40           HG3      PRO  40  36.706  15.743  19.567
  287    HD2  PRO  40           HD2      PRO  40  35.670  17.076  17.046
  288    HD3  PRO  40           HD3      PRO  40  34.807  16.117  18.266
  289    H    ILE  41           H        ILE  41  37.215  20.071  21.451
  290    HA   ILE  41           HA       ILE  41  36.545  22.609  20.337
  291    HB   ILE  41           HB       ILE  41  37.812  23.563  22.198
  292   HG12  ILE  41          HG12      ILE  41  38.513  21.633  23.952
  293   HG13  ILE  41          HG13      ILE  41  38.899  20.766  22.493
  294   HG21  ILE  41          HG21      ILE  41  36.121  21.224  23.111
  295   HG22  ILE  41          HG22      ILE  41  36.376  22.770  23.935
  296   HG23  ILE  41          HG23      ILE  41  35.464  22.729  22.430
  297   HD11  ILE  41          HD11      ILE  41  40.420  22.632  21.809
  298   HD12  ILE  41          HD12      ILE  41  39.982  23.503  23.291
  299   HD13  ILE  41          HD13      ILE  41  40.854  21.957  23.387
  300    H    SER  42           H        SER  42  39.262  20.722  19.555
  301    HA   SER  42           HA       SER  42  41.367  22.471  19.424
  302    HB2  SER  42           HB2      SER  42  42.186  20.972  17.503
  303    HB3  SER  42           HB3      SER  42  41.841  20.232  19.065
  304    HG   SER  42           HG       SER  42  40.372  20.083  16.664
  305    H    TYR  43           H        TYR  43  42.063  24.095  18.276
  306    HA   TYR  43           HA       TYR  43  40.273  25.419  16.377
  307    HB2  TYR  43           HB2      TYR  43  43.031  26.202  17.417
  308    HB3  TYR  43           HB3      TYR  43  41.914  27.248  16.549
  309    HD1  TYR  43           HD1      TYR  43  42.919  26.055  19.806
  310    HD2  TYR  43           HD2      TYR  43  39.613  27.741  17.608
  311    HE1  TYR  43           HE1      TYR  43  41.831  26.736  21.943
  312    HE2  TYR  43           HE2      TYR  43  38.516  28.386  19.746
  313    HH   TYR  43           HH       TYR  43  40.083  27.869  22.906
  314    H    LEU  44           H        LEU  44  42.942  23.292  16.064
  315    HA   LEU  44           HA       LEU  44  42.990  23.668  13.121
  316    HB2  LEU  44           HB2      LEU  44  44.968  24.815  14.067
  317    HB3  LEU  44           HB3      LEU  44  45.423  23.347  14.936
  318    HG   LEU  44           HG       LEU  44  45.840  22.184  12.794
  319   HD11  LEU  44          HD11      LEU  44  45.929  23.508  10.690
  320   HD12  LEU  44          HD12      LEU  44  44.281  23.331  11.300
  321   HD13  LEU  44          HD13      LEU  44  45.144  24.868  11.533
  322   HD21  LEU  44          HD21      LEU  44  47.641  23.421  13.940
  323   HD22  LEU  44          HD22      LEU  44  47.850  23.446  12.183
  324   HD23  LEU  44          HD23      LEU  44  47.223  24.887  13.023
  Start of MODEL    7
    1    H1   ALA   1           H1       ALA   1  27.578  25.272  35.733
    2    H2   ALA   1           H2       ALA   1  27.896  24.682  34.230
    3    H3   ALA   1           H3       ALA   1  28.731  24.123  35.540
    4    HA   ALA   1           HA       ALA   1  25.855  23.782  35.076
    5    HB1  ALA   1           HB1      ALA   1  28.096  21.726  34.884
    6    HB2  ALA   1           HB2      ALA   1  26.362  21.380  34.751
    7    HB3  ALA   1           HB3      ALA   1  27.159  22.379  33.527
    8    H    LYS   2           H        LYS   2  24.641  22.894  36.698
    9    HA   LYS   2           HA       LYS   2  25.900  21.771  39.137
   10    HB2  LYS   2           HB2      LYS   2  25.782  24.281  39.404
   11    HB3  LYS   2           HB3      LYS   2  24.042  24.179  39.162
   12    HG2  LYS   2           HG2      LYS   2  24.005  22.642  41.262
   13    HG3  LYS   2           HG3      LYS   2  25.704  23.071  41.470
   14    HD2  LYS   2           HD2      LYS   2  24.352  24.485  42.891
   15    HD3  LYS   2           HD3      LYS   2  25.011  25.497  41.596
   16    HE2  LYS   2           HE2      LYS   2  22.875  25.287  40.342
   17    HE3  LYS   2           HE3      LYS   2  22.240  24.203  41.588
   18    HZ1  LYS   2           HZ1      LYS   2  22.917  27.070  42.024
   19    HZ2  LYS   2           HZ2      LYS   2  21.426  26.464  41.862
   20    HZ3  LYS   2           HZ3      LYS   2  22.311  26.032  43.156
   21    H    ASN   3           H        ASN   3  22.923  22.517  37.353
   22    HA   ASN   3           HA       ASN   3  21.471  20.232  38.584
   23    HB2  ASN   3           HB2      ASN   3  19.577  21.814  39.128
   24    HB3  ASN   3           HB3      ASN   3  21.012  21.977  40.125
   25   HD21  ASN   3          HD21      ASN   3  20.175  25.431  39.573
   26   HD22  ASN   3          HD22      ASN   3  19.989  24.086  40.695
   27    H    GLN   4           H        GLN   4  21.209  22.890  36.212
   28    HA   GLN   4           HA       GLN   4  19.740  21.082  34.336
   29    HB2  GLN   4           HB2      GLN   4  18.569  22.963  33.552
   30    HB3  GLN   4           HB3      GLN   4  18.427  22.873  35.305
   31    HG2  GLN   4           HG2      GLN   4  20.352  24.655  35.371
   32    HG3  GLN   4           HG3      GLN   4  20.010  24.870  33.644
   33   HE21  GLN   4          HE21      GLN   4  16.572  25.408  34.318
   34   HE22  GLN   4          HE22      GLN   4  17.753  25.205  33.042
   35    H    PHE   5           H        PHE   5  22.723  21.352  34.563
   36    HA   PHE   5           HA       PHE   5  24.587  21.838  33.384
   37    HB2  PHE   5           HB2      PHE   5  22.771  21.321  31.018
   38    HB3  PHE   5           HB3      PHE   5  24.530  21.320  31.006
   39    HD1  PHE   5           HD1      PHE   5  21.573  19.530  32.466
   40    HD2  PHE   5           HD2      PHE   5  25.788  19.417  31.590
   41    HE1  PHE   5           HE1      PHE   5  21.643  17.125  33.078
   42    HE2  PHE   5           HE2      PHE   5  25.823  16.994  32.118
   43    HZ   PHE   5           HZ       PHE   5  23.760  15.848  32.905
   44    H    GLY   6           H        GLY   6  23.019  24.222  34.116
   45    HA2  GLY   6           HA2      GLY   6  23.051  26.508  33.778
   46    HA3  GLY   6           HA3      GLY   6  24.267  26.259  32.520
   47    H    CYS   7           H        CYS   7  21.671  24.389  31.602
   48    HA   CYS   7           HA       CYS   7  21.037  26.313  29.485
   49    HB2  CYS   7           HB2      CYS   7  20.538  23.334  29.811
   50    HB3  CYS   7           HB3      CYS   7  20.165  24.263  28.373
   51    H    PHE   8           H        PHE   8  19.082  27.069  28.946
   52    HA   PHE   8           HA       PHE   8  16.686  25.661  29.822
   53    HB2  PHE   8           HB2      PHE   8  17.065  27.266  31.691
   54    HB3  PHE   8           HB3      PHE   8  16.961  28.595  30.547
   55    HD1  PHE   8           HD1      PHE   8  14.828  29.189  29.459
   56    HD2  PHE   8           HD2      PHE   8  15.097  26.062  32.420
   57    HE1  PHE   8           HE1      PHE   8  12.338  29.126  29.649
   58    HE2  PHE   8           HE2      PHE   8  12.627  25.985  32.579
   59    HZ   PHE   8           HZ       PHE   8  11.247  27.477  31.176
   60    H    ALA   9           H        ALA   9  15.235  25.587  28.272
   61    HA   ALA   9           HA       ALA   9  14.316  25.753  26.240
   62    HB1  ALA   9           HB1      ALA   9  13.127  27.487  27.420
   63    HB2  ALA   9           HB2      ALA   9  14.359  28.697  26.983
   64    HB3  ALA   9           HB3      ALA   9  13.343  27.962  25.723
   65    H    ASN  10           H        ASN  10  16.672  25.065  25.688
   66    HA   ASN  10           HA       ASN  10  18.355  24.929  24.201
   67    HB2  ASN  10           HB2      ASN  10  16.556  26.686  22.500
   68    HB3  ASN  10           HB3      ASN  10  17.963  25.856  21.891
   69   HD21  ASN  10          HD21      ASN  10  15.106  23.972  21.048
   70   HD22  ASN  10          HD22      ASN  10  15.488  25.662  20.870
   71    H    VAL  11           H        VAL  11  18.386  27.478  26.086
   72    HA   VAL  11           HA       VAL  11  20.781  28.662  24.730
   73    HB   VAL  11           HB       VAL  11  18.704  30.221  26.317
   74   HG11  VAL  11          HG11      VAL  11  19.935  32.192  25.343
   75   HG12  VAL  11          HG12      VAL  11  20.976  31.262  26.407
   76   HG13  VAL  11          HG13      VAL  11  21.133  31.094  24.643
   77   HG21  VAL  11          HG21      VAL  11  19.208  30.104  23.306
   78   HG22  VAL  11          HG22      VAL  11  17.732  29.598  24.147
   79   HG23  VAL  11          HG23      VAL  11  18.180  31.299  24.118
   80    H    ASP  12           H        ASP  12  22.494  29.276  25.967
   81    HA   ASP  12           HA       ASP  12  22.760  28.187  28.660
   82    HB2  ASP  12           HB2      ASP  12  25.058  28.808  28.491
   83    HB3  ASP  12           HB3      ASP  12  24.562  27.942  27.053
   84    H    VAL  13           H        VAL  13  20.714  29.777  28.875
   85    HA   VAL  13           HA       VAL  13  21.332  32.539  29.600
   86    HB   VAL  13           HB       VAL  13  18.907  32.327  30.648
   87   HG11  VAL  13          HG11      VAL  13  19.485  33.675  28.717
   88   HG12  VAL  13          HG12      VAL  13  19.388  32.236  27.683
   89   HG13  VAL  13          HG13      VAL  13  17.931  32.847  28.490
   90   HG21  VAL  13          HG21      VAL  13  17.468  30.710  29.701
   91   HG22  VAL  13          HG22      VAL  13  18.731  30.048  28.662
   92   HG23  VAL  13          HG23      VAL  13  18.825  29.812  30.416
   93    H    LYS  14           H        LYS  14  21.048  29.547  31.406
   94    HA   LYS  14           HA       LYS  14  20.887  31.039  33.992
   95    HB2  LYS  14           HB2      LYS  14  20.786  28.034  33.747
   96    HB3  LYS  14           HB3      LYS  14  20.224  29.061  35.055
   97    HG2  LYS  14           HG2      LYS  14  18.966  28.664  32.332
   98    HG3  LYS  14           HG3      LYS  14  18.335  28.137  33.880
   99    HD2  LYS  14           HD2      LYS  14  18.625  31.044  33.053
  100    HD3  LYS  14           HD3      LYS  14  17.145  30.102  32.904
  101    HE2  LYS  14           HE2      LYS  14  16.913  29.854  35.275
  102    HE3  LYS  14           HE3      LYS  14  18.535  30.483  35.581
  103    HZ1  LYS  14           HZ1      LYS  14  17.866  32.628  34.870
  104    HZ2  LYS  14           HZ2      LYS  14  16.400  32.117  34.331
  105    HZ3  LYS  14           HZ3      LYS  14  16.717  32.116  35.943
  106    H    GLY  15           H        GLY  15  23.177  29.044  32.222
  107    HA2  GLY  15           HA2      GLY  15  25.440  30.014  33.727
  108    HA3  GLY  15           HA3      GLY  15  25.011  28.387  34.252
  109    H    ASP  16           H        ASP  16  26.744  27.243  33.407
  110    HA   ASP  16           HA       ASP  16  27.047  27.250  30.441
  111    HB2  ASP  16           HB2      ASP  16  29.370  26.979  30.601
  112    HB3  ASP  16           HB3      ASP  16  28.945  28.346  31.633
  113    H    CYS  17           H        CYS  17  27.213  25.519  29.357
  114    HA   CYS  17           HA       CYS  17  27.024  22.752  30.521
  115    HB2  CYS  17           HB2      CYS  17  25.181  22.698  29.287
  116    HB3  CYS  17           HB3      CYS  17  25.490  24.250  28.589
  117    H    LYS  18           H        LYS  18  28.924  24.919  28.597
  118    HA   LYS  18           HA       LYS  18  30.723  23.475  27.120
  119    HB2  LYS  18           HB2      LYS  18  30.916  25.871  27.421
  120    HB3  LYS  18           HB3      LYS  18  31.087  25.709  29.160
  121    HG2  LYS  18           HG2      LYS  18  33.194  26.307  28.410
  122    HG3  LYS  18           HG3      LYS  18  33.333  24.615  28.810
  123    HD2  LYS  18           HD2      LYS  18  34.484  24.654  26.831
  124    HD3  LYS  18           HD3      LYS  18  32.885  24.254  26.197
  125    HE2  LYS  18           HE2      LYS  18  32.474  26.573  25.563
  126    HE3  LYS  18           HE3      LYS  18  33.847  27.133  26.526
  127    HZ1  LYS  18           HZ1      LYS  18  34.440  27.131  24.220
  128    HZ2  LYS  18           HZ2      LYS  18  35.338  26.005  24.993
  129    HZ3  LYS  18           HZ3      LYS  18  34.066  25.559  24.012
  130    H    ARG  19           H        ARG  19  30.989  23.759  30.736
  131    HA   ARG  19           HA       ARG  19  33.309  22.116  30.892
  132    HB2  ARG  19           HB2      ARG  19  31.291  23.123  32.903
  133    HB3  ARG  19           HB3      ARG  19  32.466  21.891  33.393
  134    HG2  ARG  19           HG2      ARG  19  34.327  23.255  32.602
  135    HG3  ARG  19           HG3      ARG  19  33.232  24.537  32.080
  136    HD2  ARG  19           HD2      ARG  19  33.449  23.571  34.967
  137    HD3  ARG  19           HD3      ARG  19  34.457  24.852  34.276
  138    HE   ARG  19           HE       ARG  19  31.640  25.386  33.834
  139   HH11  ARG  19          HH11      ARG  19  34.229  25.785  36.245
  140   HH12  ARG  19          HH12      ARG  19  33.391  27.184  36.922
  141   HH21  ARG  19          HH21      ARG  19  30.668  27.029  34.916
  142   HH22  ARG  19          HH22      ARG  19  31.547  27.857  36.212
  143    H    HIS  20           H        HIS  20  30.004  21.009  30.621
  144    HA   HIS  20           HA       HIS  20  30.613  18.255  31.475
  145    HB2  HIS  20           HB2      HIS  20  28.371  19.021  31.738
  146    HB3  HIS  20           HB3      HIS  20  28.277  19.603  30.080
  147    HD2  HIS  20           HD2      HIS  20  27.140  18.088  28.412
  148    HE1  HIS  20           HE1      HIS  20  27.490  14.345  30.424
  149    HE2  HIS  20           HE2      HIS  20  26.547  15.493  28.356
  150    H    CYS  21           H        CYS  21  30.253  19.912  28.283
  151    HA   CYS  21           HA       CYS  21  31.020  17.499  26.839
  152    HB2  CYS  21           HB2      CYS  21  30.585  20.384  26.058
  153    HB3  CYS  21           HB3      CYS  21  31.093  19.180  24.892
  154    H    LYS  22           H        LYS  22  32.841  20.287  28.060
  155    HA   LYS  22           HA       LYS  22  35.269  19.831  26.678
  156    HB2  LYS  22           HB2      LYS  22  34.708  21.883  27.928
  157    HB3  LYS  22           HB3      LYS  22  34.710  20.990  29.433
  158    HG2  LYS  22           HG2      LYS  22  36.669  22.195  29.456
  159    HG3  LYS  22           HG3      LYS  22  37.207  20.571  29.102
  160    HD2  LYS  22           HD2      LYS  22  36.815  22.805  27.049
  161    HD3  LYS  22           HD3      LYS  22  38.332  22.472  27.850
  162    HE2  LYS  22           HE2      LYS  22  36.893  20.617  25.915
  163    HE3  LYS  22           HE3      LYS  22  38.311  21.612  25.595
  164    HZ1  LYS  22           HZ1      LYS  22  39.084  19.405  26.047
  165    HZ2  LYS  22           HZ2      LYS  22  39.486  20.302  27.356
  166    HZ3  LYS  22           HZ3      LYS  22  38.219  19.260  27.415
  167    H    ALA  23           H        ALA  23  33.951  18.143  29.490
  168    HA   ALA  23           HA       ALA  23  36.336  16.645  30.137
  169    HB1  ALA  23           HB1      ALA  23  34.456  17.026  31.696
  170    HB2  ALA  23           HB2      ALA  23  33.384  16.085  30.642
  171    HB3  ALA  23           HB3      ALA  23  34.745  15.290  31.457
  172    H    GLU  24           H        GLU  24  33.833  16.242  27.692
  173    HA   GLU  24           HA       GLU  24  34.862  13.608  26.780
  174    HB2  GLU  24           HB2      GLU  24  32.710  15.368  25.550
  175    HB3  GLU  24           HB3      GLU  24  33.056  13.697  25.164
  176    HG2  GLU  24           HG2      GLU  24  31.884  14.748  27.766
  177    HG3  GLU  24           HG3      GLU  24  31.016  13.923  26.481
  178    H    ASP  25           H        ASP  25  36.142  16.501  26.702
  179    HA   ASP  25           HA       ASP  25  37.325  17.856  25.478
  180    HB2  ASP  25           HB2      ASP  25  38.627  15.663  25.438
  181    HB3  ASP  25           HB3      ASP  25  38.166  15.544  23.740
  182    H    LYS  26           H        LYS  26  34.628  17.795  24.729
  183    HA   LYS  26           HA       LYS  26  34.641  18.717  21.879
  184    HB2  LYS  26           HB2      LYS  26  32.397  17.498  23.519
  185    HB3  LYS  26           HB3      LYS  26  32.223  18.213  21.918
  186    HG2  LYS  26           HG2      LYS  26  34.255  16.429  21.423
  187    HG3  LYS  26           HG3      LYS  26  33.363  15.591  22.704
  188    HD2  LYS  26           HD2      LYS  26  31.255  15.939  21.379
  189    HD3  LYS  26           HD3      LYS  26  32.237  16.686  20.093
  190    HE2  LYS  26           HE2      LYS  26  33.523  14.602  19.842
  191    HE3  LYS  26           HE3      LYS  26  32.684  13.896  21.225
  192    HZ1  LYS  26           HZ1      LYS  26  30.603  14.451  19.686
  193    HZ2  LYS  26           HZ2      LYS  26  31.700  14.149  18.498
  194    HZ3  LYS  26           HZ3      LYS  26  31.373  13.019  19.657
  195    H    GLU  27           H        GLU  27  32.894  20.249  21.377
  196    HA   GLU  27           HA       GLU  27  32.700  22.540  23.238
  197    HB2  GLU  27           HB2      GLU  27  31.645  21.994  20.441
  198    HB3  GLU  27           HB3      GLU  27  31.365  23.493  21.306
  199    HG2  GLU  27           HG2      GLU  27  34.217  22.559  20.837
  200    HG3  GLU  27           HG3      GLU  27  33.289  23.248  19.521
  201    H    GLY  28           H        GLY  28  30.672  23.235  24.012
  202    HA2  GLY  28           HA2      GLY  28  28.467  21.197  24.173
  203    HA3  GLY  28           HA3      GLY  28  28.838  22.332  25.450
  204    H    ILE  29           H        ILE  29  26.246  21.877  23.938
  205    HA   ILE  29           HA       ILE  29  25.632  24.699  23.574
  206    HB   ILE  29           HB       ILE  29  26.344  23.947  21.374
  207   HG12  ILE  29          HG12      ILE  29  24.470  25.632  21.811
  208   HG13  ILE  29          HG13      ILE  29  24.825  25.101  20.177
  209   HG21  ILE  29          HG21      ILE  29  25.015  22.410  19.986
  210   HG22  ILE  29          HG22      ILE  29  25.891  21.618  21.297
  211   HG23  ILE  29          HG23      ILE  29  24.143  21.888  21.441
  212   HD11  ILE  29          HD11      ILE  29  22.577  23.899  21.819
  213   HD12  ILE  29          HD12      ILE  29  22.377  25.276  20.714
  214   HD13  ILE  29          HD13      ILE  29  22.886  23.699  20.085
  215    H    CYS  30           H        CYS  30  23.560  25.146  24.262
  216    HA   CYS  30           HA       CYS  30  22.362  23.078  25.898
  217    HB2  CYS  30           HB2      CYS  30  21.692  25.975  25.332
  218    HB3  CYS  30           HB3      CYS  30  20.733  24.954  26.420
  219    H    HIS  31           H        HIS  31  20.798  21.725  25.460
  220    HA   HIS  31           HA       HIS  31  18.682  22.435  23.463
  221    HB2  HIS  31           HB2      HIS  31  20.066  19.777  23.854
  222    HB3  HIS  31           HB3      HIS  31  18.444  19.908  23.196
  223    HD2  HIS  31           HD2      HIS  31  21.894  21.557  22.317
  224    HE1  HIS  31           HE1      HIS  31  19.983  20.409  18.685
  225    HE2  HIS  31           HE2      HIS  31  22.081  21.410  19.671
  226    H    GLY  32           H        GLY  32  16.939  22.879  24.526
  227    HA2  GLY  32           HA2      GLY  32  15.217  22.900  26.096
  228    HA3  GLY  32           HA3      GLY  32  15.665  21.254  26.537
  229    H    THR  33           H        THR  33  16.014  21.134  28.633
  230    HA   THR  33           HA       THR  33  17.649  23.186  30.068
  231    HB   THR  33           HB       THR  33  16.772  22.255  32.167
  232    HG1  THR  33           HG1      THR  33  14.701  20.989  30.835
  233   HG21  THR  33          HG21      THR  33  15.709  24.204  31.168
  234   HG22  THR  33          HG22      THR  33  14.633  23.186  30.209
  235   HG23  THR  33          HG23      THR  33  14.505  23.210  31.982
  236    H    LYS  34           H        LYS  34  18.697  21.183  28.271
  237    HA   LYS  34           HA       LYS  34  20.612  19.786  30.079
  238    HB2  LYS  34           HB2      LYS  34  19.253  18.564  27.637
  239    HB3  LYS  34           HB3      LYS  34  20.443  17.773  28.657
  240    HG2  LYS  34           HG2      LYS  34  17.651  18.619  29.559
  241    HG3  LYS  34           HG3      LYS  34  18.110  17.008  29.042
  242    HD2  LYS  34           HD2      LYS  34  19.587  16.691  30.903
  243    HD3  LYS  34           HD3      LYS  34  19.438  18.364  31.437
  244    HE2  LYS  34           HE2      LYS  34  17.049  16.492  31.214
  245    HE3  LYS  34           HE3      LYS  34  18.041  16.567  32.668
  246    HZ1  LYS  34           HZ1      LYS  34  16.671  18.962  31.544
  247    HZ2  LYS  34           HZ2      LYS  34  16.046  17.991  32.708
  248    HZ3  LYS  34           HZ3      LYS  34  17.419  18.838  33.003
  249    H    CYS  35           H        CYS  35  22.500  18.963  28.818
  250    HA   CYS  35           HA       CYS  35  23.467  21.026  26.895
  251    HB2  CYS  35           HB2      CYS  35  24.674  20.453  29.048
  252    HB3  CYS  35           HB3      CYS  35  24.972  18.857  28.392
  253    H    LYS  36           H        LYS  36  24.590  20.258  24.945
  254    HA   LYS  36           HA       LYS  36  24.362  17.449  24.143
  255    HB2  LYS  36           HB2      LYS  36  22.316  18.702  23.360
  256    HB3  LYS  36           HB3      LYS  36  23.349  19.852  22.535
  257    HG2  LYS  36           HG2      LYS  36  23.687  16.935  21.908
  258    HG3  LYS  36           HG3      LYS  36  22.220  17.732  21.335
  259    HD2  LYS  36           HD2      LYS  36  23.344  19.168  19.904
  260    HD3  LYS  36           HD3      LYS  36  24.897  19.036  20.743
  261    HE2  LYS  36           HE2      LYS  36  25.360  16.917  19.927
  262    HE3  LYS  36           HE3      LYS  36  23.665  16.557  19.565
  263    HZ1  LYS  36           HZ1      LYS  36  24.964  17.032  17.542
  264    HZ2  LYS  36           HZ2      LYS  36  23.703  18.051  17.743
  265    HZ3  LYS  36           HZ3      LYS  36  25.225  18.589  18.066
  266    H    CYS  37           H        CYS  37  26.256  16.930  23.017
  267    HA   CYS  37           HA       CYS  37  28.261  19.100  22.939
  268    HB2  CYS  37           HB2      CYS  37  28.753  16.165  22.550
  269    HB3  CYS  37           HB3      CYS  37  29.942  17.445  22.764
  270    H    GLY  38           H        GLY  38  29.294  19.924  21.328
  271    HA2  GLY  38           HA2      GLY  38  28.304  19.577  18.573
  272    HA3  GLY  38           HA3      GLY  38  29.359  20.853  19.188
  273    H    VAL  39           H        VAL  39  31.270  20.736  18.106
  274    HA   VAL  39           HA       VAL  39  32.395  18.171  17.293
  275    HB   VAL  39           HB       VAL  39  34.103  19.555  16.123
  276   HG11  VAL  39          HG11      VAL  39  32.074  18.795  14.960
  277   HG12  VAL  39          HG12      VAL  39  31.224  20.287  15.445
  278   HG13  VAL  39          HG13      VAL  39  32.629  20.362  14.365
  279   HG21  VAL  39          HG21      VAL  39  33.789  21.945  15.861
  280   HG22  VAL  39          HG22      VAL  39  32.420  21.949  16.983
  281   HG23  VAL  39          HG23      VAL  39  34.060  21.565  17.564
  282    HA   PRO  40           HA       PRO  40  35.658  17.803  20.375
  283    HB2  PRO  40           HB2      PRO  40  37.468  17.410  18.019
  284    HB3  PRO  40           HB3      PRO  40  37.290  16.416  19.496
  285    HG2  PRO  40           HG2      PRO  40  36.212  15.628  17.131
  286    HG3  PRO  40           HG3      PRO  40  35.369  15.363  18.687
  287    HD2  PRO  40           HD2      PRO  40  34.778  17.501  16.611
  288    HD3  PRO  40           HD3      PRO  40  33.687  16.536  17.639
  289    H    ILE  41           H        ILE  41  37.190  19.254  21.299
  290    HA   ILE  41           HA       ILE  41  37.253  21.877  20.151
  291    HB   ILE  41           HB       ILE  41  38.511  22.594  22.001
  292   HG12  ILE  41          HG12      ILE  41  38.980  20.708  23.837
  293   HG13  ILE  41          HG13      ILE  41  39.186  19.695  22.422
  294   HG21  ILE  41          HG21      ILE  41  36.512  20.545  23.011
  295   HG22  ILE  41          HG22      ILE  41  36.977  22.085  23.757
  296   HG23  ILE  41          HG23      ILE  41  36.072  22.088  22.245
  297   HD11  ILE  41          HD11      ILE  41  40.699  22.254  23.122
  298   HD12  ILE  41          HD12      ILE  41  41.329  20.597  23.142
  299   HD13  ILE  41          HD13      ILE  41  40.943  21.367  21.608
  300    H    SER  42           H        SER  42  39.545  19.182  20.047
  301    HA   SER  42           HA       SER  42  41.820  20.698  19.329
  302    HB2  SER  42           HB2      SER  42  41.731  18.310  20.215
  303    HB3  SER  42           HB3      SER  42  41.374  17.792  18.554
  304    HG   SER  42           HG       SER  42  43.439  18.036  18.127
  305    H    TYR  43           H        TYR  43  42.616  21.464  17.457
  306    HA   TYR  43           HA       TYR  43  41.000  21.172  14.981
  307    HB2  TYR  43           HB2      TYR  43  43.358  22.961  15.655
  308    HB3  TYR  43           HB3      TYR  43  42.486  22.975  14.130
  309    HD1  TYR  43           HD1      TYR  43  39.976  23.516  14.114
  310    HD2  TYR  43           HD2      TYR  43  42.509  24.208  17.541
  311    HE1  TYR  43           HE1      TYR  43  38.281  25.066  15.056
  312    HE2  TYR  43           HE2      TYR  43  40.819  25.782  18.460
  313    HH   TYR  43           HH       TYR  43  37.773  26.540  16.734
  314    H    LEU  44           H        LEU  44  43.538  19.490  16.321
  315    HA   LEU  44           HA       LEU  44  44.156  18.056  13.851
  316    HB2  LEU  44           HB2      LEU  44  46.652  18.187  14.348
  317    HB3  LEU  44           HB3      LEU  44  45.895  19.573  13.615
  318    HG   LEU  44           HG       LEU  44  45.933  20.820  15.734
  319   HD11  LEU  44          HD11      LEU  44  47.278  19.952  17.637
  320   HD12  LEU  44          HD12      LEU  44  45.808  19.023  17.392
  321   HD13  LEU  44          HD13      LEU  44  47.371  18.363  16.847
  322   HD21  LEU  44          HD21      LEU  44  48.613  19.568  14.977
  323   HD22  LEU  44          HD22      LEU  44  47.821  20.940  14.162
  324   HD23  LEU  44          HD23      LEU  44  48.370  21.108  15.832
  Start of MODEL    8
    1    H1   ALA   1           H1       ALA   1  28.456  23.997  33.506
    2    H2   ALA   1           H2       ALA   1  29.331  23.291  34.720
    3    H3   ALA   1           H3       ALA   1  28.922  24.885  34.821
    4    HA   ALA   1           HA       ALA   1  27.557  23.657  36.273
    5    HB1  ALA   1           HB1      ALA   1  26.582  25.602  35.130
    6    HB2  ALA   1           HB2      ALA   1  26.048  24.565  33.791
    7    HB3  ALA   1           HB3      ALA   1  25.373  24.340  35.417
    8    H    LYS   2           H        LYS   2  25.781  22.044  36.537
    9    HA   LYS   2           HA       LYS   2  26.090  19.661  34.750
   10    HB2  LYS   2           HB2      LYS   2  27.854  19.673  36.518
   11    HB3  LYS   2           HB3      LYS   2  26.630  19.809  37.752
   12    HG2  LYS   2           HG2      LYS   2  26.721  17.607  37.941
   13    HG3  LYS   2           HG3      LYS   2  25.769  17.507  36.473
   14    HD2  LYS   2           HD2      LYS   2  28.803  17.483  36.646
   15    HD3  LYS   2           HD3      LYS   2  27.752  16.075  36.384
   16    HE2  LYS   2           HE2      LYS   2  26.856  17.345  34.316
   17    HE3  LYS   2           HE3      LYS   2  28.245  18.428  34.510
   18    HZ1  LYS   2           HZ1      LYS   2  29.703  16.467  34.242
   19    HZ2  LYS   2           HZ2      LYS   2  28.394  15.472  34.142
   20    HZ3  LYS   2           HZ3      LYS   2  28.691  16.565  32.971
   21    H    ASN   3           H        ASN   3  24.349  20.821  37.741
   22    HA   ASN   3           HA       ASN   3  22.603  18.581  37.647
   23    HB2  ASN   3           HB2      ASN   3  22.121  21.196  39.104
   24    HB3  ASN   3           HB3      ASN   3  21.376  19.642  39.445
   25   HD21  ASN   3          HD21      ASN   3  24.101  18.712  41.518
   26   HD22  ASN   3          HD22      ASN   3  22.452  18.315  41.021
   27    H    GLN   4           H        GLN   4  22.234  21.754  36.122
   28    HA   GLN   4           HA       GLN   4  20.197  20.489  34.370
   29    HB2  GLN   4           HB2      GLN   4  18.868  22.409  34.151
   30    HB3  GLN   4           HB3      GLN   4  18.953  22.021  35.866
   31    HG2  GLN   4           HG2      GLN   4  20.423  23.882  36.301
   32    HG3  GLN   4           HG3      GLN   4  20.695  24.175  34.575
   33   HE21  GLN   4          HE21      GLN   4  18.563  24.696  33.247
   34   HE22  GLN   4          HE22      GLN   4  17.469  25.743  34.146
   35    H    PHE   5           H        PHE   5  23.139  20.997  34.355
   36    HA   PHE   5           HA       PHE   5  24.845  21.822  33.138
   37    HB2  PHE   5           HB2      PHE   5  22.989  21.556  30.780
   38    HB3  PHE   5           HB3      PHE   5  24.748  21.455  30.821
   39    HD1  PHE   5           HD1      PHE   5  21.595  19.680  31.582
   40    HD2  PHE   5           HD2      PHE   5  25.896  19.449  31.651
   41    HE1  PHE   5           HE1      PHE   5  21.457  17.209  31.855
   42    HE2  PHE   5           HE2      PHE   5  25.750  16.982  31.935
   43    HZ   PHE   5           HZ       PHE   5  23.536  15.866  32.012
   44    H    GLY   6           H        GLY   6  22.785  23.978  34.036
   45    HA2  GLY   6           HA2      GLY   6  22.695  26.271  33.904
   46    HA3  GLY   6           HA3      GLY   6  24.024  26.232  32.734
   47    H    CYS   7           H        CYS   7  21.651  24.221  31.506
   48    HA   CYS   7           HA       CYS   7  21.029  26.235  29.465
   49    HB2  CYS   7           HB2      CYS   7  20.550  23.245  29.613
   50    HB3  CYS   7           HB3      CYS   7  20.103  24.249  28.255
   51    H    PHE   8           H        PHE   8  19.154  27.158  29.103
   52    HA   PHE   8           HA       PHE   8  16.659  25.689  29.610
   53    HB2  PHE   8           HB2      PHE   8  17.012  27.011  31.709
   54    HB3  PHE   8           HB3      PHE   8  17.020  28.482  30.753
   55    HD1  PHE   8           HD1      PHE   8  14.965  29.422  29.844
   56    HD2  PHE   8           HD2      PHE   8  14.946  25.673  31.980
   57    HE1  PHE   8           HE1      PHE   8  12.474  29.483  29.962
   58    HE2  PHE   8           HE2      PHE   8  12.462  25.735  32.062
   59    HZ   PHE   8           HZ       PHE   8  11.228  27.632  31.044
   60    H    ALA   9           H        ALA   9  15.050  26.185  28.062
   61    HA   ALA   9           HA       ALA   9  14.304  26.800  26.024
   62    HB1  ALA   9           HB1      ALA   9  15.124  29.566  26.975
   63    HB2  ALA   9           HB2      ALA   9  13.876  29.175  25.770
   64    HB3  ALA   9           HB3      ALA   9  13.651  28.699  27.460
   65    H    ASN  10           H        ASN  10  16.790  25.704  25.707
   66    HA   ASN  10           HA       ASN  10  18.643  25.507  24.466
   67    HB2  ASN  10           HB2      ASN  10  17.153  27.108  22.351
   68    HB3  ASN  10           HB3      ASN  10  18.499  26.013  22.088
   69   HD21  ASN  10          HD21      ASN  10  15.698  24.231  21.091
   70   HD22  ASN  10          HD22      ASN  10  16.955  25.301  20.483
   71    H    VAL  11           H        VAL  11  18.671  27.842  26.285
   72    HA   VAL  11           HA       VAL  11  21.000  29.262  25.073
   73    HB   VAL  11           HB       VAL  11  18.816  30.531  26.761
   74   HG11  VAL  11          HG11      VAL  11  21.043  31.579  27.175
   75   HG12  VAL  11          HG12      VAL  11  21.301  31.729  25.427
   76   HG13  VAL  11          HG13      VAL  11  20.015  32.649  26.229
   77   HG21  VAL  11          HG21      VAL  11  18.402  31.897  24.715
   78   HG22  VAL  11          HG22      VAL  11  19.573  30.909  23.818
   79   HG23  VAL  11          HG23      VAL  11  18.070  30.192  24.422
   80    H    ASP  12           H        ASP  12  22.702  29.693  26.406
   81    HA   ASP  12           HA       ASP  12  22.943  28.192  28.894
   82    HB2  ASP  12           HB2      ASP  12  25.256  28.739  28.783
   83    HB3  ASP  12           HB3      ASP  12  24.718  28.220  27.201
   84    H    VAL  13           H        VAL  13  20.928  29.769  29.406
   85    HA   VAL  13           HA       VAL  13  21.612  32.409  30.440
   86    HB   VAL  13           HB       VAL  13  19.207  32.026  31.572
   87   HG11  VAL  13          HG11      VAL  13  19.654  32.587  28.641
   88   HG12  VAL  13          HG12      VAL  13  18.191  32.977  29.568
   89   HG13  VAL  13          HG13      VAL  13  19.727  33.753  29.978
   90   HG21  VAL  13          HG21      VAL  13  17.720  30.673  30.317
   91   HG22  VAL  13          HG22      VAL  13  18.962  30.217  29.148
   92   HG23  VAL  13          HG23      VAL  13  19.056  29.619  30.817
   93    H    LYS  14           H        LYS  14  21.057  29.273  31.995
   94    HA   LYS  14           HA       LYS  14  21.186  30.535  34.693
   95    HB2  LYS  14           HB2      LYS  14  20.785  27.590  34.159
   96    HB3  LYS  14           HB3      LYS  14  20.358  28.511  35.587
   97    HG2  LYS  14           HG2      LYS  14  19.019  28.588  32.861
   98    HG3  LYS  14           HG3      LYS  14  18.372  27.882  34.321
   99    HD2  LYS  14           HD2      LYS  14  18.907  30.878  34.089
  100    HD3  LYS  14           HD3      LYS  14  17.408  30.104  33.570
  101    HE2  LYS  14           HE2      LYS  14  17.094  29.162  35.846
  102    HE3  LYS  14           HE3      LYS  14  18.531  30.030  36.406
  103    HZ1  LYS  14           HZ1      LYS  14  16.255  31.458  35.129
  104    HZ2  LYS  14           HZ2      LYS  14  16.251  31.119  36.728
  105    HZ3  LYS  14           HZ3      LYS  14  17.418  32.094  36.074
  106    H    GLY  15           H        GLY  15  23.296  28.845  32.568
  107    HA2  GLY  15           HA2      GLY  15  25.626  29.385  34.168
  108    HA3  GLY  15           HA3      GLY  15  25.162  27.691  34.359
  109    H    ASP  16           H        ASP  16  27.057  26.916  33.291
  110    HA   ASP  16           HA       ASP  16  27.067  27.289  30.338
  111    HB2  ASP  16           HB2      ASP  16  29.457  27.037  30.306
  112    HB3  ASP  16           HB3      ASP  16  28.988  28.391  31.335
  113    H    CYS  17           H        CYS  17  26.840  25.655  29.129
  114    HA   CYS  17           HA       CYS  17  26.929  22.845  30.082
  115    HB2  CYS  17           HB2      CYS  17  25.010  23.100  28.931
  116    HB3  CYS  17           HB3      CYS  17  25.593  24.430  27.966
  117    H    LYS  18           H        LYS  18  28.880  25.150  28.342
  118    HA   LYS  18           HA       LYS  18  30.668  23.530  26.921
  119    HB2  LYS  18           HB2      LYS  18  30.910  25.952  26.948
  120    HB3  LYS  18           HB3      LYS  18  31.133  25.969  28.692
  121    HG2  LYS  18           HG2      LYS  18  33.276  26.358  27.751
  122    HG3  LYS  18           HG3      LYS  18  33.305  24.758  28.434
  123    HD2  LYS  18           HD2      LYS  18  34.456  24.520  26.426
  124    HD3  LYS  18           HD3      LYS  18  32.850  23.885  26.031
  125    HE2  LYS  18           HE2      LYS  18  32.206  26.009  24.972
  126    HE3  LYS  18           HE3      LYS  18  33.650  26.796  25.594
  127    HZ1  LYS  18           HZ1      LYS  18  33.994  26.305  23.312
  128    HZ2  LYS  18           HZ2      LYS  18  34.988  25.319  24.155
  129    HZ3  LYS  18           HZ3      LYS  18  33.591  24.767  23.428
  130    H    ARG  19           H        ARG  19  30.853  24.175  30.505
  131    HA   ARG  19           HA       ARG  19  33.195  22.724  30.992
  132    HB2  ARG  19           HB2      ARG  19  30.989  23.767  32.613
  133    HB3  ARG  19           HB3      ARG  19  31.508  22.211  33.233
  134    HG2  ARG  19           HG2      ARG  19  33.815  22.933  33.400
  135    HG3  ARG  19           HG3      ARG  19  33.433  24.498  32.673
  136    HD2  ARG  19           HD2      ARG  19  32.174  23.538  35.281
  137    HD3  ARG  19           HD3      ARG  19  33.706  24.421  35.205
  138    HE   ARG  19           HE       ARG  19  31.537  25.754  33.760
  139   HH11  ARG  19          HH11      ARG  19  32.969  25.573  36.997
  140   HH12  ARG  19          HH12      ARG  19  32.745  27.313  37.210
  141   HH21  ARG  19          HH21      ARG  19  30.973  27.729  34.337
  142   HH22  ARG  19          HH22      ARG  19  31.470  28.408  35.885
  143    H    HIS  20           H        HIS  20  29.936  21.352  30.787
  144    HA   HIS  20           HA       HIS  20  30.627  18.676  31.591
  145    HB2  HIS  20           HB2      HIS  20  28.340  19.414  31.688
  146    HB3  HIS  20           HB3      HIS  20  28.331  19.861  29.983
  147    HD2  HIS  20           HD2      HIS  20  27.338  18.131  28.370
  148    HE1  HIS  20           HE1      HIS  20  27.671  14.622  30.756
  149    HE2  HIS  20           HE2      HIS  20  26.759  15.568  28.582
  150    H    CYS  21           H        CYS  21  30.443  20.195  28.345
  151    HA   CYS  21           HA       CYS  21  31.299  17.698  27.063
  152    HB2  CYS  21           HB2      CYS  21  30.692  20.482  26.051
  153    HB3  CYS  21           HB3      CYS  21  31.157  19.149  25.001
  154    H    LYS  22           H        LYS  22  32.942  20.652  28.127
  155    HA   LYS  22           HA       LYS  22  35.383  20.299  26.705
  156    HB2  LYS  22           HB2      LYS  22  34.454  22.234  28.254
  157    HB3  LYS  22           HB3      LYS  22  35.267  21.381  29.537
  158    HG2  LYS  22           HG2      LYS  22  36.419  22.759  27.083
  159    HG3  LYS  22           HG3      LYS  22  36.581  23.212  28.766
  160    HD2  LYS  22           HD2      LYS  22  38.665  22.383  28.410
  161    HD3  LYS  22           HD3      LYS  22  37.885  20.906  28.987
  162    HE2  LYS  22           HE2      LYS  22  37.480  20.259  26.585
  163    HE3  LYS  22           HE3      LYS  22  38.264  21.756  26.070
  164    HZ1  LYS  22           HZ1      LYS  22  40.327  20.978  27.013
  165    HZ2  LYS  22           HZ2      LYS  22  39.627  19.662  27.700
  166    HZ3  LYS  22           HZ3      LYS  22  39.750  19.732  26.082
  167    H    ALA  23           H        ALA  23  34.198  18.810  29.722
  168    HA   ALA  23           HA       ALA  23  36.541  17.240  30.280
  169    HB1  ALA  23           HB1      ALA  23  33.616  16.844  31.001
  170    HB2  ALA  23           HB2      ALA  23  34.989  16.021  31.768
  171    HB3  ALA  23           HB3      ALA  23  34.802  17.777  31.935
  172    H    GLU  24           H        GLU  24  34.198  16.857  27.744
  173    HA   GLU  24           HA       GLU  24  35.093  14.071  27.164
  174    HB2  GLU  24           HB2      GLU  24  32.913  15.658  25.777
  175    HB3  GLU  24           HB3      GLU  24  33.209  13.929  25.697
  176    HG2  GLU  24           HG2      GLU  24  32.151  15.505  28.071
  177    HG3  GLU  24           HG3      GLU  24  31.256  14.398  27.057
  178    H    ASP  25           H        ASP  25  36.334  16.950  26.738
  179    HA   ASP  25           HA       ASP  25  37.501  18.155  25.358
  180    HB2  ASP  25           HB2      ASP  25  38.688  15.808  25.356
  181    HB3  ASP  25           HB3      ASP  25  38.272  15.806  23.648
  182    H    LYS  26           H        LYS  26  34.822  18.174  24.843
  183    HA   LYS  26           HA       LYS  26  34.544  18.740  21.919
  184    HB2  LYS  26           HB2      LYS  26  32.713  17.342  23.908
  185    HB3  LYS  26           HB3      LYS  26  32.115  18.056  22.428
  186    HG2  LYS  26           HG2      LYS  26  34.195  16.514  21.436
  187    HG3  LYS  26           HG3      LYS  26  33.625  15.536  22.814
  188    HD2  LYS  26           HD2      LYS  26  31.303  15.693  21.954
  189    HD3  LYS  26           HD3      LYS  26  31.884  16.742  20.640
  190    HE2  LYS  26           HE2      LYS  26  33.284  14.877  19.806
  191    HE3  LYS  26           HE3      LYS  26  32.598  13.822  21.052
  192    HZ1  LYS  26           HZ1      LYS  26  31.041  15.200  18.916
  193    HZ2  LYS  26           HZ2      LYS  26  31.314  13.566  19.019
  194    HZ3  LYS  26           HZ3      LYS  26  30.379  14.320  20.108
  195    H    GLU  27           H        GLU  27  32.831  20.063  21.277
  196    HA   GLU  27           HA       GLU  27  32.289  22.511  22.760
  197    HB2  GLU  27           HB2      GLU  27  31.261  21.196  20.203
  198    HB3  GLU  27           HB3      GLU  27  30.496  22.634  20.845
  199    HG2  GLU  27           HG2      GLU  27  33.466  22.504  20.166
  200    HG3  GLU  27           HG3      GLU  27  32.210  23.067  19.054
  201    H    GLY  28           H        GLY  28  30.409  23.042  23.760
  202    HA2  GLY  28           HA2      GLY  28  28.325  20.943  24.282
  203    HA3  GLY  28           HA3      GLY  28  28.716  22.224  25.413
  204    H    ILE  29           H        ILE  29  26.150  21.418  23.770
  205    HA   ILE  29           HA       ILE  29  25.437  24.213  23.283
  206    HB   ILE  29           HB       ILE  29  26.134  23.427  21.146
  207   HG12  ILE  29          HG12      ILE  29  24.144  24.991  21.516
  208   HG13  ILE  29          HG13      ILE  29  24.529  24.407  19.908
  209   HG21  ILE  29          HG21      ILE  29  24.883  21.742  19.831
  210   HG22  ILE  29          HG22      ILE  29  25.860  21.087  21.143
  211   HG23  ILE  29          HG23      ILE  29  24.095  21.212  21.338
  212   HD11  ILE  29          HD11      ILE  29  22.090  24.442  20.421
  213   HD12  ILE  29          HD12      ILE  29  22.690  22.855  19.912
  214   HD13  ILE  29          HD13      ILE  29  22.350  23.162  21.622
  215    H    CYS  30           H        CYS  30  23.462  24.763  24.028
  216    HA   CYS  30           HA       CYS  30  22.126  22.855  25.701
  217    HB2  CYS  30           HB2      CYS  30  21.412  25.696  24.943
  218    HB3  CYS  30           HB3      CYS  30  20.533  24.718  26.135
  219    H    HIS  31           H        HIS  31  20.767  21.387  25.183
  220    HA   HIS  31           HA       HIS  31  18.725  21.696  23.005
  221    HB2  HIS  31           HB2      HIS  31  20.087  19.287  24.246
  222    HB3  HIS  31           HB3      HIS  31  18.453  19.157  23.609
  223    HD2  HIS  31           HD2      HIS  31  21.677  20.791  22.060
  224    HE1  HIS  31           HE1      HIS  31  19.739  18.441  19.076
  225    HE2  HIS  31           HE2      HIS  31  21.605  20.106  19.508
  226    H    GLY  32           H        GLY  32  17.135  22.851  24.010
  227    HA2  GLY  32           HA2      GLY  32  15.386  23.343  25.435
  228    HA3  GLY  32           HA3      GLY  32  15.440  21.663  25.954
  229    H    THR  33           H        THR  33  15.810  21.385  28.010
  230    HA   THR  33           HA       THR  33  17.295  23.360  29.660
  231    HB   THR  33           HB       THR  33  16.215  22.401  31.592
  232    HG1  THR  33           HG1      THR  33  14.525  20.823  31.128
  233   HG21  THR  33          HG21      THR  33  13.989  23.123  31.222
  234   HG22  THR  33          HG22      THR  33  14.970  24.091  30.116
  235   HG23  THR  33          HG23      THR  33  14.037  22.717  29.492
  236    H    LYS  34           H        LYS  34  18.403  21.109  27.887
  237    HA   LYS  34           HA       LYS  34  20.222  19.830  29.878
  238    HB2  LYS  34           HB2      LYS  34  19.012  18.545  27.392
  239    HB3  LYS  34           HB3      LYS  34  20.118  17.773  28.513
  240    HG2  LYS  34           HG2      LYS  34  17.283  18.684  29.199
  241    HG3  LYS  34           HG3      LYS  34  17.776  17.042  28.782
  242    HD2  LYS  34           HD2      LYS  34  19.305  16.996  30.732
  243    HD3  LYS  34           HD3      LYS  34  18.750  18.593  31.227
  244    HE2  LYS  34           HE2      LYS  34  16.967  16.137  30.915
  245    HE3  LYS  34           HE3      LYS  34  17.688  16.670  32.439
  246    HZ1  LYS  34           HZ1      LYS  34  16.467  18.772  32.205
  247    HZ2  LYS  34           HZ2      LYS  34  15.732  18.230  30.832
  248    HZ3  LYS  34           HZ3      LYS  34  15.431  17.498  32.261
  249    H    CYS  35           H        CYS  35  22.207  18.942  28.789
  250    HA   CYS  35           HA       CYS  35  23.244  20.825  26.709
  251    HB2  CYS  35           HB2      CYS  35  24.367  20.642  28.921
  252    HB3  CYS  35           HB3      CYS  35  24.735  18.957  28.562
  253    H    LYS  36           H        LYS  36  24.401  19.938  24.899
  254    HA   LYS  36           HA       LYS  36  24.365  17.013  24.406
  255    HB2  LYS  36           HB2      LYS  36  22.292  18.296  23.509
  256    HB3  LYS  36           HB3      LYS  36  23.402  19.106  22.413
  257    HG2  LYS  36           HG2      LYS  36  22.916  16.112  22.526
  258    HG3  LYS  36           HG3      LYS  36  22.074  17.240  21.466
  259    HD2  LYS  36           HD2      LYS  36  24.998  16.557  21.405
  260    HD3  LYS  36           HD3      LYS  36  23.759  16.113  20.225
  261    HE2  LYS  36           HE2      LYS  36  23.451  18.625  19.806
  262    HE3  LYS  36           HE3      LYS  36  24.930  18.867  20.756
  263    HZ1  LYS  36           HZ1      LYS  36  24.657  17.351  18.224
  264    HZ2  LYS  36           HZ2      LYS  36  25.538  18.708  18.451
  265    HZ3  LYS  36           HZ3      LYS  36  26.000  17.262  19.126
  266    H    CYS  37           H        CYS  37  26.444  16.503  23.696
  267    HA   CYS  37           HA       CYS  37  28.241  18.750  23.194
  268    HB2  CYS  37           HB2      CYS  37  28.964  15.820  23.219
  269    HB3  CYS  37           HB3      CYS  37  30.048  17.207  23.257
  270    H    GLY  38           H        GLY  38  29.385  19.233  21.393
  271    HA2  GLY  38           HA2      GLY  38  28.111  18.453  18.804
  272    HA3  GLY  38           HA3      GLY  38  28.979  19.938  19.164
  273    H    VAL  39           H        VAL  39  30.797  20.093  18.161
  274    HA   VAL  39           HA       VAL  39  32.406  17.770  17.296
  275    HB   VAL  39           HB       VAL  39  33.698  19.611  16.062
  276   HG11  VAL  39          HG11      VAL  39  32.074  19.708  14.248
  277   HG12  VAL  39          HG12      VAL  39  32.107  18.090  14.971
  278   HG13  VAL  39          HG13      VAL  39  30.772  19.205  15.347
  279   HG21  VAL  39          HG21      VAL  39  32.645  21.709  15.635
  280   HG22  VAL  39          HG22      VAL  39  31.271  21.325  16.681
  281   HG23  VAL  39          HG23      VAL  39  32.901  21.544  17.374
  282    HA   PRO  40           HA       PRO  40  35.550  18.134  20.309
  283    HB2  PRO  40           HB2      PRO  40  37.898  17.778  18.938
  284    HB3  PRO  40           HB3      PRO  40  36.709  16.469  19.255
  285    HG2  PRO  40           HG2      PRO  40  36.948  18.233  16.802
  286    HG3  PRO  40           HG3      PRO  40  36.882  16.437  16.846
  287    HD2  PRO  40           HD2      PRO  40  34.665  17.834  16.344
  288    HD3  PRO  40           HD3      PRO  40  34.537  16.518  17.529
  289    H    ILE  41           H        ILE  41  37.203  19.498  21.221
  290    HA   ILE  41           HA       ILE  41  37.163  22.250  20.321
  291    HB   ILE  41           HB       ILE  41  38.705  22.686  22.163
  292   HG12  ILE  41          HG12      ILE  41  38.989  20.939  23.933
  293   HG13  ILE  41          HG13      ILE  41  38.473  19.728  22.765
  294   HG21  ILE  41          HG21      ILE  41  36.253  21.062  22.953
  295   HG22  ILE  41          HG22      ILE  41  37.037  22.342  23.902
  296   HG23  ILE  41          HG23      ILE  41  36.230  22.746  22.384
  297   HD11  ILE  41          HD11      ILE  41  40.893  21.518  22.380
  298   HD12  ILE  41          HD12      ILE  41  40.964  19.915  23.124
  299   HD13  ILE  41          HD13      ILE  41  40.469  20.063  21.437
  300    H    SER  42           H        SER  42  38.832  19.814  19.098
  301    HA   SER  42           HA       SER  42  41.374  20.859  18.379
  302    HB2  SER  42           HB2      SER  42  39.645  18.706  17.116
  303    HB3  SER  42           HB3      SER  42  41.368  18.977  16.762
  304    HG   SER  42           HG       SER  42  40.605  17.381  18.555
  305    H    TYR  43           H        TYR  43  40.037  23.011  17.863
  306    HA   TYR  43           HA       TYR  43  38.625  23.343  15.480
  307    HB2  TYR  43           HB2      TYR  43  40.366  25.447  16.800
  308    HB3  TYR  43           HB3      TYR  43  38.955  25.728  15.797
  309    HD1  TYR  43           HD1      TYR  43  36.781  24.187  16.817
  310    HD2  TYR  43           HD2      TYR  43  39.993  26.031  19.023
  311    HE1  TYR  43           HE1      TYR  43  35.311  24.345  18.816
  312    HE2  TYR  43           HE2      TYR  43  38.524  26.169  21.033
  313    HH   TYR  43           HH       TYR  43  35.118  25.061  21.048
  314    H    LEU  44           H        LEU  44  42.069  23.004  15.715
  315    HA   LEU  44           HA       LEU  44  42.338  23.205  12.806
  316    HB2  LEU  44           HB2      LEU  44  44.210  24.635  12.770
  317    HB3  LEU  44           HB3      LEU  44  42.959  25.490  13.645
  318    HG   LEU  44           HG       LEU  44  45.244  24.015  15.016
  319   HD11  LEU  44          HD11      LEU  44  46.386  26.167  15.182
  320   HD12  LEU  44          HD12      LEU  44  46.143  25.731  13.487
  321   HD13  LEU  44          HD13      LEU  44  45.097  26.952  14.255
  322   HD21  LEU  44          HD21      LEU  44  43.394  26.254  15.957
  323   HD22  LEU  44          HD22      LEU  44  43.383  24.575  16.531
  324   HD23  LEU  44          HD23      LEU  44  44.772  25.603  16.874
  Start of MODEL    9
    1    H1   ALA   1           H1       ALA   1  28.337  23.879  35.662
    2    H2   ALA   1           H2       ALA   1  28.401  23.757  34.032
    3    H3   ALA   1           H3       ALA   1  29.271  22.719  34.972
    4    HA   ALA   1           HA       ALA   1  26.344  22.837  34.766
    5    HB1  ALA   1           HB1      ALA   1  28.317  20.656  33.959
    6    HB2  ALA   1           HB2      ALA   1  26.562  20.529  33.879
    7    HB3  ALA   1           HB3      ALA   1  27.402  21.705  32.850
    8    H    LYS   2           H        LYS   2  25.115  21.700  36.373
    9    HA   LYS   2           HA       LYS   2  26.586  19.946  38.274
   10    HB2  LYS   2           HB2      LYS   2  26.636  22.274  39.162
   11    HB3  LYS   2           HB3      LYS   2  24.861  22.313  39.089
   12    HG2  LYS   2           HG2      LYS   2  24.757  20.458  40.734
   13    HG3  LYS   2           HG3      LYS   2  26.513  20.333  40.729
   14    HD2  LYS   2           HD2      LYS   2  25.690  21.522  42.707
   15    HD3  LYS   2           HD3      LYS   2  26.710  22.576  41.697
   16    HE2  LYS   2           HE2      LYS   2  24.735  23.661  40.745
   17    HE3  LYS   2           HE3      LYS   2  23.658  22.545  41.590
   18    HZ1  LYS   2           HZ1      LYS   2  23.942  24.718  42.753
   19    HZ2  LYS   2           HZ2      LYS   2  24.418  23.426  43.686
   20    HZ3  LYS   2           HZ3      LYS   2  25.540  24.355  42.982
   21    H    ASN   3           H        ASN   3  23.401  21.067  37.120
   22    HA   ASN   3           HA       ASN   3  22.320  18.364  37.597
   23    HB2  ASN   3           HB2      ASN   3  20.258  19.323  38.649
   24    HB3  ASN   3           HB3      ASN   3  21.703  19.350  39.643
   25   HD21  ASN   3          HD21      ASN   3  21.112  22.722  40.406
   26   HD22  ASN   3          HD22      ASN   3  21.834  21.193  40.862
   27    H    GLN   4           H        GLN   4  21.563  21.566  36.249
   28    HA   GLN   4           HA       GLN   4  20.185  20.224  33.954
   29    HB2  GLN   4           HB2      GLN   4  18.775  22.095  33.660
   30    HB3  GLN   4           HB3      GLN   4  18.662  21.582  35.340
   31    HG2  GLN   4           HG2      GLN   4  20.001  23.474  36.067
   32    HG3  GLN   4           HG3      GLN   4  20.383  23.926  34.408
   33   HE21  GLN   4          HE21      GLN   4  18.457  24.640  32.965
   34   HE22  GLN   4          HE22      GLN   4  17.256  25.567  33.864
   35    H    PHE   5           H        PHE   5  23.108  20.949  34.376
   36    HA   PHE   5           HA       PHE   5  24.852  21.868  33.304
   37    HB2  PHE   5           HB2      PHE   5  23.195  21.524  30.799
   38    HB3  PHE   5           HB3      PHE   5  24.949  21.550  30.944
   39    HD1  PHE   5           HD1      PHE   5  26.200  19.586  31.626
   40    HD2  PHE   5           HD2      PHE   5  21.888  19.539  31.645
   41    HE1  PHE   5           HE1      PHE   5  26.217  17.138  32.041
   42    HE2  PHE   5           HE2      PHE   5  21.928  17.085  32.041
   43    HZ   PHE   5           HZ       PHE   5  24.087  15.888  32.242
   44    H    GLY   6           H        GLY   6  22.596  23.903  34.009
   45    HA2  GLY   6           HA2      GLY   6  22.469  26.214  33.929
   46    HA3  GLY   6           HA3      GLY   6  23.916  26.238  32.908
   47    H    CYS   7           H        CYS   7  21.666  24.155  31.489
   48    HA   CYS   7           HA       CYS   7  21.016  26.145  29.415
   49    HB2  CYS   7           HB2      CYS   7  20.674  23.138  29.579
   50    HB3  CYS   7           HB3      CYS   7  20.211  24.103  28.210
   51    H    PHE   8           H        PHE   8  19.049  26.992  29.094
   52    HA   PHE   8           HA       PHE   8  16.662  25.392  29.680
   53    HB2  PHE   8           HB2      PHE   8  17.003  26.663  31.787
   54    HB3  PHE   8           HB3      PHE   8  16.933  28.168  30.882
   55    HD1  PHE   8           HD1      PHE   8  14.845  28.986  29.923
   56    HD2  PHE   8           HD2      PHE   8  14.998  25.257  32.084
   57    HE1  PHE   8           HE1      PHE   8  12.356  28.891  29.954
   58    HE2  PHE   8           HE2      PHE   8  12.517  25.139  32.072
   59    HZ   PHE   8           HZ       PHE   8  11.194  26.939  30.990
   60    H    ALA   9           H        ALA   9  15.082  25.651  28.180
   61    HA   ALA   9           HA       ALA   9  14.226  26.145  26.162
   62    HB1  ALA   9           HB1      ALA   9  13.105  27.756  27.555
   63    HB2  ALA   9           HB2      ALA   9  14.396  28.946  27.293
   64    HB3  ALA   9           HB3      ALA   9  13.366  28.437  25.940
   65    H    ASN  10           H        ASN  10  16.576  25.400  25.631
   66    HA   ASN  10           HA       ASN  10  18.282  25.309  24.201
   67    HB2  ASN  10           HB2      ASN  10  16.680  27.353  22.610
   68    HB3  ASN  10           HB3      ASN  10  18.023  26.430  21.976
   69   HD21  ASN  10          HD21      ASN  10  15.017  24.944  20.897
   70   HD22  ASN  10          HD22      ASN  10  15.910  26.432  20.645
   71    H    VAL  11           H        VAL  11  18.242  27.808  26.250
   72    HA   VAL  11           HA       VAL  11  20.765  28.999  25.147
   73    HB   VAL  11           HB       VAL  11  18.655  30.408  26.815
   74   HG11  VAL  11          HG11      VAL  11  19.919  32.467  26.094
   75   HG12  VAL  11          HG12      VAL  11  20.906  31.419  27.100
   76   HG13  VAL  11          HG13      VAL  11  21.143  31.428  25.336
   77   HG21  VAL  11          HG21      VAL  11  19.263  30.645  23.825
   78   HG22  VAL  11          HG22      VAL  11  17.763  30.027  24.540
   79   HG23  VAL  11          HG23      VAL  11  18.183  31.722  24.742
   80    H    ASP  12           H        ASP  12  22.410  29.485  26.563
   81    HA   ASP  12           HA       ASP  12  22.564  28.047  29.090
   82    HB2  ASP  12           HB2      ASP  12  24.907  28.750  29.046
   83    HB3  ASP  12           HB3      ASP  12  24.416  27.926  27.587
   84    H    VAL  13           H        VAL  13  20.539  29.892  29.215
   85    HA   VAL  13           HA       VAL  13  21.170  32.442  30.361
   86    HB   VAL  13           HB       VAL  13  18.766  32.142  31.399
   87   HG11  VAL  13          HG11      VAL  13  19.193  32.243  28.416
   88   HG12  VAL  13          HG12      VAL  13  17.745  32.785  29.291
   89   HG13  VAL  13          HG13      VAL  13  19.295  33.608  29.546
   90   HG21  VAL  13          HG21      VAL  13  18.558  30.009  29.243
   91   HG22  VAL  13          HG22      VAL  13  18.706  29.629  30.970
   92   HG23  VAL  13          HG23      VAL  13  17.322  30.562  30.379
   93    H    LYS  14           H        LYS  14  21.010  29.295  31.805
   94    HA   LYS  14           HA       LYS  14  21.088  30.434  34.573
   95    HB2  LYS  14           HB2      LYS  14  20.407  27.635  33.568
   96    HB3  LYS  14           HB3      LYS  14  20.482  28.084  35.263
   97    HG2  LYS  14           HG2      LYS  14  18.634  29.435  33.255
   98    HG3  LYS  14           HG3      LYS  14  18.183  28.040  34.208
   99    HD2  LYS  14           HD2      LYS  14  19.217  30.584  35.516
  100    HD3  LYS  14           HD3      LYS  14  17.534  30.415  35.064
  101    HE2  LYS  14           HE2      LYS  14  18.962  28.418  36.870
  102    HE3  LYS  14           HE3      LYS  14  18.116  29.848  37.473
  103    HZ1  LYS  14           HZ1      LYS  14  16.850  27.658  35.893
  104    HZ2  LYS  14           HZ2      LYS  14  16.635  27.990  37.518
  105    HZ3  LYS  14           HZ3      LYS  14  16.110  29.028  36.368
  106    H    GLY  15           H        GLY  15  23.290  28.945  32.348
  107    HA2  GLY  15           HA2      GLY  15  25.491  29.591  33.987
  108    HA3  GLY  15           HA3      GLY  15  25.063  27.947  34.438
  109    H    ASP  16           H        ASP  16  26.797  26.872  33.700
  110    HA   ASP  16           HA       ASP  16  27.634  27.239  30.873
  111    HB2  ASP  16           HB2      ASP  16  29.872  26.439  31.728
  112    HB3  ASP  16           HB3      ASP  16  29.344  28.069  32.170
  113    H    CYS  17           H        CYS  17  27.471  25.764  29.539
  114    HA   CYS  17           HA       CYS  17  27.161  22.888  30.247
  115    HB2  CYS  17           HB2      CYS  17  25.275  23.447  29.106
  116    HB3  CYS  17           HB3      CYS  17  26.012  24.771  28.266
  117    H    LYS  18           H        LYS  18  29.128  25.186  28.387
  118    HA   LYS  18           HA       LYS  18  30.711  23.411  26.876
  119    HB2  LYS  18           HB2      LYS  18  30.740  25.849  26.699
  120    HB3  LYS  18           HB3      LYS  18  31.538  26.002  28.260
  121    HG2  LYS  18           HG2      LYS  18  32.781  24.276  26.110
  122    HG3  LYS  18           HG3      LYS  18  32.857  26.015  25.926
  123    HD2  LYS  18           HD2      LYS  18  33.890  24.575  28.409
  124    HD3  LYS  18           HD3      LYS  18  34.878  24.875  27.008
  125    HE2  LYS  18           HE2      LYS  18  33.544  26.988  28.771
  126    HE3  LYS  18           HE3      LYS  18  35.259  26.563  28.754
  127    HZ1  LYS  18           HZ1      LYS  18  34.934  28.524  27.461
  128    HZ2  LYS  18           HZ2      LYS  18  35.281  27.302  26.383
  129    HZ3  LYS  18           HZ3      LYS  18  33.741  27.859  26.572
  130    H    ARG  19           H        ARG  19  31.127  24.211  30.361
  131    HA   ARG  19           HA       ARG  19  33.554  22.732  30.700
  132    HB2  ARG  19           HB2      ARG  19  31.378  23.667  32.601
  133    HB3  ARG  19           HB3      ARG  19  32.797  22.756  33.162
  134    HG2  ARG  19           HG2      ARG  19  34.324  24.421  32.236
  135    HG3  ARG  19           HG3      ARG  19  32.994  25.310  31.512
  136    HD2  ARG  19           HD2      ARG  19  33.770  26.413  33.533
  137    HD3  ARG  19           HD3      ARG  19  32.102  25.882  33.709
  138    HE   ARG  19           HE       ARG  19  34.474  24.402  34.818
  139   HH11  ARG  19          HH11      ARG  19  31.120  24.720  36.927
  140   HH12  ARG  19          HH12      ARG  19  31.035  25.217  35.239
  141   HH21  ARG  19          HH21      ARG  19  34.374  23.910  37.015
  142   HH22  ARG  19          HH22      ARG  19  32.807  23.974  37.811
  143    H    HIS  20           H        HIS  20  30.262  21.505  30.564
  144    HA   HIS  20           HA       HIS  20  30.979  18.840  31.590
  145    HB2  HIS  20           HB2      HIS  20  28.690  19.469  31.771
  146    HB3  HIS  20           HB3      HIS  20  28.595  19.974  30.090
  147    HD2  HIS  20           HD2      HIS  20  27.601  18.316  28.438
  148    HE1  HIS  20           HE1      HIS  20  27.940  14.723  30.699
  149    HE2  HIS  20           HE2      HIS  20  27.012  15.772  28.554
  150    H    CYS  21           H        CYS  21  30.526  20.289  28.314
  151    HA   CYS  21           HA       CYS  21  31.319  17.856  26.996
  152    HB2  CYS  21           HB2      CYS  21  31.002  20.738  26.091
  153    HB3  CYS  21           HB3      CYS  21  31.352  19.424  24.980
  154    H    LYS  22           H        LYS  22  33.254  20.678  28.050
  155    HA   LYS  22           HA       LYS  22  35.646  19.975  26.717
  156    HB2  LYS  22           HB2      LYS  22  35.143  22.154  27.881
  157    HB3  LYS  22           HB3      LYS  22  35.277  21.299  29.424
  158    HG2  LYS  22           HG2      LYS  22  37.289  22.361  29.263
  159    HG3  LYS  22           HG3      LYS  22  37.731  20.767  28.740
  160    HD2  LYS  22           HD2      LYS  22  37.081  23.059  26.834
  161    HD3  LYS  22           HD3      LYS  22  38.690  22.771  27.450
  162    HE2  LYS  22           HE2      LYS  22  37.111  20.759  25.803
  163    HE3  LYS  22           HE3      LYS  22  38.267  21.912  25.145
  164    HZ1  LYS  22           HZ1      LYS  22  39.152  20.049  27.247
  165    HZ2  LYS  22           HZ2      LYS  22  39.187  19.596  25.664
  166    HZ3  LYS  22           HZ3      LYS  22  40.069  20.844  26.165
  167    H    ALA  23           H        ALA  23  34.251  18.658  29.665
  168    HA   ALA  23           HA       ALA  23  36.539  16.987  30.371
  169    HB1  ALA  23           HB1      ALA  23  34.934  16.019  31.964
  170    HB2  ALA  23           HB2      ALA  23  34.909  17.787  32.021
  171    HB3  ALA  23           HB3      ALA  23  33.608  16.906  31.193
  172    H    GLU  24           H        GLU  24  34.125  16.714  27.892
  173    HA   GLU  24           HA       GLU  24  34.788  13.850  27.398
  174    HB2  GLU  24           HB2      GLU  24  32.684  15.591  26.130
  175    HB3  GLU  24           HB3      GLU  24  32.909  13.896  25.820
  176    HG2  GLU  24           HG2      GLU  24  32.201  14.931  28.608
  177    HG3  GLU  24           HG3      GLU  24  30.988  14.661  27.357
  178    H    ASP  25           H        ASP  25  36.164  16.657  26.860
  179    HA   ASP  25           HA       ASP  25  37.328  17.809  25.449
  180    HB2  ASP  25           HB2      ASP  25  38.555  15.545  25.511
  181    HB3  ASP  25           HB3      ASP  25  38.074  15.376  23.832
  182    H    LYS  26           H        LYS  26  34.723  18.033  24.875
  183    HA   LYS  26           HA       LYS  26  34.623  18.551  21.916
  184    HB2  LYS  26           HB2      LYS  26  32.402  17.547  23.742
  185    HB3  LYS  26           HB3      LYS  26  32.213  18.048  22.063
  186    HG2  LYS  26           HG2      LYS  26  34.271  16.244  21.813
  187    HG3  LYS  26           HG3      LYS  26  33.348  15.544  23.166
  188    HD2  LYS  26           HD2      LYS  26  31.274  15.800  21.679
  189    HD3  LYS  26           HD3      LYS  26  32.402  16.292  20.381
  190    HE2  LYS  26           HE2      LYS  26  33.647  14.131  20.757
  191    HE3  LYS  26           HE3      LYS  26  32.379  13.654  21.904
  192    HZ1  LYS  26           HZ1      LYS  26  30.810  14.102  19.902
  193    HZ2  LYS  26           HZ2      LYS  26  32.165  13.959  18.973
  194    HZ3  LYS  26           HZ3      LYS  26  31.683  12.704  19.883
  195    H    GLU  27           H        GLU  27  32.869  20.022  21.328
  196    HA   GLU  27           HA       GLU  27  32.657  22.501  22.922
  197    HB2  GLU  27           HB2      GLU  27  31.548  21.541  20.250
  198    HB3  GLU  27           HB3      GLU  27  31.182  23.128  20.923
  199    HG2  GLU  27           HG2      GLU  27  34.078  22.281  20.501
  200    HG3  GLU  27           HG3      GLU  27  33.092  22.857  19.162
  201    H    GLY  28           H        GLY  28  30.569  23.295  23.563
  202    HA2  GLY  28           HA2      GLY  28  28.395  21.254  23.957
  203    HA3  GLY  28           HA3      GLY  28  28.881  22.321  25.247
  204    H    ILE  29           H        ILE  29  26.218  21.897  23.833
  205    HA   ILE  29           HA       ILE  29  25.549  24.722  23.408
  206    HB   ILE  29           HB       ILE  29  26.264  23.994  21.238
  207   HG12  ILE  29          HG12      ILE  29  24.239  25.508  21.621
  208   HG13  ILE  29          HG13      ILE  29  24.658  24.974  20.012
  209   HG21  ILE  29          HG21      ILE  29  26.037  21.670  21.127
  210   HG22  ILE  29          HG22      ILE  29  24.275  21.722  21.369
  211   HG23  ILE  29          HG23      ILE  29  25.018  22.333  19.869
  212   HD11  ILE  29          HD11      ILE  29  22.477  23.623  21.620
  213   HD12  ILE  29          HD12      ILE  29  22.203  24.943  20.492
  214   HD13  ILE  29          HD13      ILE  29  22.848  23.412  19.911
  215    H    CYS  30           H        CYS  30  23.314  25.162  23.825
  216    HA   CYS  30           HA       CYS  30  22.197  23.116  25.623
  217    HB2  CYS  30           HB2      CYS  30  21.505  26.020  25.180
  218    HB3  CYS  30           HB3      CYS  30  20.635  24.948  26.269
  219    H    HIS  31           H        HIS  31  20.702  21.776  25.130
  220    HA   HIS  31           HA       HIS  31  18.588  22.420  23.094
  221    HB2  HIS  31           HB2      HIS  31  19.997  19.813  23.712
  222    HB3  HIS  31           HB3      HIS  31  18.345  19.839  23.094
  223    HD2  HIS  31           HD2      HIS  31  21.818  21.252  22.010
  224    HE1  HIS  31           HE1      HIS  31  19.426  20.689  18.518
  225    HE2  HIS  31           HE2      HIS  31  21.742  21.332  19.377
  226    H    GLY  32           H        GLY  32  16.982  23.196  24.226
  227    HA2  GLY  32           HA2      GLY  32  15.315  23.429  25.810
  228    HA3  GLY  32           HA3      GLY  32  15.445  21.688  26.086
  229    H    THR  33           H        THR  33  15.810  21.235  28.122
  230    HA   THR  33           HA       THR  33  17.140  23.081  29.992
  231    HB   THR  33           HB       THR  33  16.300  21.592  31.734
  232    HG1  THR  33           HG1      THR  33  15.132  19.786  31.178
  233   HG21  THR  33          HG21      THR  33  14.046  22.038  29.750
  234   HG22  THR  33          HG22      THR  33  13.959  21.988  31.519
  235   HG23  THR  33          HG23      THR  33  14.761  23.344  30.705
  236    H    LYS  34           H        LYS  34  18.461  21.006  27.934
  237    HA   LYS  34           HA       LYS  34  20.519  19.948  29.827
  238    HB2  LYS  34           HB2      LYS  34  19.294  18.562  27.406
  239    HB3  LYS  34           HB3      LYS  34  20.573  17.900  28.411
  240    HG2  LYS  34           HG2      LYS  34  17.722  18.471  29.326
  241    HG3  LYS  34           HG3      LYS  34  18.405  16.907  28.876
  242    HD2  LYS  34           HD2      LYS  34  20.077  17.147  30.728
  243    HD3  LYS  34           HD3      LYS  34  19.225  18.586  31.285
  244    HE2  LYS  34           HE2      LYS  34  18.099  15.768  31.058
  245    HE3  LYS  34           HE3      LYS  34  18.602  16.566  32.555
  246    HZ1  LYS  34           HZ1      LYS  34  16.330  17.322  30.814
  247    HZ2  LYS  34           HZ2      LYS  34  16.230  16.682  32.309
  248    HZ3  LYS  34           HZ3      LYS  34  16.814  18.209  32.143
  249    H    CYS  35           H        CYS  35  22.530  19.333  28.864
  250    HA   CYS  35           HA       CYS  35  23.451  21.150  26.697
  251    HB2  CYS  35           HB2      CYS  35  24.570  21.111  28.891
  252    HB3  CYS  35           HB3      CYS  35  24.965  19.399  28.649
  253    H    LYS  36           H        LYS  36  24.247  20.387  24.775
  254    HA   LYS  36           HA       LYS  36  24.302  17.452  24.185
  255    HB2  LYS  36           HB2      LYS  36  22.268  18.921  23.358
  256    HB3  LYS  36           HB3      LYS  36  23.422  19.633  22.257
  257    HG2  LYS  36           HG2      LYS  36  22.647  16.706  22.373
  258    HG3  LYS  36           HG3      LYS  36  21.997  17.900  21.253
  259    HD2  LYS  36           HD2      LYS  36  24.883  16.977  21.369
  260    HD3  LYS  36           HD3      LYS  36  23.663  16.476  20.202
  261    HE2  LYS  36           HE2      LYS  36  23.450  18.933  19.524
  262    HE3  LYS  36           HE3      LYS  36  24.895  19.236  20.515
  263    HZ1  LYS  36           HZ1      LYS  36  25.565  18.852  18.271
  264    HZ2  LYS  36           HZ2      LYS  36  26.016  17.500  19.115
  265    HZ3  LYS  36           HZ3      LYS  36  24.676  17.499  18.124
  266    H    CYS  37           H        CYS  37  26.428  17.005  23.667
  267    HA   CYS  37           HA       CYS  37  28.205  19.234  23.161
  268    HB2  CYS  37           HB2      CYS  37  28.897  16.315  23.090
  269    HB3  CYS  37           HB3      CYS  37  30.014  17.667  23.128
  270    H    GLY  38           H        GLY  38  29.363  19.811  21.448
  271    HA2  GLY  38           HA2      GLY  38  28.336  19.167  18.733
  272    HA3  GLY  38           HA3      GLY  38  29.347  20.540  19.201
  273    H    VAL  39           H        VAL  39  31.187  20.293  17.942
  274    HA   VAL  39           HA       VAL  39  32.292  17.665  17.456
  275    HB   VAL  39           HB       VAL  39  33.876  18.823  15.975
  276   HG11  VAL  39          HG11      VAL  39  32.292  19.512  14.307
  277   HG12  VAL  39          HG12      VAL  39  31.629  18.132  15.202
  278   HG13  VAL  39          HG13      VAL  39  31.027  19.773  15.524
  279   HG21  VAL  39          HG21      VAL  39  34.198  20.941  17.160
  280   HG22  VAL  39          HG22      VAL  39  33.675  21.194  15.487
  281   HG23  VAL  39          HG23      VAL  39  32.522  21.407  16.813
  282    HA   PRO  40           HA       PRO  40  35.791  17.611  20.270
  283    HB2  PRO  40           HB2      PRO  40  37.416  17.097  17.770
  284    HB3  PRO  40           HB3      PRO  40  37.463  16.232  19.340
  285    HG2  PRO  40           HG2      PRO  40  36.160  15.173  17.195
  286    HG3  PRO  40           HG3      PRO  40  35.458  15.057  18.842
  287    HD2  PRO  40           HD2      PRO  40  34.685  16.970  16.614
  288    HD3  PRO  40           HD3      PRO  40  33.673  16.106  17.793
  289    H    ILE  41           H        ILE  41  37.415  19.065  20.946
  290    HA   ILE  41           HA       ILE  41  37.036  21.663  19.887
  291    HB   ILE  41           HB       ILE  41  38.526  22.441  21.631
  292   HG12  ILE  41          HG12      ILE  41  39.278  20.886  23.413
  293   HG13  ILE  41          HG13      ILE  41  38.886  19.520  22.351
  294   HG21  ILE  41          HG21      ILE  41  36.493  20.395  22.598
  295   HG22  ILE  41          HG22      ILE  41  37.008  21.872  23.438
  296   HG23  ILE  41          HG23      ILE  41  36.083  21.997  21.941
  297   HD11  ILE  41          HD11      ILE  41  40.667  20.108  20.834
  298   HD12  ILE  41          HD12      ILE  41  40.867  21.707  21.581
  299   HD13  ILE  41          HD13      ILE  41  41.337  20.238  22.457
  300    H    SER  42           H        SER  42  39.381  19.522  18.731
  301    HA   SER  42           HA       SER  42  40.908  21.699  17.557
  302    HB2  SER  42           HB2      SER  42  42.438  20.029  16.772
  303    HB3  SER  42           HB3      SER  42  42.145  19.811  18.508
  304    HG   SER  42           HG       SER  42  42.046  17.957  16.805
  305    H    TYR  43           H        TYR  43  38.187  20.932  16.978
  306    HA   TYR  43           HA       TYR  43  36.628  20.942  15.315
  307    HB2  TYR  43           HB2      TYR  43  38.608  22.951  14.238
  308    HB3  TYR  43           HB3      TYR  43  36.927  22.826  13.762
  309    HD1  TYR  43           HD1      TYR  43  39.220  24.162  16.252
  310    HD2  TYR  43           HD2      TYR  43  35.093  23.018  15.540
  311    HE1  TYR  43           HE1      TYR  43  38.516  25.400  18.315
  312    HE2  TYR  43           HE2      TYR  43  34.401  24.246  17.607
  313    HH   TYR  43           HH       TYR  43  35.081  25.534  19.373
  314    H    LEU  44           H        LEU  44  37.232  18.686  14.909
  315    HA   LEU  44           HA       LEU  44  38.519  17.871  12.456
  316    HB2  LEU  44           HB2      LEU  44  36.864  16.564  14.627
  317    HB3  LEU  44           HB3      LEU  44  37.070  15.721  13.100
  318    HG   LEU  44           HG       LEU  44  39.457  15.650  13.306
  319   HD11  LEU  44          HD11      LEU  44  39.131  17.236  15.881
  320   HD12  LEU  44          HD12      LEU  44  40.618  16.415  15.362
  321   HD13  LEU  44          HD13      LEU  44  39.984  17.761  14.412
  322   HD21  LEU  44          HD21      LEU  44  38.086  13.939  14.487
  323   HD22  LEU  44          HD22      LEU  44  39.648  14.232  15.283
  324   HD23  LEU  44          HD23      LEU  44  38.166  14.921  15.965
  Start of MODEL   10
    1    H1   ALA   1           H1       ALA   1  26.491  24.144  38.005
    2    H2   ALA   1           H2       ALA   1  25.889  23.398  39.351
    3    H3   ALA   1           H3       ALA   1  25.290  24.841  38.872
    4    HA   ALA   1           HA       ALA   1  23.807  23.002  38.335
    5    HB1  ALA   1           HB1      ALA   1  23.398  23.616  35.990
    6    HB2  ALA   1           HB2      ALA   1  23.584  25.023  37.039
    7    HB3  ALA   1           HB3      ALA   1  24.923  24.533  35.965
    8    H    LYS   2           H        LYS   2  23.503  21.009  37.711
    9    HA   LYS   2           HA       LYS   2  25.335  19.572  35.830
   10    HB2  LYS   2           HB2      LYS   2  26.114  19.216  38.173
   11    HB3  LYS   2           HB3      LYS   2  24.502  18.668  38.619
   12    HG2  LYS   2           HG2      LYS   2  24.724  16.717  37.081
   13    HG3  LYS   2           HG3      LYS   2  26.329  17.307  36.598
   14    HD2  LYS   2           HD2      LYS   2  26.699  15.607  38.232
   15    HD3  LYS   2           HD3      LYS   2  27.012  17.143  39.051
   16    HE2  LYS   2           HE2      LYS   2  24.562  17.038  39.863
   17    HE3  LYS   2           HE3      LYS   2  24.514  15.397  39.204
   18    HZ1  LYS   2           HZ1      LYS   2  25.122  15.174  41.474
   19    HZ2  LYS   2           HZ2      LYS   2  26.543  14.993  40.673
   20    HZ3  LYS   2           HZ3      LYS   2  26.165  16.420  41.427
   21    H    ASN   3           H        ASN   3  22.188  19.720  37.500
   22    HA   ASN   3           HA       ASN   3  21.111  17.445  36.048
   23    HB2  ASN   3           HB2      ASN   3  19.795  19.480  37.892
   24    HB3  ASN   3           HB3      ASN   3  19.008  18.041  37.233
   25   HD21  ASN   3          HD21      ASN   3  20.947  15.765  39.261
   26   HD22  ASN   3          HD22      ASN   3  19.897  15.883  37.843
   27    H    GLN   4           H        GLN   4  20.602  21.053  35.684
   28    HA   GLN   4           HA       GLN   4  19.554  20.431  32.959
   29    HB2  GLN   4           HB2      GLN   4  18.609  22.530  32.882
   30    HB3  GLN   4           HB3      GLN   4  18.130  21.716  34.352
   31    HG2  GLN   4           HG2      GLN   4  19.909  23.148  35.567
   32    HG3  GLN   4           HG3      GLN   4  19.982  24.091  34.042
   33   HE21  GLN   4          HE21      GLN   4  16.460  24.683  34.189
   34   HE22  GLN   4          HE22      GLN   4  17.816  24.641  33.080
   35    H    PHE   5           H        PHE   5  22.523  20.765  34.165
   36    HA   PHE   5           HA       PHE   5  24.544  21.631  33.574
   37    HB2  PHE   5           HB2      PHE   5  23.454  21.617  30.752
   38    HB3  PHE   5           HB3      PHE   5  25.131  21.499  31.236
   39    HD1  PHE   5           HD1      PHE   5  21.965  19.722  30.864
   40    HD2  PHE   5           HD2      PHE   5  25.988  19.394  32.348
   41    HE1  PHE   5           HE1      PHE   5  21.722  17.236  30.960
   42    HE2  PHE   5           HE2      PHE   5  25.716  16.936  32.517
   43    HZ   PHE   5           HZ       PHE   5  23.598  15.855  31.792
   44    H    GLY   6           H        GLY   6  22.212  23.615  33.941
   45    HA2  GLY   6           HA2      GLY   6  22.204  25.949  34.233
   46    HA3  GLY   6           HA3      GLY   6  23.651  26.065  33.235
   47    H    CYS   7           H        CYS   7  21.810  24.173  31.337
   48    HA   CYS   7           HA       CYS   7  20.979  26.330  29.602
   49    HB2  CYS   7           HB2      CYS   7  20.492  23.340  29.453
   50    HB3  CYS   7           HB3      CYS   7  20.147  24.482  28.175
   51    H    PHE   8           H        PHE   8  19.004  27.074  29.144
   52    HA   PHE   8           HA       PHE   8  16.595  25.495  29.635
   53    HB2  PHE   8           HB2      PHE   8  16.840  26.689  31.794
   54    HB3  PHE   8           HB3      PHE   8  16.915  28.214  30.940
   55    HD1  PHE   8           HD1      PHE   8  14.926  29.272  30.014
   56    HD2  PHE   8           HD2      PHE   8  14.720  25.459  32.024
   57    HE1  PHE   8           HE1      PHE   8  12.443  29.441  30.096
   58    HE2  PHE   8           HE2      PHE   8  12.242  25.631  32.105
   59    HZ   PHE   8           HZ       PHE   8  11.107  27.609  31.122
   60    H    ALA   9           H        ALA   9  14.996  25.949  28.077
   61    HA   ALA   9           HA       ALA   9  14.280  26.584  26.044
   62    HB1  ALA   9           HB1      ALA   9  13.639  28.932  25.878
   63    HB2  ALA   9           HB2      ALA   9  13.360  28.316  27.520
   64    HB3  ALA   9           HB3      ALA   9  14.766  29.351  27.190
   65    H    ASN  10           H        ASN  10  16.731  25.672  25.682
   66    HA   ASN  10           HA       ASN  10  18.591  25.595  24.449
   67    HB2  ASN  10           HB2      ASN  10  17.140  27.511  22.580
   68    HB3  ASN  10           HB3      ASN  10  18.493  26.472  22.156
   69   HD21  ASN  10          HD21      ASN  10  15.781  24.832  20.832
   70   HD22  ASN  10          HD22      ASN  10  16.514  26.397  20.588
   71    H    VAL  11           H        VAL  11  18.439  28.022  26.459
   72    HA   VAL  11           HA       VAL  11  20.870  29.444  25.429
   73    HB   VAL  11           HB       VAL  11  18.548  30.580  27.032
   74   HG11  VAL  11          HG11      VAL  11  19.664  32.778  26.682
   75   HG12  VAL  11          HG12      VAL  11  20.622  31.718  27.699
   76   HG13  VAL  11          HG13      VAL  11  21.075  31.947  25.992
   77   HG21  VAL  11          HG21      VAL  11  19.488  31.163  24.182
   78   HG22  VAL  11          HG22      VAL  11  17.998  30.307  24.623
   79   HG23  VAL  11          HG23      VAL  11  18.179  32.008  25.038
   80    H    ASP  12           H        ASP  12  22.414  30.126  26.926
   81    HA   ASP  12           HA       ASP  12  22.828  28.386  29.222
   82    HB2  ASP  12           HB2      ASP  12  25.055  29.224  29.184
   83    HB3  ASP  12           HB3      ASP  12  24.579  28.879  27.528
   84    H    VAL  13           H        VAL  13  20.633  29.922  29.811
   85    HA   VAL  13           HA       VAL  13  21.183  32.463  30.998
   86    HB   VAL  13           HB       VAL  13  18.899  31.973  32.220
   87   HG11  VAL  13          HG11      VAL  13  19.257  33.568  30.386
   88   HG12  VAL  13          HG12      VAL  13  19.090  32.247  29.206
   89   HG13  VAL  13          HG13      VAL  13  17.719  32.707  30.225
   90   HG21  VAL  13          HG21      VAL  13  18.870  29.511  31.687
   91   HG22  VAL  13          HG22      VAL  13  17.459  30.426  31.133
   92   HG23  VAL  13          HG23      VAL  13  18.697  29.943  29.963
   93    H    LYS  14           H        LYS  14  20.914  29.273  32.601
   94    HA   LYS  14           HA       LYS  14  21.879  30.520  35.148
   95    HB2  LYS  14           HB2      LYS  14  20.696  27.782  34.541
   96    HB3  LYS  14           HB3      LYS  14  21.378  28.228  36.099
   97    HG2  LYS  14           HG2      LYS  14  18.953  29.502  34.766
   98    HG3  LYS  14           HG3      LYS  14  18.990  28.430  36.167
   99    HD2  LYS  14           HD2      LYS  14  20.578  30.278  37.206
  100    HD3  LYS  14           HD3      LYS  14  19.861  31.328  35.976
  101    HE2  LYS  14           HE2      LYS  14  18.380  29.713  38.084
  102    HE3  LYS  14           HE3      LYS  14  18.732  31.448  38.189
  103    HZ1  LYS  14           HZ1      LYS  14  16.485  30.989  37.444
  104    HZ2  LYS  14           HZ2      LYS  14  17.291  31.807  36.291
  105    HZ3  LYS  14           HZ3      LYS  14  17.014  30.166  36.134
  106    H    GLY  15           H        GLY  15  23.140  28.634  32.534
  107    HA2  GLY  15           HA2      GLY  15  25.815  29.075  33.269
  108    HA3  GLY  15           HA3      GLY  15  25.398  27.486  33.904
  109    H    ASP  16           H        ASP  16  27.379  27.673  32.057
  110    HA   ASP  16           HA       ASP  16  26.238  27.167  29.387
  111    HB2  ASP  16           HB2      ASP  16  28.173  28.761  29.946
  112    HB3  ASP  16           HB3      ASP  16  29.177  27.320  30.094
  113    H    CYS  17           H        CYS  17  26.056  25.296  28.454
  114    HA   CYS  17           HA       CYS  17  26.745  22.718  29.559
  115    HB2  CYS  17           HB2      CYS  17  24.861  22.752  28.281
  116    HB3  CYS  17           HB3      CYS  17  25.491  23.908  27.125
  117    H    LYS  18           H        LYS  18  28.617  24.997  27.740
  118    HA   LYS  18           HA       LYS  18  30.659  23.596  26.498
  119    HB2  LYS  18           HB2      LYS  18  30.684  26.030  26.719
  120    HB3  LYS  18           HB3      LYS  18  30.673  25.926  28.471
  121    HG2  LYS  18           HG2      LYS  18  32.830  26.615  27.979
  122    HG3  LYS  18           HG3      LYS  18  33.011  24.938  28.397
  123    HD2  LYS  18           HD2      LYS  18  34.397  25.199  26.537
  124    HD3  LYS  18           HD3      LYS  18  32.944  24.477  25.823
  125    HE2  LYS  18           HE2      LYS  18  32.133  26.783  25.240
  126    HE3  LYS  18           HE3      LYS  18  33.568  27.467  26.022
  127    HZ1  LYS  18           HZ1      LYS  18  34.896  26.183  24.353
  128    HZ2  LYS  18           HZ2      LYS  18  33.508  25.873  23.530
  129    HZ3  LYS  18           HZ3      LYS  18  33.979  27.418  23.740
  130    H    ARG  19           H        ARG  19  30.366  24.057  30.049
  131    HA   ARG  19           HA       ARG  19  32.942  22.897  30.602
  132    HB2  ARG  19           HB2      ARG  19  30.606  23.551  32.454
  133    HB3  ARG  19           HB3      ARG  19  32.237  23.097  32.984
  134    HG2  ARG  19           HG2      ARG  19  33.125  25.025  31.567
  135    HG3  ARG  19           HG3      ARG  19  31.462  25.572  31.371
  136    HD2  ARG  19           HD2      ARG  19  32.877  25.233  34.052
  137    HD3  ARG  19           HD3      ARG  19  32.791  26.745  33.140
  138    HE   ARG  19           HE       ARG  19  30.150  25.613  33.615
  139   HH11  ARG  19          HH11      ARG  19  32.561  27.742  35.116
  140   HH12  ARG  19          HH12      ARG  19  31.343  28.341  36.232
  141   HH21  ARG  19          HH21      ARG  19  28.803  26.431  34.963
  142   HH22  ARG  19          HH22      ARG  19  29.297  27.547  36.232
  143    H    HIS  20           H        HIS  20  29.798  21.369  30.420
  144    HA   HIS  20           HA       HIS  20  30.717  18.824  31.528
  145    HB2  HIS  20           HB2      HIS  20  28.434  19.536  31.773
  146    HB3  HIS  20           HB3      HIS  20  28.248  19.767  30.033
  147    HD2  HIS  20           HD2      HIS  20  27.279  17.844  28.717
  148    HE1  HIS  20           HE1      HIS  20  27.481  14.774  31.682
  149    HE2  HIS  20           HE2      HIS  20  26.544  15.385  29.390
  150    H    CYS  21           H        CYS  21  30.297  20.115  28.193
  151    HA   CYS  21           HA       CYS  21  31.178  17.596  26.990
  152    HB2  CYS  21           HB2      CYS  21  30.653  20.355  25.906
  153    HB3  CYS  21           HB3      CYS  21  31.209  19.025  24.899
  154    H    LYS  22           H        LYS  22  32.875  20.682  27.825
  155    HA   LYS  22           HA       LYS  22  35.326  20.099  26.568
  156    HB2  LYS  22           HB2      LYS  22  34.535  22.289  27.530
  157    HB3  LYS  22           HB3      LYS  22  34.866  21.670  29.143
  158    HG2  LYS  22           HG2      LYS  22  36.615  23.166  28.357
  159    HG3  LYS  22           HG3      LYS  22  37.281  21.551  28.603
  160    HD2  LYS  22           HD2      LYS  22  37.610  21.189  26.304
  161    HD3  LYS  22           HD3      LYS  22  36.289  22.273  25.857
  162    HE2  LYS  22           HE2      LYS  22  38.262  23.345  25.160
  163    HE3  LYS  22           HE3      LYS  22  37.618  24.229  26.545
  164    HZ1  LYS  22           HZ1      LYS  22  39.903  22.303  26.668
  165    HZ2  LYS  22           HZ2      LYS  22  40.046  23.939  26.680
  166    HZ3  LYS  22           HZ3      LYS  22  39.339  23.200  27.926
  167    H    ALA  23           H        ALA  23  34.068  18.880  29.627
  168    HA   ALA  23           HA       ALA  23  36.416  17.680  30.694
  169    HB1  ALA  23           HB1      ALA  23  34.760  16.297  31.924
  170    HB2  ALA  23           HB2      ALA  23  34.293  18.005  31.915
  171    HB3  ALA  23           HB3      ALA  23  33.481  16.847  30.835
  172    H    GLU  24           H        GLU  24  34.351  16.698  28.000
  173    HA   GLU  24           HA       GLU  24  35.877  14.163  27.622
  174    HB2  GLU  24           HB2      GLU  24  33.239  15.158  26.498
  175    HB3  GLU  24           HB3      GLU  24  33.985  13.624  26.075
  176    HG2  GLU  24           HG2      GLU  24  33.124  14.434  28.906
  177    HG3  GLU  24           HG3      GLU  24  32.190  13.453  27.800
  178    H    ASP  25           H        ASP  25  36.466  17.165  26.942
  179    HA   ASP  25           HA       ASP  25  37.553  18.390  25.500
  180    HB2  ASP  25           HB2      ASP  25  38.936  16.106  25.552
  181    HB3  ASP  25           HB3      ASP  25  38.570  16.143  23.825
  182    H    LYS  26           H        LYS  26  34.815  17.953  24.912
  183    HA   LYS  26           HA       LYS  26  34.690  18.599  21.986
  184    HB2  LYS  26           HB2      LYS  26  32.588  17.380  23.818
  185    HB3  LYS  26           HB3      LYS  26  32.310  17.903  22.169
  186    HG2  LYS  26           HG2      LYS  26  34.549  16.152  22.002
  187    HG3  LYS  26           HG3      LYS  26  33.435  15.398  23.165
  188    HD2  LYS  26           HD2      LYS  26  31.590  15.606  21.505
  189    HD3  LYS  26           HD3      LYS  26  32.699  16.422  20.400
  190    HE2  LYS  26           HE2      LYS  26  32.600  14.214  19.594
  191    HE3  LYS  26           HE3      LYS  26  34.155  14.337  20.438
  192    HZ1  LYS  26           HZ1      LYS  26  32.803  12.284  20.914
  193    HZ2  LYS  26           HZ2      LYS  26  33.222  13.123  22.273
  194    HZ3  LYS  26           HZ3      LYS  26  31.686  13.201  21.630
  195    H    GLU  27           H        GLU  27  32.943  20.068  21.365
  196    HA   GLU  27           HA       GLU  27  32.602  22.371  23.210
  197    HB2  GLU  27           HB2      GLU  27  31.752  21.804  20.351
  198    HB3  GLU  27           HB3      GLU  27  31.190  23.202  21.248
  199    HG2  GLU  27           HG2      GLU  27  34.129  22.608  20.756
  200    HG3  GLU  27           HG3      GLU  27  33.146  23.580  19.670
  201    H    GLY  28           H        GLY  28  30.492  22.966  23.904
  202    HA2  GLY  28           HA2      GLY  28  28.395  20.822  23.979
  203    HA3  GLY  28           HA3      GLY  28  28.612  22.004  25.244
  204    H    ILE  29           H        ILE  29  26.115  21.509  23.875
  205    HA   ILE  29           HA       ILE  29  25.544  24.254  23.214
  206    HB   ILE  29           HB       ILE  29  26.132  23.473  21.063
  207   HG12  ILE  29          HG12      ILE  29  24.100  25.012  21.532
  208   HG13  ILE  29          HG13      ILE  29  24.489  24.486  19.909
  209   HG21  ILE  29          HG21      ILE  29  24.851  21.783  19.784
  210   HG22  ILE  29          HG22      ILE  29  25.870  21.134  21.067
  211   HG23  ILE  29          HG23      ILE  29  24.113  21.250  21.315
  212   HD11  ILE  29          HD11      ILE  29  22.687  22.922  19.840
  213   HD12  ILE  29          HD12      ILE  29  22.387  23.080  21.583
  214   HD13  ILE  29          HD13      ILE  29  22.035  24.431  20.496
  215    H    CYS  30           H        CYS  30  23.575  24.882  23.941
  216    HA   CYS  30           HA       CYS  30  22.135  23.004  25.642
  217    HB2  CYS  30           HB2      CYS  30  21.627  25.910  24.929
  218    HB3  CYS  30           HB3      CYS  30  20.654  24.974  26.068
  219    H    HIS  31           H        HIS  31  20.639  21.646  25.023
  220    HA   HIS  31           HA       HIS  31  18.588  22.417  22.962
  221    HB2  HIS  31           HB2      HIS  31  19.954  19.769  23.481
  222    HB3  HIS  31           HB3      HIS  31  18.288  19.815  22.931
  223    HD2  HIS  31           HD2      HIS  31  21.823  20.655  21.666
  224    HE1  HIS  31           HE1      HIS  31  19.184  20.728  18.317
  225    HE2  HIS  31           HE2      HIS  31  21.620  20.770  19.019
  226    H    GLY  32           H        GLY  32  16.914  23.064  23.975
  227    HA2  GLY  32           HA2      GLY  32  15.147  23.292  25.417
  228    HA3  GLY  32           HA3      GLY  32  15.356  21.602  25.879
  229    H    THR  33           H        THR  33  15.837  21.307  27.927
  230    HA   THR  33           HA       THR  33  17.361  23.346  29.480
  231    HB   THR  33           HB       THR  33  16.309  22.741  31.473
  232    HG1  THR  33           HG1      THR  33  14.846  21.127  31.653
  233   HG21  THR  33          HG21      THR  33  14.031  22.653  29.467
  234   HG22  THR  33          HG22      THR  33  13.981  23.241  31.140
  235   HG23  THR  33          HG23      THR  33  14.884  24.142  29.901
  236    H    LYS  34           H        LYS  34  18.379  21.129  27.726
  237    HA   LYS  34           HA       LYS  34  20.247  19.963  29.717
  238    HB2  LYS  34           HB2      LYS  34  18.810  18.385  27.552
  239    HB3  LYS  34           HB3      LYS  34  20.079  17.737  28.583
  240    HG2  LYS  34           HG2      LYS  34  17.363  18.724  29.556
  241    HG3  LYS  34           HG3      LYS  34  17.799  17.053  29.257
  242    HD2  LYS  34           HD2      LYS  34  19.371  16.985  31.039
  243    HD3  LYS  34           HD3      LYS  34  19.326  18.724  31.305
  244    HE2  LYS  34           HE2      LYS  34  16.936  16.875  31.645
  245    HE3  LYS  34           HE3      LYS  34  18.029  17.321  32.957
  246    HZ1  LYS  34           HZ1      LYS  34  17.070  19.659  31.640
  247    HZ2  LYS  34           HZ2      LYS  34  15.825  18.721  32.160
  248    HZ3  LYS  34           HZ3      LYS  34  16.949  19.229  33.232
  249    H    CYS  35           H        CYS  35  22.094  18.783  28.607
  250    HA   CYS  35           HA       CYS  35  23.276  20.625  26.605
  251    HB2  CYS  35           HB2      CYS  35  24.283  20.306  28.866
  252    HB3  CYS  35           HB3      CYS  35  24.530  18.605  28.475
  253    H    LYS  36           H        LYS  36  24.300  19.877  24.726
  254    HA   LYS  36           HA       LYS  36  24.329  16.996  24.040
  255    HB2  LYS  36           HB2      LYS  36  22.263  18.387  23.172
  256    HB3  LYS  36           HB3      LYS  36  23.427  19.174  22.113
  257    HG2  LYS  36           HG2      LYS  36  22.935  16.183  22.188
  258    HG3  LYS  36           HG3      LYS  36  22.020  17.293  21.190
  259    HD2  LYS  36           HD2      LYS  36  25.004  16.794  20.986
  260    HD3  LYS  36           HD3      LYS  36  23.770  16.138  19.915
  261    HE2  LYS  36           HE2      LYS  36  23.170  18.470  19.213
  262    HE3  LYS  36           HE3      LYS  36  24.479  19.091  20.222
  263    HZ1  LYS  36           HZ1      LYS  36  24.785  17.270  17.903
  264    HZ2  LYS  36           HZ2      LYS  36  25.220  18.849  17.949
  265    HZ3  LYS  36           HZ3      LYS  36  26.034  17.769  18.879
  266    H    CYS  37           H        CYS  37  26.350  16.557  23.108
  267    HA   CYS  37           HA       CYS  37  28.202  18.845  22.974
  268    HB2  CYS  37           HB2      CYS  37  28.866  15.930  22.645
  269    HB3  CYS  37           HB3      CYS  37  29.992  17.282  22.756
  270    H    GLY  38           H        GLY  38  29.358  19.589  21.329
  271    HA2  GLY  38           HA2      GLY  38  28.435  19.115  18.539
  272    HA3  GLY  38           HA3      GLY  38  29.418  20.454  19.136
  273    H    VAL  39           H        VAL  39  31.207  20.236  17.830
  274    HA   VAL  39           HA       VAL  39  32.493  17.727  17.384
  275    HB   VAL  39           HB       VAL  39  34.227  19.086  16.206
  276   HG11  VAL  39          HG11      VAL  39  32.815  19.810  14.379
  277   HG12  VAL  39          HG12      VAL  39  32.224  18.280  15.031
  278   HG13  VAL  39          HG13      VAL  39  31.378  19.797  15.417
  279   HG21  VAL  39          HG21      VAL  39  33.871  21.473  15.849
  280   HG22  VAL  39          HG22      VAL  39  32.518  21.490  16.993
  281   HG23  VAL  39          HG23      VAL  39  34.170  21.129  17.556
  282    HA   PRO  40           HA       PRO  40  35.734  17.606  20.521
  283    HB2  PRO  40           HB2      PRO  40  37.552  17.042  18.211
  284    HB3  PRO  40           HB3      PRO  40  37.351  16.136  19.738
  285    HG2  PRO  40           HG2      PRO  40  36.314  15.234  17.368
  286    HG3  PRO  40           HG3      PRO  40  35.467  15.001  18.924
  287    HD2  PRO  40           HD2      PRO  40  34.863  17.041  16.765
  288    HD3  PRO  40           HD3      PRO  40  33.774  16.126  17.843
  289    H    ILE  41           H        ILE  41  37.134  19.251  21.318
  290    HA   ILE  41           HA       ILE  41  37.082  21.762  19.979
  291    HB   ILE  41           HB       ILE  41  38.424  22.629  21.775
  292   HG12  ILE  41          HG12      ILE  41  38.780  20.821  23.752
  293   HG13  ILE  41          HG13      ILE  41  39.051  19.762  22.377
  294   HG21  ILE  41          HG21      ILE  41  36.348  20.676  22.828
  295   HG22  ILE  41          HG22      ILE  41  36.858  22.205  23.558
  296   HG23  ILE  41          HG23      ILE  41  35.981  22.224  22.030
  297   HD11  ILE  41          HD11      ILE  41  41.164  20.711  23.176
  298   HD12  ILE  41          HD12      ILE  41  40.817  21.387  21.574
  299   HD13  ILE  41          HD13      ILE  41  40.520  22.357  23.031
  300    H    SER  42           H        SER  42  39.328  19.231  19.630
  301    HA   SER  42           HA       SER  42  41.169  18.870  18.488
  302    HB2  SER  42           HB2      SER  42  39.748  20.783  16.657
  303    HB3  SER  42           HB3      SER  42  40.867  19.459  16.225
  304    HG   SER  42           HG       SER  42  38.266  19.247  17.348
  305    H    TYR  43           H        TYR  43  42.022  20.732  20.297
  306    HA   TYR  43           HA       TYR  43  44.240  22.029  18.729
  307    HB2  TYR  43           HB2      TYR  43  43.193  22.715  21.495
  308    HB3  TYR  43           HB3      TYR  43  44.593  23.451  20.729
  309    HD1  TYR  43           HD1      TYR  43  44.046  24.244  18.135
  310    HD2  TYR  43           HD2      TYR  43  41.284  24.087  21.452
  311    HE1  TYR  43           HE1      TYR  43  42.656  25.997  17.067
  312    HE2  TYR  43           HE2      TYR  43  39.917  25.855  20.394
  313    HH   TYR  43           HH       TYR  43  39.788  27.393  18.686
  314    H    LEU  44           H        LEU  44  43.553  19.524  20.983
  315    HA   LEU  44           HA       LEU  44  46.452  18.965  21.348
  316    HB2  LEU  44           HB2      LEU  44  45.458  20.131  23.358
  317    HB3  LEU  44           HB3      LEU  44  44.313  18.806  23.520
  318    HG   LEU  44           HG       LEU  44  46.206  17.228  23.924
  319   HD11  LEU  44          HD11      LEU  44  48.446  18.218  24.449
  320   HD12  LEU  44          HD12      LEU  44  48.035  18.371  22.742
  321   HD13  LEU  44          HD13      LEU  44  47.884  19.778  23.816
  322   HD21  LEU  44          HD21      LEU  44  45.065  18.339  25.806
  323   HD22  LEU  44          HD22      LEU  44  46.782  18.120  26.163
  324   HD23  LEU  44          HD23      LEU  44  46.175  19.721  25.693
  Start of MODEL   11
    1    H1   ALA   1           H1       ALA   1  26.266  21.909  39.426
    2    H2   ALA   1           H2       ALA   1  25.906  23.503  39.271
    3    H3   ALA   1           H3       ALA   1  26.873  22.771  38.147
    4    HA   ALA   1           HA       ALA   1  24.041  22.131  38.648
    5    HB1  ALA   1           HB1      ALA   1  24.156  24.308  37.599
    6    HB2  ALA   1           HB2      ALA   1  25.368  23.739  36.427
    7    HB3  ALA   1           HB3      ALA   1  23.718  23.148  36.339
    8    H    LYS   2           H        LYS   2  23.252  20.359  37.603
    9    HA   LYS   2           HA       LYS   2  24.965  18.892  35.643
   10    HB2  LYS   2           HB2      LYS   2  24.917  16.831  36.920
   11    HB3  LYS   2           HB3      LYS   2  25.776  18.098  37.802
   12    HG2  LYS   2           HG2      LYS   2  23.791  18.434  39.254
   13    HG3  LYS   2           HG3      LYS   2  22.892  17.224  38.338
   14    HD2  LYS   2           HD2      LYS   2  23.623  16.214  40.326
   15    HD3  LYS   2           HD3      LYS   2  24.567  15.496  39.025
   16    HE2  LYS   2           HE2      LYS   2  26.528  16.827  39.638
   17    HE3  LYS   2           HE3      LYS   2  25.559  17.805  40.759
   18    HZ1  LYS   2           HZ1      LYS   2  26.757  16.132  42.016
   19    HZ2  LYS   2           HZ2      LYS   2  25.149  15.729  42.023
   20    HZ3  LYS   2           HZ3      LYS   2  26.183  14.906  41.089
   21    H    ASN   3           H        ASN   3  21.771  19.281  37.150
   22    HA   ASN   3           HA       ASN   3  20.668  17.140  35.510
   23    HB2  ASN   3           HB2      ASN   3  18.540  17.763  36.516
   24    HB3  ASN   3           HB3      ASN   3  19.807  17.344  37.657
   25   HD21  ASN   3          HD21      ASN   3  18.432  19.967  39.511
   26   HD22  ASN   3          HD22      ASN   3  18.489  18.226  39.249
   27    H    GLN   4           H        GLN   4  20.498  20.663  35.346
   28    HA   GLN   4           HA       GLN   4  19.659  20.342  32.496
   29    HB2  GLN   4           HB2      GLN   4  18.482  22.405  32.529
   30    HB3  GLN   4           HB3      GLN   4  17.891  21.412  33.858
   31    HG2  GLN   4           HG2      GLN   4  19.332  22.713  35.434
   32    HG3  GLN   4           HG3      GLN   4  19.855  23.739  34.087
   33   HE21  GLN   4          HE21      GLN   4  18.026  24.930  32.896
   34   HE22  GLN   4          HE22      GLN   4  16.786  25.573  33.974
   35    H    PHE   5           H        PHE   5  22.288  20.923  34.307
   36    HA   PHE   5           HA       PHE   5  24.362  21.730  33.944
   37    HB2  PHE   5           HB2      PHE   5  23.575  22.071  31.057
   38    HB3  PHE   5           HB3      PHE   5  25.193  21.916  31.700
   39    HD1  PHE   5           HD1      PHE   5  26.022  19.693  32.526
   40    HD2  PHE   5           HD2      PHE   5  22.198  20.163  30.608
   41    HE1  PHE   5           HE1      PHE   5  25.906  17.251  32.149
   42    HE2  PHE   5           HE2      PHE   5  22.075  17.697  30.253
   43    HZ   PHE   5           HZ       PHE   5  23.913  16.245  31.026
   44    H    GLY   6           H        GLY   6  21.904  23.716  34.130
   45    HA2  GLY   6           HA2      GLY   6  21.798  26.040  34.467
   46    HA3  GLY   6           HA3      GLY   6  23.379  26.244  33.698
   47    H    CYS   7           H        CYS   7  21.664  24.307  31.602
   48    HA   CYS   7           HA       CYS   7  21.040  26.484  29.744
   49    HB2  CYS   7           HB2      CYS   7  20.768  23.455  29.607
   50    HB3  CYS   7           HB3      CYS   7  20.254  24.520  28.334
   51    H    PHE   8           H        PHE   8  19.048  27.192  29.175
   52    HA   PHE   8           HA       PHE   8  16.683  25.528  29.626
   53    HB2  PHE   8           HB2      PHE   8  16.801  26.749  31.758
   54    HB3  PHE   8           HB3      PHE   8  16.874  28.275  30.905
   55    HD1  PHE   8           HD1      PHE   8  14.908  29.229  29.793
   56    HD2  PHE   8           HD2      PHE   8  14.688  25.540  32.012
   57    HE1  PHE   8           HE1      PHE   8  12.426  29.312  29.692
   58    HE2  PHE   8           HE2      PHE   8  12.210  25.624  31.903
   59    HZ   PHE   8           HZ       PHE   8  11.079  27.501  30.731
   60    H    ALA   9           H        ALA   9  15.232  25.757  28.014
   61    HA   ALA   9           HA       ALA   9  14.467  26.257  25.943
   62    HB1  ALA   9           HB1      ALA   9  14.525  29.061  27.104
   63    HB2  ALA   9           HB2      ALA   9  13.531  28.500  25.743
   64    HB3  ALA   9           HB3      ALA   9  13.260  27.832  27.359
   65    H    ASN  10           H        ASN  10  16.923  25.630  25.520
   66    HA   ASN  10           HA       ASN  10  18.762  25.760  24.231
   67    HB2  ASN  10           HB2      ASN  10  16.965  27.564  22.559
   68    HB3  ASN  10           HB3      ASN  10  18.529  26.977  22.007
   69   HD21  ASN  10          HD21      ASN  10  16.183  24.803  20.640
   70   HD22  ASN  10          HD22      ASN  10  16.314  26.553  20.602
   71    H    VAL  11           H        VAL  11  18.425  28.132  26.352
   72    HA   VAL  11           HA       VAL  11  20.867  29.586  25.403
   73    HB   VAL  11           HB       VAL  11  18.599  30.707  27.079
   74   HG11  VAL  11          HG11      VAL  11  20.733  31.830  27.591
   75   HG12  VAL  11          HG12      VAL  11  21.063  32.035  25.854
   76   HG13  VAL  11          HG13      VAL  11  19.715  32.892  26.627
   77   HG21  VAL  11          HG21      VAL  11  19.341  31.178  24.158
   78   HG22  VAL  11          HG22      VAL  11  17.845  30.431  24.758
   79   HG23  VAL  11          HG23      VAL  11  18.155  32.137  25.074
   80    H    ASP  12           H        ASP  12  22.467  30.036  26.799
   81    HA   ASP  12           HA       ASP  12  22.922  28.378  29.114
   82    HB2  ASP  12           HB2      ASP  12  24.496  30.772  28.088
   83    HB3  ASP  12           HB3      ASP  12  25.096  29.477  29.125
   84    H    VAL  13           H        VAL  13  20.634  29.997  29.639
   85    HA   VAL  13           HA       VAL  13  21.147  32.530  30.804
   86    HB   VAL  13           HB       VAL  13  18.839  31.992  32.051
   87   HG11  VAL  13          HG11      VAL  13  17.667  32.783  30.094
   88   HG12  VAL  13          HG12      VAL  13  19.202  33.639  30.263
   89   HG13  VAL  13          HG13      VAL  13  19.037  32.352  29.046
   90   HG21  VAL  13          HG21      VAL  13  18.868  29.547  31.436
   91   HG22  VAL  13          HG22      VAL  13  17.443  30.452  30.908
   92   HG23  VAL  13          HG23      VAL  13  18.693  30.026  29.729
   93    H    LYS  14           H        LYS  14  20.900  29.404  32.510
   94    HA   LYS  14           HA       LYS  14  21.580  30.822  35.071
   95    HB2  LYS  14           HB2      LYS  14  20.686  27.946  34.709
   96    HB3  LYS  14           HB3      LYS  14  20.914  28.805  36.227
   97    HG2  LYS  14           HG2      LYS  14  18.812  29.378  34.100
   98    HG3  LYS  14           HG3      LYS  14  18.553  28.635  35.679
   99    HD2  LYS  14           HD2      LYS  14  19.153  30.742  36.820
  100    HD3  LYS  14           HD3      LYS  14  19.508  31.512  35.253
  101    HE2  LYS  14           HE2      LYS  14  17.214  31.021  34.494
  102    HE3  LYS  14           HE3      LYS  14  16.816  30.382  36.100
  103    HZ1  LYS  14           HZ1      LYS  14  16.158  32.703  35.795
  104    HZ2  LYS  14           HZ2      LYS  14  17.272  32.590  37.009
  105    HZ3  LYS  14           HZ3      LYS  14  17.707  33.149  35.510
  106    H    GLY  15           H        GLY  15  23.034  28.832  32.667
  107    HA2  GLY  15           HA2      GLY  15  25.655  29.433  33.426
  108    HA3  GLY  15           HA3      GLY  15  25.285  27.859  34.148
  109    H    ASP  16           H        ASP  16  27.311  28.011  32.371
  110    HA   ASP  16           HA       ASP  16  26.362  27.122  29.733
  111    HB2  ASP  16           HB2      ASP  16  28.752  26.962  29.196
  112    HB3  ASP  16           HB3      ASP  16  28.283  28.559  29.768
  113    H    CYS  17           H        CYS  17  26.493  25.126  28.882
  114    HA   CYS  17           HA       CYS  17  27.180  22.849  30.664
  115    HB2  CYS  17           HB2      CYS  17  25.776  21.554  29.481
  116    HB3  CYS  17           HB3      CYS  17  24.925  23.090  29.504
  117    H    LYS  18           H        LYS  18  28.478  24.714  28.097
  118    HA   LYS  18           HA       LYS  18  29.864  22.756  26.659
  119    HB2  LYS  18           HB2      LYS  18  29.444  25.206  26.118
  120    HB3  LYS  18           HB3      LYS  18  30.846  25.588  27.113
  121    HG2  LYS  18           HG2      LYS  18  31.295  23.413  25.129
  122    HG3  LYS  18           HG3      LYS  18  30.829  24.936  24.391
  123    HD2  LYS  18           HD2      LYS  18  33.067  24.669  26.438
  124    HD3  LYS  18           HD3      LYS  18  33.322  24.431  24.711
  125    HE2  LYS  18           HE2      LYS  18  32.416  27.019  26.059
  126    HE3  LYS  18           HE3      LYS  18  33.995  26.673  25.344
  127    HZ1  LYS  18           HZ1      LYS  18  32.937  27.787  23.662
  128    HZ2  LYS  18           HZ2      LYS  18  32.560  26.234  23.214
  129    HZ3  LYS  18           HZ3      LYS  18  31.467  27.216  23.967
  130    H    ARG  19           H        ARG  19  30.822  24.106  29.808
  131    HA   ARG  19           HA       ARG  19  33.475  22.933  29.836
  132    HB2  ARG  19           HB2      ARG  19  31.560  23.982  31.893
  133    HB3  ARG  19           HB3      ARG  19  32.869  22.929  32.435
  134    HG2  ARG  19           HG2      ARG  19  34.542  24.351  31.385
  135    HG3  ARG  19           HG3      ARG  19  33.290  25.444  30.774
  136    HD2  ARG  19           HD2      ARG  19  33.659  24.845  33.744
  137    HD3  ARG  19           HD3      ARG  19  34.548  26.126  32.904
  138    HE   ARG  19           HE       ARG  19  31.769  26.490  32.358
  139   HH11  ARG  19          HH11      ARG  19  33.099  28.224  35.693
  140   HH12  ARG  19          HH12      ARG  19  33.976  26.815  35.110
  141   HH21  ARG  19          HH21      ARG  19  30.708  28.204  33.283
  142   HH22  ARG  19          HH22      ARG  19  31.303  28.900  34.771
  143    H    HIS  20           H        HIS  20  30.303  21.512  30.583
  144    HA   HIS  20           HA       HIS  20  31.344  18.966  31.513
  145    HB2  HIS  20           HB2      HIS  20  29.222  19.161  32.253
  146    HB3  HIS  20           HB3      HIS  20  28.700  20.184  30.942
  147    HD2  HIS  20           HD2      HIS  20  27.669  19.068  28.763
  148    HE1  HIS  20           HE1      HIS  20  27.442  15.084  30.244
  149    HE2  HIS  20           HE2      HIS  20  26.728  16.636  28.354
  150    H    CYS  21           H        CYS  21  30.470  20.160  28.250
  151    HA   CYS  21           HA       CYS  21  31.210  17.619  26.967
  152    HB2  CYS  21           HB2      CYS  21  30.646  20.429  25.983
  153    HB3  CYS  21           HB3      CYS  21  31.055  19.133  24.891
  154    H    LYS  22           H        LYS  22  32.954  20.686  27.578
  155    HA   LYS  22           HA       LYS  22  35.339  20.042  26.180
  156    HB2  LYS  22           HB2      LYS  22  34.775  22.278  26.905
  157    HB3  LYS  22           HB3      LYS  22  34.841  21.799  28.607
  158    HG2  LYS  22           HG2      LYS  22  37.218  21.460  28.530
  159    HG3  LYS  22           HG3      LYS  22  37.272  21.697  26.772
  160    HD2  LYS  22           HD2      LYS  22  36.253  23.850  28.674
  161    HD3  LYS  22           HD3      LYS  22  37.973  23.656  28.322
  162    HE2  LYS  22           HE2      LYS  22  37.671  24.055  25.977
  163    HE3  LYS  22           HE3      LYS  22  35.906  24.003  26.105
  164    HZ1  LYS  22           HZ1      LYS  22  37.061  26.274  26.066
  165    HZ2  LYS  22           HZ2      LYS  22  35.881  26.054  27.218
  166    HZ3  LYS  22           HZ3      LYS  22  37.442  26.004  27.639
  167    H    ALA  23           H        ALA  23  34.291  19.040  29.389
  168    HA   ALA  23           HA       ALA  23  36.674  17.900  30.413
  169    HB1  ALA  23           HB1      ALA  23  33.786  16.894  30.624
  170    HB2  ALA  23           HB2      ALA  23  35.112  16.515  31.722
  171    HB3  ALA  23           HB3      ALA  23  34.506  18.170  31.629
  172    H    GLU  24           H        GLU  24  34.615  16.755  27.768
  173    HA   GLU  24           HA       GLU  24  36.212  14.239  27.537
  174    HB2  GLU  24           HB2      GLU  24  33.326  14.757  26.733
  175    HB3  GLU  24           HB3      GLU  24  34.228  13.241  26.490
  176    HG2  GLU  24           HG2      GLU  24  34.593  13.075  28.952
  177    HG3  GLU  24           HG3      GLU  24  33.614  14.522  29.197
  178    H    ASP  25           H        ASP  25  36.702  17.008  26.462
  179    HA   ASP  25           HA       ASP  25  37.487  18.054  24.616
  180    HB2  ASP  25           HB2      ASP  25  39.092  16.228  24.630
  181    HB3  ASP  25           HB3      ASP  25  38.038  15.225  23.641
  182    H    LYS  26           H        LYS  26  34.965  18.399  24.653
  183    HA   LYS  26           HA       LYS  26  34.023  18.263  21.826
  184    HB2  LYS  26           HB2      LYS  26  32.345  17.636  24.293
  185    HB3  LYS  26           HB3      LYS  26  31.753  17.730  22.642
  186    HG2  LYS  26           HG2      LYS  26  33.735  15.677  23.674
  187    HG3  LYS  26           HG3      LYS  26  31.995  15.427  23.610
  188    HD2  LYS  26           HD2      LYS  26  31.860  15.547  21.298
  189    HD3  LYS  26           HD3      LYS  26  33.449  16.277  21.093
  190    HE2  LYS  26           HE2      LYS  26  32.896  13.393  21.900
  191    HE3  LYS  26           HE3      LYS  26  33.571  13.979  20.371
  192    HZ1  LYS  26           HZ1      LYS  26  35.422  13.341  21.614
  193    HZ2  LYS  26           HZ2      LYS  26  35.393  14.969  21.809
  194    HZ3  LYS  26           HZ3      LYS  26  34.881  14.006  23.023
  195    H    GLU  27           H        GLU  27  32.744  19.962  21.131
  196    HA   GLU  27           HA       GLU  27  32.352  22.306  22.867
  197    HB2  GLU  27           HB2      GLU  27  31.475  21.554  20.060
  198    HB3  GLU  27           HB3      GLU  27  30.748  22.915  20.906
  199    HG2  GLU  27           HG2      GLU  27  33.696  22.594  20.297
  200    HG3  GLU  27           HG3      GLU  27  32.576  23.642  19.436
  201    H    GLY  28           H        GLY  28  30.202  22.974  23.474
  202    HA2  GLY  28           HA2      GLY  28  28.106  20.857  23.658
  203    HA3  GLY  28           HA3      GLY  28  28.692  21.589  25.151
  204    H    ILE  29           H        ILE  29  26.049  21.596  23.503
  205    HA   ILE  29           HA       ILE  29  25.517  24.510  23.680
  206    HB   ILE  29           HB       ILE  29  26.190  24.059  21.447
  207   HG12  ILE  29          HG12      ILE  29  24.176  25.584  22.018
  208   HG13  ILE  29          HG13      ILE  29  24.637  25.275  20.354
  209   HG21  ILE  29          HG21      ILE  29  25.001  22.612  19.881
  210   HG22  ILE  29          HG22      ILE  29  25.848  21.726  21.141
  211   HG23  ILE  29          HG23      ILE  29  24.081  21.911  21.234
  212   HD11  ILE  29          HD11      ILE  29  22.161  25.238  20.796
  213   HD12  ILE  29          HD12      ILE  29  22.802  23.807  19.973
  214   HD13  ILE  29          HD13      ILE  29  22.409  23.729  21.697
  215    H    CYS  30           H        CYS  30  23.525  25.084  24.374
  216    HA   CYS  30           HA       CYS  30  22.048  23.158  25.856
  217    HB2  CYS  30           HB2      CYS  30  21.323  25.976  24.999
  218    HB3  CYS  30           HB3      CYS  30  20.477  25.029  26.233
  219    H    HIS  31           H        HIS  31  20.706  21.676  25.170
  220    HA   HIS  31           HA       HIS  31  18.768  22.198  22.924
  221    HB2  HIS  31           HB2      HIS  31  20.142  19.676  23.858
  222    HB3  HIS  31           HB3      HIS  31  18.523  19.593  23.179
  223    HD2  HIS  31           HD2      HIS  31  21.828  21.369  22.004
  224    HE1  HIS  31           HE1      HIS  31  19.990  19.547  18.618
  225    HE2  HIS  31           HE2      HIS  31  21.942  20.983  19.399
  226    H    GLY  32           H        GLY  32  17.163  23.195  23.966
  227    HA2  GLY  32           HA2      GLY  32  15.374  23.557  25.389
  228    HA3  GLY  32           HA3      GLY  32  15.353  21.820  25.691
  229    H    THR  33           H        THR  33  15.626  21.299  27.703
  230    HA   THR  33           HA       THR  33  17.276  22.893  29.604
  231    HB   THR  33           HB       THR  33  16.010  21.902  31.420
  232    HG1  THR  33           HG1      THR  33  14.468  20.728  29.353
  233   HG21  THR  33          HG21      THR  33  13.934  23.092  31.093
  234   HG22  THR  33          HG22      THR  33  15.259  24.008  30.340
  235   HG23  THR  33          HG23      THR  33  14.149  23.065  29.327
  236    H    LYS  34           H        LYS  34  18.344  20.956  27.699
  237    HA   LYS  34           HA       LYS  34  20.148  19.606  29.640
  238    HB2  LYS  34           HB2      LYS  34  18.918  18.312  27.166
  239    HB3  LYS  34           HB3      LYS  34  20.257  17.622  28.046
  240    HG2  LYS  34           HG2      LYS  34  17.525  18.128  29.284
  241    HG3  LYS  34           HG3      LYS  34  18.061  16.592  28.581
  242    HD2  LYS  34           HD2      LYS  34  20.022  16.625  30.215
  243    HD3  LYS  34           HD3      LYS  34  19.223  18.004  31.011
  244    HE2  LYS  34           HE2      LYS  34  17.188  16.551  31.299
  245    HE3  LYS  34           HE3      LYS  34  18.104  15.191  30.623
  246    HZ1  LYS  34           HZ1      LYS  34  18.101  15.268  33.105
  247    HZ2  LYS  34           HZ2      LYS  34  19.619  15.308  32.503
  248    HZ3  LYS  34           HZ3      LYS  34  18.912  16.686  33.045
  249    H    CYS  35           H        CYS  35  22.117  18.746  28.360
  250    HA   CYS  35           HA       CYS  35  23.121  20.862  26.515
  251    HB2  CYS  35           HB2      CYS  35  24.304  20.250  28.694
  252    HB3  CYS  35           HB3      CYS  35  24.679  18.697  27.970
  253    H    LYS  36           H        LYS  36  24.476  20.094  24.682
  254    HA   LYS  36           HA       LYS  36  24.190  17.260  23.811
  255    HB2  LYS  36           HB2      LYS  36  22.323  18.774  22.921
  256    HB3  LYS  36           HB3      LYS  36  23.553  19.655  22.034
  257    HG2  LYS  36           HG2      LYS  36  22.994  16.683  21.697
  258    HG3  LYS  36           HG3      LYS  36  22.186  17.942  20.781
  259    HD2  LYS  36           HD2      LYS  36  25.126  17.284  20.714
  260    HD3  LYS  36           HD3      LYS  36  23.918  17.028  19.439
  261    HE2  LYS  36           HE2      LYS  36  23.613  19.580  19.424
  262    HE3  LYS  36           HE3      LYS  36  25.056  19.657  20.449
  263    HZ1  LYS  36           HZ1      LYS  36  26.007  19.797  18.381
  264    HZ2  LYS  36           HZ2      LYS  36  25.976  18.143  18.481
  265    HZ3  LYS  36           HZ3      LYS  36  24.846  18.938  17.632
  266    H    CYS  37           H        CYS  37  26.260  16.612  23.487
  267    HA   CYS  37           HA       CYS  37  28.365  18.587  23.044
  268    HB2  CYS  37           HB2      CYS  37  28.599  15.609  23.317
  269    HB3  CYS  37           HB3      CYS  37  29.910  16.752  23.270
  270    H    GLY  38           H        GLY  38  29.395  19.097  21.327
  271    HA2  GLY  38           HA2      GLY  38  28.566  18.066  18.672
  272    HA3  GLY  38           HA3      GLY  38  29.295  19.639  19.061
  273    H    VAL  39           H        VAL  39  30.966  19.620  17.651
  274    HA   VAL  39           HA       VAL  39  32.797  17.428  17.332
  275    HB   VAL  39           HB       VAL  39  34.162  19.148  16.052
  276   HG11  VAL  39          HG11      VAL  39  32.582  17.604  14.981
  277   HG12  VAL  39          HG12      VAL  39  31.265  18.773  15.215
  278   HG13  VAL  39          HG13      VAL  39  32.630  19.172  14.153
  279   HG21  VAL  39          HG21      VAL  39  31.754  20.951  16.458
  280   HG22  VAL  39          HG22      VAL  39  33.347  21.189  17.210
  281   HG23  VAL  39          HG23      VAL  39  33.175  21.257  15.449
  282    HA   PRO  40           HA       PRO  40  35.652  18.151  20.536
  283    HB2  PRO  40           HB2      PRO  40  38.014  17.214  19.554
  284    HB3  PRO  40           HB3      PRO  40  36.614  16.155  19.890
  285    HG2  PRO  40           HG2      PRO  40  37.402  17.377  17.231
  286    HG3  PRO  40           HG3      PRO  40  37.023  15.665  17.586
  287    HD2  PRO  40           HD2      PRO  40  35.122  17.326  16.596
  288    HD3  PRO  40           HD3      PRO  40  34.699  16.151  17.865
  289    H    ILE  41           H        ILE  41  37.546  19.296  21.358
  290    HA   ILE  41           HA       ILE  41  37.685  21.906  19.963
  291    HB   ILE  41           HB       ILE  41  37.791  22.947  22.010
  292   HG12  ILE  41          HG12      ILE  41  37.520  21.419  24.196
  293   HG13  ILE  41          HG13      ILE  41  38.497  20.318  23.244
  294   HG21  ILE  41          HG21      ILE  41  35.584  22.060  21.278
  295   HG22  ILE  41          HG22      ILE  41  35.791  20.707  22.411
  296   HG23  ILE  41          HG23      ILE  41  35.687  22.368  23.015
  297   HD11  ILE  41          HD11      ILE  41  39.905  21.704  24.693
  298   HD12  ILE  41          HD12      ILE  41  40.223  22.183  23.016
  299   HD13  ILE  41          HD13      ILE  41  39.183  23.186  24.036
  300    H    SER  42           H        SER  42  39.808  19.534  21.552
  301    HA   SER  42           HA       SER  42  42.066  21.162  21.788
  302    HB2  SER  42           HB2      SER  42  42.033  18.142  21.401
  303    HB3  SER  42           HB3      SER  42  43.313  19.115  22.144
  304    HG   SER  42           HG       SER  42  40.670  18.640  23.060
  305    H    TYR  43           H        TYR  43  43.673  21.848  20.505
  306    HA   TYR  43           HA       TYR  43  43.879  20.842  17.707
  307    HB2  TYR  43           HB2      TYR  43  43.384  22.832  16.725
  308    HB3  TYR  43           HB3      TYR  43  42.182  22.717  17.983
  309    HD1  TYR  43           HD1      TYR  43  45.054  24.503  16.688
  310    HD2  TYR  43           HD2      TYR  43  42.391  24.174  20.066
  311    HE1  TYR  43           HE1      TYR  43  45.910  26.638  17.582
  312    HE2  TYR  43           HE2      TYR  43  43.228  26.347  20.924
  313    HH   TYR  43           HH       TYR  43  44.652  28.183  20.526
  314    H    LEU  44           H        LEU  44  45.577  21.726  20.435
  315    HA   LEU  44           HA       LEU  44  48.104  21.321  19.048
  316    HB2  LEU  44           HB2      LEU  44  49.195  23.293  20.060
  317    HB3  LEU  44           HB3      LEU  44  48.013  23.677  18.827
  318    HG   LEU  44           HG       LEU  44  46.400  24.363  20.630
  319   HD11  LEU  44          HD11      LEU  44  48.868  23.978  22.392
  320   HD12  LEU  44          HD12      LEU  44  47.431  24.924  22.850
  321   HD13  LEU  44          HD13      LEU  44  47.283  23.191  22.575
  322   HD21  LEU  44          HD21      LEU  44  47.845  25.948  19.379
  323   HD22  LEU  44          HD22      LEU  44  47.536  26.491  21.028
  324   HD23  LEU  44          HD23      LEU  44  49.110  25.769  20.613
  Start of MODEL   12
    1    H1   ALA   1           H1       ALA   1  24.209  25.248  38.391
    2    H2   ALA   1           H2       ALA   1  24.516  24.015  39.459
    3    H3   ALA   1           H3       ALA   1  23.377  25.136  39.802
    4    HA   ALA   1           HA       ALA   1  22.326  23.126  39.163
    5    HB1  ALA   1           HB1      ALA   1  22.001  25.225  36.972
    6    HB2  ALA   1           HB2      ALA   1  20.812  24.018  37.514
    7    HB3  ALA   1           HB3      ALA   1  21.284  25.344  38.588
    8    H    LYS   2           H        LYS   2  23.069  21.218  38.438
    9    HA   LYS   2           HA       LYS   2  24.984  21.140  36.138
   10    HB2  LYS   2           HB2      LYS   2  25.696  20.594  38.560
   11    HB3  LYS   2           HB3      LYS   2  24.669  19.171  38.431
   12    HG2  LYS   2           HG2      LYS   2  26.038  18.459  36.418
   13    HG3  LYS   2           HG3      LYS   2  27.076  19.859  36.695
   14    HD2  LYS   2           HD2      LYS   2  28.165  17.984  37.730
   15    HD3  LYS   2           HD3      LYS   2  27.532  18.995  39.020
   16    HE2  LYS   2           HE2      LYS   2  27.093  16.719  39.607
   17    HE3  LYS   2           HE3      LYS   2  25.540  17.451  39.204
   18    HZ1  LYS   2           HZ1      LYS   2  25.930  15.210  38.186
   19    HZ2  LYS   2           HZ2      LYS   2  25.622  16.350  37.048
   20    HZ3  LYS   2           HZ3      LYS   2  27.149  15.842  37.292
   21    H    ASN   3           H        ASN   3  22.147  19.568  37.609
   22    HA   ASN   3           HA       ASN   3  22.002  17.480  35.617
   23    HB2  ASN   3           HB2      ASN   3  19.797  18.467  37.462
   24    HB3  ASN   3           HB3      ASN   3  19.888  16.914  36.632
   25   HD21  ASN   3          HD21      ASN   3  22.721  15.943  38.843
   26   HD22  ASN   3          HD22      ASN   3  22.326  15.859  37.122
   27    H    GLN   4           H        GLN   4  21.027  20.800  35.512
   28    HA   GLN   4           HA       GLN   4  19.697  20.274  32.878
   29    HB2  GLN   4           HB2      GLN   4  18.689  22.378  32.979
   30    HB3  GLN   4           HB3      GLN   4  18.425  21.637  34.565
   31    HG2  GLN   4           HG2      GLN   4  20.338  22.983  35.475
   32    HG3  GLN   4           HG3      GLN   4  20.532  23.743  33.886
   33   HE21  GLN   4          HE21      GLN   4  18.362  24.718  32.951
   34   HE22  GLN   4          HE22      GLN   4  17.439  25.601  34.177
   35    H    PHE   5           H        PHE   5  22.749  20.754  34.054
   36    HA   PHE   5           HA       PHE   5  24.678  21.695  33.344
   37    HB2  PHE   5           HB2      PHE   5  23.454  21.314  30.602
   38    HB3  PHE   5           HB3      PHE   5  25.166  21.431  30.992
   39    HD1  PHE   5           HD1      PHE   5  26.362  19.603  32.139
   40    HD2  PHE   5           HD2      PHE   5  22.179  19.238  31.170
   41    HE1  PHE   5           HE1      PHE   5  26.445  17.193  32.688
   42    HE2  PHE   5           HE2      PHE   5  22.252  16.831  31.768
   43    HZ   PHE   5           HZ       PHE   5  24.381  15.796  32.528
   44    H    GLY   6           H        GLY   6  22.644  23.625  34.031
   45    HA2  GLY   6           HA2      GLY   6  22.461  25.944  34.098
   46    HA3  GLY   6           HA3      GLY   6  23.854  26.045  33.019
   47    H    CYS   7           H        CYS   7  21.885  24.119  31.279
   48    HA   CYS   7           HA       CYS   7  21.059  26.229  29.519
   49    HB2  CYS   7           HB2      CYS   7  20.606  23.232  29.466
   50    HB3  CYS   7           HB3      CYS   7  20.183  24.317  28.174
   51    H    PHE   8           H        PHE   8  19.111  27.171  29.272
   52    HA   PHE   8           HA       PHE   8  16.660  25.647  29.853
   53    HB2  PHE   8           HB2      PHE   8  16.971  26.841  31.960
   54    HB3  PHE   8           HB3      PHE   8  17.144  28.366  31.104
   55    HD1  PHE   8           HD1      PHE   8  15.228  29.693  30.608
   56    HD2  PHE   8           HD2      PHE   8  14.735  25.547  31.692
   57    HE1  PHE   8           HE1      PHE   8  12.761  29.979  30.592
   58    HE2  PHE   8           HE2      PHE   8  12.262  25.832  31.631
   59    HZ   PHE   8           HZ       PHE   8  11.277  28.044  31.083
   60    H    ALA   9           H        ALA   9  15.118  25.970  28.356
   61    HA   ALA   9           HA       ALA   9  14.241  26.531  26.344
   62    HB1  ALA   9           HB1      ALA   9  13.500  28.907  26.246
   63    HB2  ALA   9           HB2      ALA   9  13.184  28.116  27.805
   64    HB3  ALA   9           HB3      ALA   9  14.538  29.248  27.646
   65    H    ASN  10           H        ASN  10  16.713  25.832  25.865
   66    HA   ASN  10           HA       ASN  10  18.350  25.757  24.360
   67    HB2  ASN  10           HB2      ASN  10  16.666  27.742  22.789
   68    HB3  ASN  10           HB3      ASN  10  18.107  26.952  22.176
   69   HD21  ASN  10          HD21      ASN  10  14.731  26.601  22.437
   70   HD22  ASN  10          HD22      ASN  10  14.749  24.958  21.799
   71    H    VAL  11           H        VAL  11  18.347  28.131  26.490
   72    HA   VAL  11           HA       VAL  11  20.804  29.431  25.390
   73    HB   VAL  11           HB       VAL  11  18.741  30.708  27.211
   74   HG11  VAL  11          HG11      VAL  11  21.171  31.854  25.753
   75   HG12  VAL  11          HG12      VAL  11  19.950  32.818  26.606
   76   HG13  VAL  11          HG13      VAL  11  20.967  31.716  27.521
   77   HG21  VAL  11          HG21      VAL  11  18.149  32.121  25.270
   78   HG22  VAL  11          HG22      VAL  11  19.222  31.150  24.233
   79   HG23  VAL  11          HG23      VAL  11  17.778  30.431  24.963
   80    H    ASP  12           H        ASP  12  22.492  29.867  26.763
   81    HA   ASP  12           HA       ASP  12  22.808  28.238  29.157
   82    HB2  ASP  12           HB2      ASP  12  25.144  29.013  29.042
   83    HB3  ASP  12           HB3      ASP  12  24.567  28.262  27.563
   84    H    VAL  13           H        VAL  13  20.779  30.004  29.658
   85    HA   VAL  13           HA       VAL  13  21.566  32.496  30.864
   86    HB   VAL  13           HB       VAL  13  19.191  32.362  31.919
   87   HG11  VAL  13          HG11      VAL  13  18.170  33.128  29.921
   88   HG12  VAL  13          HG12      VAL  13  19.853  33.696  29.935
   89   HG13  VAL  13          HG13      VAL  13  19.383  32.310  28.926
   90   HG21  VAL  13          HG21      VAL  13  18.906  29.874  31.592
   91   HG22  VAL  13          HG22      VAL  13  17.612  30.872  30.908
   92   HG23  VAL  13          HG23      VAL  13  18.835  30.169  29.836
   93    H    LYS  14           H        LYS  14  21.264  29.309  32.270
   94    HA   LYS  14           HA       LYS  14  21.866  30.433  35.000
   95    HB2  LYS  14           HB2      LYS  14  20.727  27.735  34.233
   96    HB3  LYS  14           HB3      LYS  14  21.159  28.248  35.868
   97    HG2  LYS  14           HG2      LYS  14  19.530  30.115  35.729
   98    HG3  LYS  14           HG3      LYS  14  19.119  29.656  34.075
   99    HD2  LYS  14           HD2      LYS  14  17.416  28.743  35.383
  100    HD3  LYS  14           HD3      LYS  14  18.478  27.400  34.938
  101    HE2  LYS  14           HE2      LYS  14  19.591  27.656  37.222
  102    HE3  LYS  14           HE3      LYS  14  18.365  28.876  37.618
  103    HZ1  LYS  14           HZ1      LYS  14  17.693  26.729  38.459
  104    HZ2  LYS  14           HZ2      LYS  14  16.681  27.081  37.199
  105    HZ3  LYS  14           HZ3      LYS  14  17.864  26.020  36.976
  106    H    GLY  15           H        GLY  15  23.371  28.913  32.371
  107    HA2  GLY  15           HA2      GLY  15  25.937  29.272  33.156
  108    HA3  GLY  15           HA3      GLY  15  25.571  27.676  33.845
  109    H    ASP  16           H        ASP  16  27.551  27.835  32.068
  110    HA   ASP  16           HA       ASP  16  26.567  27.073  29.400
  111    HB2  ASP  16           HB2      ASP  16  28.838  27.159  28.708
  112    HB3  ASP  16           HB3      ASP  16  28.524  28.587  29.689
  113    H    CYS  17           H        CYS  17  26.776  25.093  28.442
  114    HA   CYS  17           HA       CYS  17  27.385  22.754  30.182
  115    HB2  CYS  17           HB2      CYS  17  25.283  22.802  28.909
  116    HB3  CYS  17           HB3      CYS  17  26.200  22.942  27.406
  117    H    LYS  18           H        LYS  18  28.879  24.722  27.719
  118    HA   LYS  18           HA       LYS  18  30.621  22.894  26.500
  119    HB2  LYS  18           HB2      LYS  18  30.340  25.251  25.837
  120    HB3  LYS  18           HB3      LYS  18  31.275  25.777  27.238
  121    HG2  LYS  18           HG2      LYS  18  32.500  23.714  25.387
  122    HG3  LYS  18           HG3      LYS  18  32.342  25.345  24.767
  123    HD2  LYS  18           HD2      LYS  18  33.623  24.905  27.476
  124    HD3  LYS  18           HD3      LYS  18  34.557  24.627  26.001
  125    HE2  LYS  18           HE2      LYS  18  34.448  26.850  25.305
  126    HE3  LYS  18           HE3      LYS  18  32.990  27.199  26.242
  127    HZ1  LYS  18           HZ1      LYS  18  35.013  28.199  27.196
  128    HZ2  LYS  18           HZ2      LYS  18  34.231  27.236  28.232
  129    HZ3  LYS  18           HZ3      LYS  18  35.626  26.703  27.531
  130    H    ARG  19           H        ARG  19  31.051  24.324  29.762
  131    HA   ARG  19           HA       ARG  19  33.519  23.074  30.412
  132    HB2  ARG  19           HB2      ARG  19  31.093  24.066  31.886
  133    HB3  ARG  19           HB3      ARG  19  32.192  23.028  32.787
  134    HG2  ARG  19           HG2      ARG  19  34.027  24.485  32.555
  135    HG3  ARG  19           HG3      ARG  19  33.304  25.365  31.205
  136    HD2  ARG  19           HD2      ARG  19  33.343  26.619  33.387
  137    HD3  ARG  19           HD3      ARG  19  31.799  26.520  32.575
  138    HE   ARG  19           HE       ARG  19  32.580  24.859  34.965
  139   HH11  ARG  19          HH11      ARG  19  29.961  26.473  33.173
  140   HH12  ARG  19          HH12      ARG  19  28.824  26.021  34.431
  141   HH21  ARG  19          HH21      ARG  19  31.089  24.378  36.371
  142   HH22  ARG  19          HH22      ARG  19  29.417  24.924  36.185
  143    H    HIS  20           H        HIS  20  30.296  21.484  30.540
  144    HA   HIS  20           HA       HIS  20  31.332  19.022  31.703
  145    HB2  HIS  20           HB2      HIS  20  29.020  19.532  31.988
  146    HB3  HIS  20           HB3      HIS  20  28.773  19.789  30.265
  147    HD2  HIS  20           HD2      HIS  20  27.698  17.866  28.991
  148    HE1  HIS  20           HE1      HIS  20  28.603  14.620  31.607
  149    HE2  HIS  20           HE2      HIS  20  27.266  15.317  29.560
  150    H    CYS  21           H        CYS  21  30.705  20.079  28.354
  151    HA   CYS  21           HA       CYS  21  31.557  17.562  27.180
  152    HB2  CYS  21           HB2      CYS  21  31.033  20.315  26.054
  153    HB3  CYS  21           HB3      CYS  21  31.396  18.922  25.052
  154    H    LYS  22           H        LYS  22  33.247  20.625  27.905
  155    HA   LYS  22           HA       LYS  22  35.736  20.169  26.624
  156    HB2  LYS  22           HB2      LYS  22  35.139  22.344  27.477
  157    HB3  LYS  22           HB3      LYS  22  34.849  21.702  29.076
  158    HG2  LYS  22           HG2      LYS  22  36.723  22.943  29.358
  159    HG3  LYS  22           HG3      LYS  22  37.332  21.311  29.341
  160    HD2  LYS  22           HD2      LYS  22  37.547  23.383  27.109
  161    HD3  LYS  22           HD3      LYS  22  38.805  22.875  28.229
  162    HE2  LYS  22           HE2      LYS  22  38.160  20.465  27.125
  163    HE3  LYS  22           HE3      LYS  22  37.767  21.535  25.776
  164    HZ1  LYS  22           HZ1      LYS  22  40.374  21.334  27.206
  165    HZ2  LYS  22           HZ2      LYS  22  40.068  20.770  25.700
  166    HZ3  LYS  22           HZ3      LYS  22  40.079  22.418  26.036
  167    H    ALA  23           H        ALA  23  34.494  18.872  29.681
  168    HA   ALA  23           HA       ALA  23  36.992  17.836  30.650
  169    HB1  ALA  23           HB1      ALA  23  34.125  16.928  31.062
  170    HB2  ALA  23           HB2      ALA  23  35.537  16.402  32.014
  171    HB3  ALA  23           HB3      ALA  23  35.020  18.106  32.053
  172    H    GLU  24           H        GLU  24  34.873  16.756  28.075
  173    HA   GLU  24           HA       GLU  24  36.656  14.436  27.516
  174    HB2  GLU  24           HB2      GLU  24  33.835  14.905  26.483
  175    HB3  GLU  24           HB3      GLU  24  34.872  13.505  26.193
  176    HG2  GLU  24           HG2      GLU  24  34.888  13.247  28.790
  177    HG3  GLU  24           HG3      GLU  24  33.490  14.326  28.748
  178    H    ASP  25           H        ASP  25  36.952  17.412  26.891
  179    HA   ASP  25           HA       ASP  25  37.706  18.747  25.296
  180    HB2  ASP  25           HB2      ASP  25  39.223  16.535  25.319
  181    HB3  ASP  25           HB3      ASP  25  38.740  16.486  23.631
  182    H    LYS  26           H        LYS  26  34.947  17.909  24.854
  183    HA   LYS  26           HA       LYS  26  34.562  18.565  21.962
  184    HB2  LYS  26           HB2      LYS  26  32.816  17.209  24.061
  185    HB3  LYS  26           HB3      LYS  26  32.169  17.809  22.553
  186    HG2  LYS  26           HG2      LYS  26  34.452  16.132  21.932
  187    HG3  LYS  26           HG3      LYS  26  33.399  15.289  23.084
  188    HD2  LYS  26           HD2      LYS  26  31.435  15.719  21.614
  189    HD3  LYS  26           HD3      LYS  26  32.489  16.583  20.486
  190    HE2  LYS  26           HE2      LYS  26  32.272  14.481  19.512
  191    HE3  LYS  26           HE3      LYS  26  33.859  14.423  20.294
  192    HZ1  LYS  26           HZ1      LYS  26  32.872  13.118  22.071
  193    HZ2  LYS  26           HZ2      LYS  26  31.365  13.329  21.505
  194    HZ3  LYS  26           HZ3      LYS  26  32.438  12.435  20.630
  195    H    GLU  27           H        GLU  27  32.833  19.988  21.406
  196    HA   GLU  27           HA       GLU  27  32.340  22.261  23.196
  197    HB2  GLU  27           HB2      GLU  27  31.179  21.486  20.477
  198    HB3  GLU  27           HB3      GLU  27  30.768  22.937  21.394
  199    HG2  GLU  27           HG2      GLU  27  33.346  23.402  21.372
  200    HG3  GLU  27           HG3      GLU  27  33.370  22.277  20.011
  201    H    GLY  28           H        GLY  28  30.295  22.811  23.972
  202    HA2  GLY  28           HA2      GLY  28  28.171  20.699  24.138
  203    HA3  GLY  28           HA3      GLY  28  28.623  21.641  25.553
  204    H    ILE  29           H        ILE  29  26.029  21.337  23.977
  205    HA   ILE  29           HA       ILE  29  25.449  24.200  23.468
  206    HB   ILE  29           HB       ILE  29  26.160  23.273  21.403
  207   HG12  ILE  29          HG12      ILE  29  24.132  24.848  21.580
  208   HG13  ILE  29          HG13      ILE  29  24.598  24.145  20.041
  209   HG21  ILE  29          HG21      ILE  29  24.127  21.061  21.677
  210   HG22  ILE  29          HG22      ILE  29  24.972  21.489  20.172
  211   HG23  ILE  29          HG23      ILE  29  25.893  20.931  21.562
  212   HD11  ILE  29          HD11      ILE  29  22.346  22.999  21.721
  213   HD12  ILE  29          HD12      ILE  29  22.134  24.189  20.423
  214   HD13  ILE  29          HD13      ILE  29  22.781  22.587  20.054
  215    H    CYS  30           H        CYS  30  23.532  24.884  24.178
  216    HA   CYS  30           HA       CYS  30  21.930  23.074  25.759
  217    HB2  CYS  30           HB2      CYS  30  21.517  25.988  25.009
  218    HB3  CYS  30           HB3      CYS  30  20.549  25.074  26.179
  219    H    HIS  31           H        HIS  31  20.541  21.737  25.048
  220    HA   HIS  31           HA       HIS  31  18.732  22.307  22.727
  221    HB2  HIS  31           HB2      HIS  31  20.108  19.811  23.670
  222    HB3  HIS  31           HB3      HIS  31  18.446  19.658  23.127
  223    HD2  HIS  31           HD2      HIS  31  21.939  20.202  21.717
  224    HE1  HIS  31           HE1      HIS  31  19.252  20.299  18.408
  225    HE2  HIS  31           HE2      HIS  31  21.711  20.205  19.101
  226    H    GLY  32           H        GLY  32  17.076  23.309  23.600
  227    HA2  GLY  32           HA2      GLY  32  15.159  23.718  24.815
  228    HA3  GLY  32           HA3      GLY  32  15.131  22.003  25.219
  229    H    THR  33           H        THR  33  15.304  21.513  27.327
  230    HA   THR  33           HA       THR  33  16.443  23.534  29.232
  231    HB   THR  33           HB       THR  33  15.019  22.505  30.943
  232    HG1  THR  33           HG1      THR  33  13.255  21.171  29.711
  233   HG21  THR  33          HG21      THR  33  12.902  23.374  30.217
  234   HG22  THR  33          HG22      THR  33  14.157  24.407  29.523
  235   HG23  THR  33          HG23      THR  33  13.335  23.213  28.501
  236    H    LYS  34           H        LYS  34  17.718  21.290  27.609
  237    HA   LYS  34           HA       LYS  34  19.426  20.077  29.712
  238    HB2  LYS  34           HB2      LYS  34  18.083  18.587  27.408
  239    HB3  LYS  34           HB3      LYS  34  19.181  17.867  28.576
  240    HG2  LYS  34           HG2      LYS  34  16.424  19.004  29.229
  241    HG3  LYS  34           HG3      LYS  34  16.779  17.322  28.972
  242    HD2  LYS  34           HD2      LYS  34  18.135  18.926  31.176
  243    HD3  LYS  34           HD3      LYS  34  16.594  18.077  31.374
  244    HE2  LYS  34           HE2      LYS  34  17.718  15.957  30.634
  245    HE3  LYS  34           HE3      LYS  34  19.266  16.810  30.611
  246    HZ1  LYS  34           HZ1      LYS  34  18.992  17.243  32.999
  247    HZ2  LYS  34           HZ2      LYS  34  17.513  16.530  33.004
  248    HZ3  LYS  34           HZ3      LYS  34  18.849  15.639  32.733
  249    H    CYS  35           H        CYS  35  21.059  18.566  28.125
  250    HA   CYS  35           HA       CYS  35  22.188  20.441  26.082
  251    HB2  CYS  35           HB2      CYS  35  23.233  20.904  28.233
  252    HB3  CYS  35           HB3      CYS  35  23.658  19.197  28.424
  253    H    LYS  36           H        LYS  36  23.719  19.574  24.587
  254    HA   LYS  36           HA       LYS  36  24.209  16.695  24.378
  255    HB2  LYS  36           HB2      LYS  36  22.730  18.540  22.553
  256    HB3  LYS  36           HB3      LYS  36  23.937  17.587  21.758
  257    HG2  LYS  36           HG2      LYS  36  22.853  15.525  22.673
  258    HG3  LYS  36           HG3      LYS  36  21.686  16.538  23.559
  259    HD2  LYS  36           HD2      LYS  36  20.806  17.401  21.430
  260    HD3  LYS  36           HD3      LYS  36  21.956  16.404  20.512
  261    HE2  LYS  36           HE2      LYS  36  21.000  14.370  21.520
  262    HE3  LYS  36           HE3      LYS  36  19.914  15.358  22.521
  263    HZ1  LYS  36           HZ1      LYS  36  18.780  14.513  20.479
  264    HZ2  LYS  36           HZ2      LYS  36  18.837  16.149  20.504
  265    HZ3  LYS  36           HZ3      LYS  36  19.862  15.322  19.543
  266    H    CYS  37           H        CYS  37  26.245  16.341  23.445
  267    HA   CYS  37           HA       CYS  37  28.044  18.692  23.287
  268    HB2  CYS  37           HB2      CYS  37  28.793  15.767  23.257
  269    HB3  CYS  37           HB3      CYS  37  29.897  17.138  23.198
  270    H    GLY  38           H        GLY  38  29.420  19.052  21.558
  271    HA2  GLY  38           HA2      GLY  38  28.155  18.546  18.901
  272    HA3  GLY  38           HA3      GLY  38  29.088  19.944  19.382
  273    H    VAL  39           H        VAL  39  31.007  20.067  18.609
  274    HA   VAL  39           HA       VAL  39  32.435  17.724  17.486
  275    HB   VAL  39           HB       VAL  39  33.728  19.496  16.205
  276   HG11  VAL  39          HG11      VAL  39  30.733  19.311  15.729
  277   HG12  VAL  39          HG12      VAL  39  31.986  19.703  14.530
  278   HG13  VAL  39          HG13      VAL  39  31.947  18.092  15.264
  279   HG21  VAL  39          HG21      VAL  39  33.194  21.454  17.612
  280   HG22  VAL  39          HG22      VAL  39  32.767  21.682  15.909
  281   HG23  VAL  39          HG23      VAL  39  31.494  21.353  17.092
  282    HA   PRO  40           HA       PRO  40  35.862  18.070  20.286
  283    HB2  PRO  40           HB2      PRO  40  38.019  17.511  18.637
  284    HB3  PRO  40           HB3      PRO  40  36.875  16.288  19.269
  285    HG2  PRO  40           HG2      PRO  40  36.875  17.659  16.570
  286    HG3  PRO  40           HG3      PRO  40  36.641  15.918  16.932
  287    HD2  PRO  40           HD2      PRO  40  34.543  17.566  16.461
  288    HD3  PRO  40           HD3      PRO  40  34.407  16.309  17.711
  289    H    ILE  41           H        ILE  41  37.235  19.672  21.053
  290    HA   ILE  41           HA       ILE  41  36.887  22.230  19.854
  291    HB   ILE  41           HB       ILE  41  38.234  23.124  21.665
  292   HG12  ILE  41          HG12      ILE  41  38.847  21.709  23.595
  293   HG13  ILE  41          HG13      ILE  41  38.544  20.273  22.619
  294   HG21  ILE  41          HG21      ILE  41  35.790  22.705  21.847
  295   HG22  ILE  41          HG22      ILE  41  36.126  21.122  22.580
  296   HG23  ILE  41          HG23      ILE  41  36.610  22.618  23.412
  297   HD11  ILE  41          HD11      ILE  41  40.449  20.695  21.237
  298   HD12  ILE  41          HD12      ILE  41  40.610  22.364  21.845
  299   HD13  ILE  41          HD13      ILE  41  40.975  20.978  22.897
  300    H    SER  42           H        SER  42  39.341  20.014  19.095
  301    HA   SER  42           HA       SER  42  41.033  22.063  17.946
  302    HB2  SER  42           HB2      SER  42  42.465  20.141  17.274
  303    HB3  SER  42           HB3      SER  42  42.125  20.178  19.020
  304    HG   SER  42           HG       SER  42  41.887  18.114  18.014
  305    H    TYR  43           H        TYR  43  38.318  21.210  17.139
  306    HA   TYR  43           HA       TYR  43  36.975  20.934  15.276
  307    HB2  TYR  43           HB2      TYR  43  38.682  23.304  14.510
  308    HB3  TYR  43           HB3      TYR  43  37.066  22.943  13.899
  309    HD1  TYR  43           HD1      TYR  43  35.108  22.793  15.598
  310    HD2  TYR  43           HD2      TYR  43  38.935  24.538  16.543
  311    HE1  TYR  43           HE1      TYR  43  34.090  23.994  17.520
  312    HE2  TYR  43           HE2      TYR  43  37.915  25.704  18.479
  313    HH   TYR  43           HH       TYR  43  34.451  25.422  19.323
  314    H    LEU  44           H        LEU  44  38.237  18.875  14.899
  315    HA   LEU  44           HA       LEU  44  39.960  18.555  12.637
  316    HB2  LEU  44           HB2      LEU  44  38.193  16.521  14.068
  317    HB3  LEU  44           HB3      LEU  44  39.566  16.147  13.039
  318    HG   LEU  44           HG       LEU  44  39.708  17.597  15.717
  319   HD11  LEU  44          HD11      LEU  44  40.524  14.776  14.911
  320   HD12  LEU  44          HD12      LEU  44  40.711  15.526  16.515
  321   HD13  LEU  44          HD13      LEU  44  39.090  15.211  15.880
  322   HD21  LEU  44          HD21      LEU  44  41.546  18.311  14.253
  323   HD22  LEU  44          HD22      LEU  44  42.159  17.220  15.499
  324   HD23  LEU  44          HD23      LEU  44  41.913  16.615  13.843
  Start of MODEL   13
    1    H1   ALA   1           H1       ALA   1  28.314  20.709  37.327
    2    H2   ALA   1           H2       ALA   1  27.985  19.176  37.805
    3    H3   ALA   1           H3       ALA   1  27.741  20.417  38.844
    4    HA   ALA   1           HA       ALA   1  26.042  21.340  37.422
    5    HB1  ALA   1           HB1      ALA   1  25.154  19.982  35.567
    6    HB2  ALA   1           HB2      ALA   1  26.857  20.388  35.296
    7    HB3  ALA   1           HB3      ALA   1  26.412  18.760  35.849
    8    H    LYS   2           H        LYS   2  23.695  20.449  37.466
    9    HA   LYS   2           HA       LYS   2  23.431  18.571  39.805
   10    HB2  LYS   2           HB2      LYS   2  23.560  21.009  40.409
   11    HB3  LYS   2           HB3      LYS   2  22.126  21.289  39.413
   12    HG2  LYS   2           HG2      LYS   2  20.845  19.703  40.910
   13    HG3  LYS   2           HG3      LYS   2  22.312  19.488  41.874
   14    HD2  LYS   2           HD2      LYS   2  20.931  21.087  42.998
   15    HD3  LYS   2           HD3      LYS   2  22.307  21.980  42.321
   16    HE2  LYS   2           HE2      LYS   2  20.862  22.652  40.369
   17    HE3  LYS   2           HE3      LYS   2  19.518  21.755  41.087
   18    HZ1  LYS   2           HZ1      LYS   2  19.347  24.065  41.666
   19    HZ2  LYS   2           HZ2      LYS   2  19.723  23.236  43.046
   20    HZ3  LYS   2           HZ3      LYS   2  20.859  24.127  42.273
   21    H    ASN   3           H        ASN   3  21.711  20.113  37.092
   22    HA   ASN   3           HA       ASN   3  19.837  17.838  36.876
   23    HB2  ASN   3           HB2      ASN   3  17.877  19.362  37.296
   24    HB3  ASN   3           HB3      ASN   3  18.820  18.998  38.732
   25   HD21  ASN   3          HD21      ASN   3  18.150  22.591  38.931
   26   HD22  ASN   3          HD22      ASN   3  17.234  21.091  39.169
   27    H    GLN   4           H        GLN   4  20.581  21.163  35.826
   28    HA   GLN   4           HA       GLN   4  19.370  20.549  33.154
   29    HB2  GLN   4           HB2      GLN   4  18.374  22.688  33.088
   30    HB3  GLN   4           HB3      GLN   4  17.980  21.999  34.659
   31    HG2  GLN   4           HG2      GLN   4  19.848  23.348  35.671
   32    HG3  GLN   4           HG3      GLN   4  20.138  24.081  34.090
   33   HE21  GLN   4          HE21      GLN   4  18.118  25.173  33.066
   34   HE22  GLN   4          HE22      GLN   4  17.212  26.160  34.224
   35    H    PHE   5           H        PHE   5  22.310  21.061  34.461
   36    HA   PHE   5           HA       PHE   5  24.319  21.790  33.768
   37    HB2  PHE   5           HB2      PHE   5  23.221  21.570  30.956
   38    HB3  PHE   5           HB3      PHE   5  24.912  21.592  31.460
   39    HD1  PHE   5           HD1      PHE   5  21.822  19.544  31.424
   40    HD2  PHE   5           HD2      PHE   5  26.038  19.651  32.277
   41    HE1  PHE   5           HE1      PHE   5  21.859  17.063  31.586
   42    HE2  PHE   5           HE2      PHE   5  26.055  17.187  32.436
   43    HZ   PHE   5           HZ       PHE   5  23.978  15.880  32.083
   44    H    GLY   6           H        GLY   6  22.259  23.876  34.326
   45    HA2  GLY   6           HA2      GLY   6  22.175  26.203  34.317
   46    HA3  GLY   6           HA3      GLY   6  23.634  26.236  33.328
   47    H    CYS   7           H        CYS   7  21.659  24.280  31.577
   48    HA   CYS   7           HA       CYS   7  20.939  26.391  29.702
   49    HB2  CYS   7           HB2      CYS   7  20.684  23.366  29.650
   50    HB3  CYS   7           HB3      CYS   7  20.181  24.407  28.343
   51    H    PHE   8           H        PHE   8  18.946  27.072  29.163
   52    HA   PHE   8           HA       PHE   8  16.594  25.416  29.694
   53    HB2  PHE   8           HB2      PHE   8  16.760  26.741  31.785
   54    HB3  PHE   8           HB3      PHE   8  16.735  28.218  30.848
   55    HD1  PHE   8           HD1      PHE   8  14.678  29.047  29.803
   56    HD2  PHE   8           HD2      PHE   8  14.736  25.378  32.075
   57    HE1  PHE   8           HE1      PHE   8  12.188  29.018  29.838
   58    HE2  PHE   8           HE2      PHE   8  12.253  25.361  32.112
   59    HZ   PHE   8           HZ       PHE   8  10.978  27.174  30.985
   60    H    ALA   9           H        ALA   9  15.018  25.713  28.154
   61    HA   ALA   9           HA       ALA   9  14.233  26.180  26.082
   62    HB1  ALA   9           HB1      ALA   9  13.175  27.880  27.486
   63    HB2  ALA   9           HB2      ALA   9  14.493  29.019  27.118
   64    HB3  ALA   9           HB3      ALA   9  13.408  28.457  25.830
   65    H    ASN  10           H        ASN  10  16.744  25.466  25.706
   66    HA   ASN  10           HA       ASN  10  18.487  25.448  24.276
   67    HB2  ASN  10           HB2      ASN  10  16.925  27.403  22.544
   68    HB3  ASN  10           HB3      ASN  10  18.177  26.301  22.004
   69   HD21  ASN  10          HD21      ASN  10  15.028  24.975  21.083
   70   HD22  ASN  10          HD22      ASN  10  15.692  26.587  20.907
   71    H    VAL  11           H        VAL  11  18.377  27.795  26.362
   72    HA   VAL  11           HA       VAL  11  20.750  29.237  25.256
   73    HB   VAL  11           HB       VAL  11  18.493  30.469  26.882
   74   HG11  VAL  11          HG11      VAL  11  20.596  31.634  27.351
   75   HG12  VAL  11          HG12      VAL  11  20.993  31.686  25.620
   76   HG13  VAL  11          HG13      VAL  11  19.639  32.630  26.264
   77   HG21  VAL  11          HG21      VAL  11  19.247  30.813  23.948
   78   HG22  VAL  11          HG22      VAL  11  17.758  30.076  24.569
   79   HG23  VAL  11          HG23      VAL  11  18.045  31.794  24.814
   80    H    ASP  12           H        ASP  12  22.328  29.837  26.626
   81    HA   ASP  12           HA       ASP  12  22.776  28.424  29.104
   82    HB2  ASP  12           HB2      ASP  12  24.965  29.359  28.983
   83    HB3  ASP  12           HB3      ASP  12  24.499  28.878  27.365
   84    H    VAL  13           H        VAL  13  20.466  29.960  29.458
   85    HA   VAL  13           HA       VAL  13  20.894  32.587  30.509
   86    HB   VAL  13           HB       VAL  13  18.568  32.099  31.674
   87   HG11  VAL  13          HG11      VAL  13  18.967  33.582  29.751
   88   HG12  VAL  13          HG12      VAL  13  18.835  32.179  28.666
   89   HG13  VAL  13          HG13      VAL  13  17.437  32.692  29.632
   90   HG21  VAL  13          HG21      VAL  13  17.222  30.435  30.651
   91   HG22  VAL  13          HG22      VAL  13  18.503  29.936  29.536
   92   HG23  VAL  13          HG23      VAL  13  18.656  29.604  31.281
   93    H    LYS  14           H        LYS  14  20.918  29.494  32.184
   94    HA   LYS  14           HA       LYS  14  21.414  30.919  34.787
   95    HB2  LYS  14           HB2      LYS  14  20.685  27.995  34.412
   96    HB3  LYS  14           HB3      LYS  14  20.782  28.888  35.921
   97    HG2  LYS  14           HG2      LYS  14  18.727  29.304  33.705
   98    HG3  LYS  14           HG3      LYS  14  18.467  28.502  35.253
   99    HD2  LYS  14           HD2      LYS  14  18.862  30.616  36.465
  100    HD3  LYS  14           HD3      LYS  14  19.243  31.438  34.951
  101    HE2  LYS  14           HE2      LYS  14  17.034  32.038  35.522
  102    HE3  LYS  14           HE3      LYS  14  16.943  30.987  34.106
  103    HZ1  LYS  14           HZ1      LYS  14  16.222  29.187  35.545
  104    HZ2  LYS  14           HZ2      LYS  14  16.494  30.116  36.903
  105    HZ3  LYS  14           HZ3      LYS  14  15.295  30.516  35.884
  106    H    GLY  15           H        GLY  15  23.052  28.924  32.442
  107    HA2  GLY  15           HA2      GLY  15  25.611  29.694  33.357
  108    HA3  GLY  15           HA3      GLY  15  25.277  28.103  34.045
  109    H    ASP  16           H        ASP  16  27.375  28.030  32.480
  110    HA   ASP  16           HA       ASP  16  26.551  27.309  29.726
  111    HB2  ASP  16           HB2      ASP  16  28.671  27.511  29.028
  112    HB3  ASP  16           HB3      ASP  16  28.773  28.608  30.396
  113    H    CYS  17           H        CYS  17  27.083  25.297  28.782
  114    HA   CYS  17           HA       CYS  17  27.500  23.036  30.691
  115    HB2  CYS  17           HB2      CYS  17  25.982  21.760  29.643
  116    HB3  CYS  17           HB3      CYS  17  25.187  23.328  29.635
  117    H    LYS  18           H        LYS  18  28.908  24.765  28.183
  118    HA   LYS  18           HA       LYS  18  30.165  22.670  26.693
  119    HB2  LYS  18           HB2      LYS  18  29.984  25.061  25.999
  120    HB3  LYS  18           HB3      LYS  18  31.227  25.477  27.177
  121    HG2  LYS  18           HG2      LYS  18  31.869  23.227  25.297
  122    HG3  LYS  18           HG3      LYS  18  31.687  24.796  24.538
  123    HD2  LYS  18           HD2      LYS  18  33.479  24.373  26.955
  124    HD3  LYS  18           HD3      LYS  18  34.044  24.018  25.329
  125    HE2  LYS  18           HE2      LYS  18  33.016  26.738  26.272
  126    HE3  LYS  18           HE3      LYS  18  34.712  26.267  26.124
  127    HZ1  LYS  18           HZ1      LYS  18  32.785  26.576  23.908
  128    HZ2  LYS  18           HZ2      LYS  18  34.152  27.425  24.188
  129    HZ3  LYS  18           HZ3      LYS  18  34.216  25.825  23.710
  130    H    ARG  19           H        ARG  19  31.128  24.122  29.822
  131    HA   ARG  19           HA       ARG  19  33.609  22.699  30.053
  132    HB2  ARG  19           HB2      ARG  19  31.633  23.773  32.077
  133    HB3  ARG  19           HB3      ARG  19  33.004  22.780  32.602
  134    HG2  ARG  19           HG2      ARG  19  34.595  24.269  31.507
  135    HG3  ARG  19           HG3      ARG  19  33.287  25.283  30.890
  136    HD2  ARG  19           HD2      ARG  19  33.667  24.829  33.871
  137    HD3  ARG  19           HD3      ARG  19  34.595  26.050  32.979
  138    HE   ARG  19           HE       ARG  19  31.780  26.324  32.406
  139   HH11  ARG  19          HH11      ARG  19  33.957  27.126  35.075
  140   HH12  ARG  19          HH12      ARG  19  33.057  28.594  35.397
  141   HH21  ARG  19          HH21      ARG  19  30.704  27.970  32.994
  142   HH22  ARG  19          HH22      ARG  19  31.212  29.044  34.296
  143    H    HIS  20           H        HIS  20  30.329  21.417  30.694
  144    HA   HIS  20           HA       HIS  20  31.241  18.834  31.626
  145    HB2  HIS  20           HB2      HIS  20  29.058  19.294  32.228
  146    HB3  HIS  20           HB3      HIS  20  28.632  20.009  30.691
  147    HD2  HIS  20           HD2      HIS  20  27.627  18.518  28.819
  148    HE1  HIS  20           HE1      HIS  20  27.624  14.814  30.921
  149    HE2  HIS  20           HE2      HIS  20  26.814  16.018  28.815
  150    H    CYS  21           H        CYS  21  30.494  20.001  28.313
  151    HA   CYS  21           HA       CYS  21  31.227  17.455  27.040
  152    HB2  CYS  21           HB2      CYS  21  30.826  20.275  26.045
  153    HB3  CYS  21           HB3      CYS  21  31.244  18.952  24.986
  154    H    LYS  22           H        LYS  22  33.086  20.416  27.887
  155    HA   LYS  22           HA       LYS  22  35.432  19.698  26.450
  156    HB2  LYS  22           HB2      LYS  22  34.862  21.954  27.361
  157    HB3  LYS  22           HB3      LYS  22  35.283  21.378  28.983
  158    HG2  LYS  22           HG2      LYS  22  37.607  21.014  28.289
  159    HG3  LYS  22           HG3      LYS  22  37.187  21.309  26.599
  160    HD2  LYS  22           HD2      LYS  22  38.294  23.265  27.429
  161    HD3  LYS  22           HD3      LYS  22  36.589  23.669  27.175
  162    HE2  LYS  22           HE2      LYS  22  36.209  23.261  29.653
  163    HE3  LYS  22           HE3      LYS  22  37.949  23.018  29.835
  164    HZ1  LYS  22           HZ1      LYS  22  37.319  25.276  30.363
  165    HZ2  LYS  22           HZ2      LYS  22  38.280  25.312  29.053
  166    HZ3  LYS  22           HZ3      LYS  22  36.638  25.513  28.892
  167    H    ALA  23           H        ALA  23  34.314  18.624  29.609
  168    HA   ALA  23           HA       ALA  23  36.690  17.189  30.362
  169    HB1  ALA  23           HB1      ALA  23  35.235  16.143  31.987
  170    HB2  ALA  23           HB2      ALA  23  34.840  17.868  31.888
  171    HB3  ALA  23           HB3      ALA  23  33.783  16.670  31.101
  172    H    GLU  24           H        GLU  24  34.599  16.593  27.746
  173    HA   GLU  24           HA       GLU  24  35.694  13.847  27.360
  174    HB2  GLU  24           HB2      GLU  24  33.059  14.971  26.332
  175    HB3  GLU  24           HB3      GLU  24  33.703  13.350  26.035
  176    HG2  GLU  24           HG2      GLU  24  33.652  12.895  28.481
  177    HG3  GLU  24           HG3      GLU  24  32.941  14.486  28.750
  178    H    ASP  25           H        ASP  25  36.673  16.655  26.653
  179    HA   ASP  25           HA       ASP  25  37.781  17.691  25.006
  180    HB2  ASP  25           HB2      ASP  25  38.698  15.224  25.022
  181    HB3  ASP  25           HB3      ASP  25  37.989  15.139  23.415
  182    H    LYS  26           H        LYS  26  34.901  17.677  24.836
  183    HA   LYS  26           HA       LYS  26  34.327  18.191  21.942
  184    HB2  LYS  26           HB2      LYS  26  32.768  16.951  24.243
  185    HB3  LYS  26           HB3      LYS  26  31.917  17.726  22.937
  186    HG2  LYS  26           HG2      LYS  26  33.931  15.559  22.297
  187    HG3  LYS  26           HG3      LYS  26  32.325  15.140  22.918
  188    HD2  LYS  26           HD2      LYS  26  31.252  16.459  21.126
  189    HD3  LYS  26           HD3      LYS  26  32.846  16.880  20.492
  190    HE2  LYS  26           HE2      LYS  26  32.395  15.158  19.093
  191    HE3  LYS  26           HE3      LYS  26  33.176  14.247  20.387
  192    HZ1  LYS  26           HZ1      LYS  26  30.921  13.652  21.184
  193    HZ2  LYS  26           HZ2      LYS  26  30.239  14.556  19.998
  194    HZ3  LYS  26           HZ3      LYS  26  31.058  13.242  19.591
  195    H    GLU  27           H        GLU  27  32.972  19.939  21.421
  196    HA   GLU  27           HA       GLU  27  32.677  22.149  23.328
  197    HB2  GLU  27           HB2      GLU  27  31.719  21.663  20.485
  198    HB3  GLU  27           HB3      GLU  27  31.387  23.140  21.382
  199    HG2  GLU  27           HG2      GLU  27  34.247  22.190  20.944
  200    HG3  GLU  27           HG3      GLU  27  33.364  23.099  19.722
  201    H    GLY  28           H        GLY  28  30.529  22.932  23.885
  202    HA2  GLY  28           HA2      GLY  28  28.275  20.970  23.784
  203    HA3  GLY  28           HA3      GLY  28  28.774  21.626  25.331
  204    H    ILE  29           H        ILE  29  26.202  21.733  23.846
  205    HA   ILE  29           HA       ILE  29  25.654  24.631  23.919
  206    HB   ILE  29           HB       ILE  29  26.393  24.131  21.681
  207   HG12  ILE  29          HG12      ILE  29  24.420  25.727  22.238
  208   HG13  ILE  29          HG13      ILE  29  24.923  25.423  20.585
  209   HG21  ILE  29          HG21      ILE  29  25.121  22.718  20.103
  210   HG22  ILE  29          HG22      ILE  29  25.957  21.812  21.360
  211   HG23  ILE  29          HG23      ILE  29  24.203  22.055  21.474
  212   HD11  ILE  29          HD11      ILE  29  22.436  25.471  20.927
  213   HD12  ILE  29          HD12      ILE  29  23.049  24.011  20.134
  214   HD13  ILE  29          HD13      ILE  29  22.584  23.955  21.839
  215    H    CYS  30           H        CYS  30  23.463  25.149  24.263
  216    HA   CYS  30           HA       CYS  30  22.103  23.156  25.855
  217    HB2  CYS  30           HB2      CYS  30  21.337  25.985  25.081
  218    HB3  CYS  30           HB3      CYS  30  20.493  24.985  26.269
  219    H    HIS  31           H        HIS  31  20.808  21.626  25.133
  220    HA   HIS  31           HA       HIS  31  18.786  22.205  22.991
  221    HB2  HIS  31           HB2      HIS  31  20.162  19.634  23.789
  222    HB3  HIS  31           HB3      HIS  31  18.576  19.643  23.027
  223    HD2  HIS  31           HD2      HIS  31  21.813  21.658  22.115
  224    HE1  HIS  31           HE1      HIS  31  20.371  19.800  18.575
  225    HE2  HIS  31           HE2      HIS  31  22.141  21.327  19.513
  226    H    GLY  32           H        GLY  32  17.132  23.028  24.028
  227    HA2  GLY  32           HA2      GLY  32  15.302  23.194  25.413
  228    HA3  GLY  32           HA3      GLY  32  15.511  21.487  25.810
  229    H    THR  33           H        THR  33  15.937  21.077  27.872
  230    HA   THR  33           HA       THR  33  17.234  23.113  29.635
  231    HB   THR  33           HB       THR  33  16.127  22.039  31.512
  232    HG1  THR  33           HG1      THR  33  14.323  20.548  30.540
  233   HG21  THR  33          HG21      THR  33  14.040  22.502  29.344
  234   HG22  THR  33          HG22      THR  33  13.870  22.729  31.101
  235   HG23  THR  33          HG23      THR  33  14.912  23.812  30.164
  236    H    LYS  34           H        LYS  34  18.509  21.115  27.790
  237    HA   LYS  34           HA       LYS  34  20.343  19.767  29.705
  238    HB2  LYS  34           HB2      LYS  34  18.879  18.485  27.342
  239    HB3  LYS  34           HB3      LYS  34  20.157  17.701  28.240
  240    HG2  LYS  34           HG2      LYS  34  17.471  18.532  29.360
  241    HG3  LYS  34           HG3      LYS  34  17.939  16.902  28.918
  242    HD2  LYS  34           HD2      LYS  34  19.514  16.700  30.688
  243    HD3  LYS  34           HD3      LYS  34  19.509  18.425  31.045
  244    HE2  LYS  34           HE2      LYS  34  17.223  16.508  31.565
  245    HE3  LYS  34           HE3      LYS  34  18.326  17.231  32.750
  246    HZ1  LYS  34           HZ1      LYS  34  17.448  19.439  31.828
  247    HZ2  LYS  34           HZ2      LYS  34  16.229  18.581  31.156
  248    HZ3  LYS  34           HZ3      LYS  34  16.427  18.599  32.803
  249    H    CYS  35           H        CYS  35  22.191  18.677  28.455
  250    HA   CYS  35           HA       CYS  35  23.306  20.759  26.615
  251    HB2  CYS  35           HB2      CYS  35  24.343  20.506  28.896
  252    HB3  CYS  35           HB3      CYS  35  24.851  18.887  28.422
  253    H    LYS  36           H        LYS  36  24.096  20.201  24.679
  254    HA   LYS  36           HA       LYS  36  24.233  17.347  23.865
  255    HB2  LYS  36           HB2      LYS  36  22.278  18.844  22.999
  256    HB3  LYS  36           HB3      LYS  36  23.519  19.788  22.179
  257    HG2  LYS  36           HG2      LYS  36  22.709  18.298  20.554
  258    HG3  LYS  36           HG3      LYS  36  24.256  17.606  21.077
  259    HD2  LYS  36           HD2      LYS  36  22.516  16.379  22.834
  260    HD3  LYS  36           HD3      LYS  36  21.447  16.617  21.464
  261    HE2  LYS  36           HE2      LYS  36  23.130  15.497  19.985
  262    HE3  LYS  36           HE3      LYS  36  24.180  15.280  21.395
  263    HZ1  LYS  36           HZ1      LYS  36  22.942  13.281  20.992
  264    HZ2  LYS  36           HZ2      LYS  36  22.370  13.930  22.402
  265    HZ3  LYS  36           HZ3      LYS  36  21.497  14.061  21.013
  266    H    CYS  37           H        CYS  37  26.197  16.818  23.185
  267    HA   CYS  37           HA       CYS  37  28.252  18.910  23.019
  268    HB2  CYS  37           HB2      CYS  37  28.605  15.927  22.837
  269    HB3  CYS  37           HB3      CYS  37  29.875  17.131  22.912
  270    H    GLY  38           H        GLY  38  29.591  19.374  21.365
  271    HA2  GLY  38           HA2      GLY  38  28.474  19.030  18.619
  272    HA3  GLY  38           HA3      GLY  38  29.359  20.422  19.243
  273    H    VAL  39           H        VAL  39  31.223  20.613  18.180
  274    HA   VAL  39           HA       VAL  39  32.676  18.315  17.141
  275    HB   VAL  39           HB       VAL  39  34.200  20.025  16.154
  276   HG11  VAL  39          HG11      VAL  39  31.257  20.490  15.553
  277   HG12  VAL  39          HG12      VAL  39  32.646  20.816  14.488
  278   HG13  VAL  39          HG13      VAL  39  32.251  19.152  14.936
  279   HG21  VAL  39          HG21      VAL  39  32.274  22.089  17.279
  280   HG22  VAL  39          HG22      VAL  39  33.950  21.825  17.813
  281   HG23  VAL  39          HG23      VAL  39  33.622  22.375  16.167
  282    HA   PRO  40           HA       PRO  40  36.018  17.926  20.084
  283    HB2  PRO  40           HB2      PRO  40  37.764  18.454  17.670
  284    HB3  PRO  40           HB3      PRO  40  37.966  17.216  18.938
  285    HG2  PRO  40           HG2      PRO  40  36.905  16.578  16.511
  286    HG3  PRO  40           HG3      PRO  40  36.229  15.879  18.016
  287    HD2  PRO  40           HD2      PRO  40  35.099  18.110  16.323
  288    HD3  PRO  40           HD3      PRO  40  34.276  16.842  17.262
  289    H    ILE  41           H        ILE  41  37.502  19.274  21.259
  290    HA   ILE  41           HA       ILE  41  37.190  22.120  20.787
  291    HB   ILE  41           HB       ILE  41  38.411  22.391  22.918
  292   HG12  ILE  41          HG12      ILE  41  38.616  20.434  24.418
  293   HG13  ILE  41          HG13      ILE  41  38.295  19.357  23.057
  294   HG21  ILE  41          HG21      ILE  41  35.933  22.230  22.714
  295   HG22  ILE  41          HG22      ILE  41  36.044  20.478  22.975
  296   HG23  ILE  41          HG23      ILE  41  36.520  21.609  24.258
  297   HD11  ILE  41          HD11      ILE  41  40.655  21.272  23.083
  298   HD12  ILE  41          HD12      ILE  41  40.710  19.644  23.786
  299   HD13  ILE  41          HD13      ILE  41  40.406  19.827  22.061
  300    H    SER  42           H        SER  42  39.504  20.084  19.644
  301    HA   SER  42           HA       SER  42  41.999  21.099  20.024
  302    HB2  SER  42           HB2      SER  42  41.684  19.088  18.822
  303    HB3  SER  42           HB3      SER  42  40.786  19.894  17.525
  304    HG   SER  42           HG       SER  42  42.976  19.376  17.013
  305    H    TYR  43           H        TYR  43  43.223  22.791  19.551
  306    HA   TYR  43           HA       TYR  43  42.589  24.674  17.353
  307    HB2  TYR  43           HB2      TYR  43  42.451  26.562  18.710
  308    HB3  TYR  43           HB3      TYR  43  41.324  25.392  19.370
  309    HD1  TYR  43           HD1      TYR  43  44.257  27.439  20.003
  310    HD2  TYR  43           HD2      TYR  43  41.995  24.060  21.444
  311    HE1  TYR  43           HE1      TYR  43  45.415  27.588  22.167
  312    HE2  TYR  43           HE2      TYR  43  43.159  24.204  23.614
  313    HH   TYR  43           HH       TYR  43  44.633  25.424  24.927
  314    H    LEU  44           H        LEU  44  44.352  26.579  17.517
  315    HA   LEU  44           HA       LEU  44  46.983  25.588  18.401
  316    HB2  LEU  44           HB2      LEU  44  48.073  26.239  16.320
  317    HB3  LEU  44           HB3      LEU  44  47.034  24.848  16.134
  318    HG   LEU  44           HG       LEU  44  46.124  27.621  15.315
  319   HD11  LEU  44          HD11      LEU  44  46.973  27.078  13.043
  320   HD12  LEU  44          HD12      LEU  44  48.277  27.244  14.222
  321   HD13  LEU  44          HD13      LEU  44  47.766  25.626  13.695
  322   HD21  LEU  44          HD21      LEU  44  45.459  24.845  14.215
  323   HD22  LEU  44          HD22      LEU  44  44.404  25.789  15.282
  324   HD23  LEU  44          HD23      LEU  44  44.770  26.385  13.672
  Start of MODEL   14
    1    H1   ALA   1           H1       ALA   1  21.143  22.917  40.274
    2    H2   ALA   1           H2       ALA   1  20.389  24.364  40.406
    3    H3   ALA   1           H3       ALA   1  21.985  24.292  40.033
    4    HA   ALA   1           HA       ALA   1  19.824  23.287  38.325
    5    HB1  ALA   1           HB1      ALA   1  19.786  25.760  38.529
    6    HB2  ALA   1           HB2      ALA   1  21.476  25.830  38.004
    7    HB3  ALA   1           HB3      ALA   1  20.222  25.237  36.893
    8    H    LYS   2           H        LYS   2  21.489  21.335  38.603
    9    HA   LYS   2           HA       LYS   2  23.802  21.477  36.714
   10    HB2  LYS   2           HB2      LYS   2  24.444  21.122  39.000
   11    HB3  LYS   2           HB3      LYS   2  23.188  19.903  39.251
   12    HG2  LYS   2           HG2      LYS   2  24.322  18.370  37.653
   13    HG3  LYS   2           HG3      LYS   2  25.608  19.569  37.429
   14    HD2  LYS   2           HD2      LYS   2  24.829  18.224  40.062
   15    HD3  LYS   2           HD3      LYS   2  26.188  17.762  39.025
   16    HE2  LYS   2           HE2      LYS   2  27.099  20.109  39.291
   17    HE3  LYS   2           HE3      LYS   2  25.784  20.435  40.439
   18    HZ1  LYS   2           HZ1      LYS   2  26.640  18.674  41.836
   19    HZ2  LYS   2           HZ2      LYS   2  27.844  18.309  40.765
   20    HZ3  LYS   2           HZ3      LYS   2  27.839  19.754  41.573
   21    H    ASN   3           H        ASN   3  20.966  19.588  37.744
   22    HA   ASN   3           HA       ASN   3  21.323  17.418  35.896
   23    HB2  ASN   3           HB2      ASN   3  18.876  18.475  37.377
   24    HB3  ASN   3           HB3      ASN   3  18.916  16.957  36.491
   25   HD21  ASN   3          HD21      ASN   3  21.057  15.382  38.979
   26   HD22  ASN   3          HD22      ASN   3  20.741  15.393  37.243
   27    H    GLN   4           H        GLN   4  19.820  20.643  35.577
   28    HA   GLN   4           HA       GLN   4  18.985  20.165  32.788
   29    HB2  GLN   4           HB2      GLN   4  18.066  22.215  32.826
   30    HB3  GLN   4           HB3      GLN   4  17.774  21.575  34.438
   31    HG2  GLN   4           HG2      GLN   4  19.760  23.006  35.240
   32    HG3  GLN   4           HG3      GLN   4  19.705  23.763  33.622
   33   HE21  GLN   4          HE21      GLN   4  16.302  24.743  34.037
   34   HE22  GLN   4          HE22      GLN   4  17.534  24.421  32.832
   35    H    PHE   5           H        PHE   5  21.992  20.500  34.193
   36    HA   PHE   5           HA       PHE   5  24.028  21.241  33.606
   37    HB2  PHE   5           HB2      PHE   5  22.956  21.189  30.780
   38    HB3  PHE   5           HB3      PHE   5  24.657  21.375  31.215
   39    HD1  PHE   5           HD1      PHE   5  21.909  18.973  30.863
   40    HD2  PHE   5           HD2      PHE   5  25.936  19.570  32.271
   41    HE1  PHE   5           HE1      PHE   5  22.297  16.510  30.833
   42    HE2  PHE   5           HE2      PHE   5  26.275  17.119  32.326
   43    HZ   PHE   5           HZ       PHE   5  24.476  15.590  31.576
   44    H    GLY   6           H        GLY   6  21.851  23.235  34.179
   45    HA2  GLY   6           HA2      GLY   6  21.746  25.555  34.416
   46    HA3  GLY   6           HA3      GLY   6  23.310  25.666  33.530
   47    H    CYS   7           H        CYS   7  21.341  23.891  31.507
   48    HA   CYS   7           HA       CYS   7  20.867  26.157  29.745
   49    HB2  CYS   7           HB2      CYS   7  20.318  23.173  29.466
   50    HB3  CYS   7           HB3      CYS   7  19.993  24.349  28.229
   51    H    PHE   8           H        PHE   8  19.010  27.134  29.355
   52    HA   PHE   8           HA       PHE   8  16.467  25.662  29.523
   53    HB2  PHE   8           HB2      PHE   8  16.647  26.727  31.759
   54    HB3  PHE   8           HB3      PHE   8  16.795  28.300  30.997
   55    HD1  PHE   8           HD1      PHE   8  14.884  29.431  30.021
   56    HD2  PHE   8           HD2      PHE   8  14.520  25.472  31.686
   57    HE1  PHE   8           HE1      PHE   8  12.406  29.520  29.730
   58    HE2  PHE   8           HE2      PHE   8  12.058  25.575  31.408
   59    HZ   PHE   8           HZ       PHE   8  11.001  27.575  30.398
   60    H    ALA   9           H        ALA   9  15.126  26.161  27.866
   61    HA   ALA   9           HA       ALA   9  14.541  26.851  25.810
   62    HB1  ALA   9           HB1      ALA   9  14.796  29.565  27.135
   63    HB2  ALA   9           HB2      ALA   9  13.851  29.199  25.674
   64    HB3  ALA   9           HB3      ALA   9  13.401  28.464  27.225
   65    H    ASN  10           H        ASN  10  16.937  25.997  25.502
   66    HA   ASN  10           HA       ASN  10  18.837  25.946  24.318
   67    HB2  ASN  10           HB2      ASN  10  17.431  28.021  22.603
   68    HB3  ASN  10           HB3      ASN  10  18.919  27.223  22.131
   69   HD21  ASN  10          HD21      ASN  10  16.269  25.521  20.587
   70   HD22  ASN  10          HD22      ASN  10  16.476  27.245  20.807
   71    H    VAL  11           H        VAL  11  18.626  28.190  26.544
   72    HA   VAL  11           HA       VAL  11  21.252  29.434  25.818
   73    HB   VAL  11           HB       VAL  11  18.941  30.711  27.316
   74   HG11  VAL  11          HG11      VAL  11  21.643  31.875  26.478
   75   HG12  VAL  11          HG12      VAL  11  20.294  32.765  27.188
   76   HG13  VAL  11          HG13      VAL  11  21.124  31.554  28.149
   77   HG21  VAL  11          HG21      VAL  11  20.126  31.324  24.561
   78   HG22  VAL  11          HG22      VAL  11  18.523  30.631  24.866
   79   HG23  VAL  11          HG23      VAL  11  18.871  32.276  25.386
   80    H    ASP  12           H        ASP  12  22.799  29.610  27.363
   81    HA   ASP  12           HA       ASP  12  22.706  27.853  29.665
   82    HB2  ASP  12           HB2      ASP  12  25.021  28.564  30.008
   83    HB3  ASP  12           HB3      ASP  12  24.717  28.048  28.364
   84    H    VAL  13           H        VAL  13  20.678  29.892  29.932
   85    HA   VAL  13           HA       VAL  13  21.391  32.194  31.390
   86    HB   VAL  13           HB       VAL  13  18.951  31.927  32.383
   87   HG11  VAL  13          HG11      VAL  13  18.028  32.868  30.388
   88   HG12  VAL  13          HG12      VAL  13  19.681  33.482  30.593
   89   HG13  VAL  13          HG13      VAL  13  19.346  32.196  29.412
   90   HG21  VAL  13          HG21      VAL  13  18.724  29.966  30.090
   91   HG22  VAL  13          HG22      VAL  13  18.730  29.494  31.808
   92   HG23  VAL  13          HG23      VAL  13  17.450  30.552  31.172
   93    H    LYS  14           H        LYS  14  20.932  28.966  32.690
   94    HA   LYS  14           HA       LYS  14  21.513  30.015  35.448
   95    HB2  LYS  14           HB2      LYS  14  20.147  27.444  34.574
   96    HB3  LYS  14           HB3      LYS  14  20.576  27.843  36.237
   97    HG2  LYS  14           HG2      LYS  14  18.639  29.419  34.481
   98    HG3  LYS  14           HG3      LYS  14  18.235  28.323  35.798
   99    HD2  LYS  14           HD2      LYS  14  19.638  29.847  37.325
  100    HD3  LYS  14           HD3      LYS  14  19.644  31.021  35.994
  101    HE2  LYS  14           HE2      LYS  14  17.190  31.101  36.006
  102    HE3  LYS  14           HE3      LYS  14  17.147  29.850  37.262
  103    HZ1  LYS  14           HZ1      LYS  14  18.409  31.401  38.702
  104    HZ2  LYS  14           HZ2      LYS  14  18.217  32.608  37.584
  105    HZ3  LYS  14           HZ3      LYS  14  16.916  31.958  38.322
  106    H    GLY  15           H        GLY  15  23.175  28.454  32.927
  107    HA2  GLY  15           HA2      GLY  15  25.587  28.710  34.269
  108    HA3  GLY  15           HA3      GLY  15  25.100  27.061  34.645
  109    H    ASP  16           H        ASP  16  27.417  28.001  33.150
  110    HA   ASP  16           HA       ASP  16  27.020  27.672  30.357
  111    HB2  ASP  16           HB2      ASP  16  29.378  27.880  30.111
  112    HB3  ASP  16           HB3      ASP  16  28.751  29.070  31.246
  113    H    CYS  17           H        CYS  17  26.422  25.965  29.412
  114    HA   CYS  17           HA       CYS  17  26.932  23.228  30.166
  115    HB2  CYS  17           HB2      CYS  17  24.976  23.372  29.080
  116    HB3  CYS  17           HB3      CYS  17  25.425  24.811  28.192
  117    H    LYS  18           H        LYS  18  28.624  25.476  27.948
  118    HA   LYS  18           HA       LYS  18  30.047  23.540  26.478
  119    HB2  LYS  18           HB2      LYS  18  29.932  25.992  26.051
  120    HB3  LYS  18           HB3      LYS  18  31.138  26.264  27.309
  121    HG2  LYS  18           HG2      LYS  18  31.695  24.247  25.105
  122    HG3  LYS  18           HG3      LYS  18  31.755  25.949  24.705
  123    HD2  LYS  18           HD2      LYS  18  33.362  24.902  27.040
  124    HD3  LYS  18           HD3      LYS  18  33.944  24.729  25.391
  125    HE2  LYS  18           HE2      LYS  18  33.569  27.242  25.096
  126    HE3  LYS  18           HE3      LYS  18  33.289  27.333  26.843
  127    HZ1  LYS  18           HZ1      LYS  18  35.637  27.775  26.185
  128    HZ2  LYS  18           HZ2      LYS  18  35.497  26.480  27.201
  129    HZ3  LYS  18           HZ3      LYS  18  35.754  26.269  25.573
  130    H    ARG  19           H        ARG  19  30.803  24.661  29.819
  131    HA   ARG  19           HA       ARG  19  33.311  23.362  30.036
  132    HB2  ARG  19           HB2      ARG  19  31.416  24.658  31.852
  133    HB3  ARG  19           HB3      ARG  19  32.083  23.201  32.592
  134    HG2  ARG  19           HG2      ARG  19  34.399  24.004  31.909
  135    HG3  ARG  19           HG3      ARG  19  33.659  25.550  31.476
  136    HD2  ARG  19           HD2      ARG  19  33.578  24.221  34.217
  137    HD3  ARG  19           HD3      ARG  19  34.660  25.529  33.719
  138    HE   ARG  19           HE       ARG  19  32.053  26.470  33.231
  139   HH11  ARG  19          HH11      ARG  19  34.033  25.646  36.060
  140   HH12  ARG  19          HH12      ARG  19  33.088  26.685  37.096
  141   HH21  ARG  19          HH21      ARG  19  30.942  27.705  34.601
  142   HH22  ARG  19          HH22      ARG  19  31.450  27.938  36.272
  143    H    HIS  20           H        HIS  20  30.083  21.923  30.457
  144    HA   HIS  20           HA       HIS  20  30.978  19.383  31.491
  145    HB2  HIS  20           HB2      HIS  20  28.680  19.950  31.746
  146    HB3  HIS  20           HB3      HIS  20  28.481  20.313  30.036
  147    HD2  HIS  20           HD2      HIS  20  27.490  18.490  28.568
  148    HE1  HIS  20           HE1      HIS  20  28.276  15.070  30.976
  149    HE2  HIS  20           HE2      HIS  20  27.171  15.885  28.833
  150    H    CYS  21           H        CYS  21  30.491  20.559  28.152
  151    HA   CYS  21           HA       CYS  21  31.397  18.041  26.986
  152    HB2  CYS  21           HB2      CYS  21  30.900  20.781  25.796
  153    HB3  CYS  21           HB3      CYS  21  31.211  19.337  24.856
  154    H    LYS  22           H        LYS  22  32.981  21.168  27.733
  155    HA   LYS  22           HA       LYS  22  35.485  20.643  26.511
  156    HB2  LYS  22           HB2      LYS  22  34.667  22.837  27.484
  157    HB3  LYS  22           HB3      LYS  22  34.926  22.163  29.089
  158    HG2  LYS  22           HG2      LYS  22  36.743  23.575  28.650
  159    HG3  LYS  22           HG3      LYS  22  37.383  21.947  28.553
  160    HD2  LYS  22           HD2      LYS  22  36.452  23.379  26.051
  161    HD3  LYS  22           HD3      LYS  22  38.002  23.827  26.750
  162    HE2  LYS  22           HE2      LYS  22  37.379  20.929  26.171
  163    HE3  LYS  22           HE3      LYS  22  37.855  22.023  24.862
  164    HZ1  LYS  22           HZ1      LYS  22  39.678  20.712  26.127
  165    HZ2  LYS  22           HZ2      LYS  22  39.956  22.309  25.781
  166    HZ3  LYS  22           HZ3      LYS  22  39.521  21.869  27.289
  167    H    ALA  23           H        ALA  23  34.167  19.518  29.620
  168    HA   ALA  23           HA       ALA  23  36.555  18.254  30.593
  169    HB1  ALA  23           HB1      ALA  23  33.628  17.615  31.143
  170    HB2  ALA  23           HB2      ALA  23  35.023  17.138  32.134
  171    HB3  ALA  23           HB3      ALA  23  34.594  18.851  31.986
  172    H    GLU  24           H        GLU  24  34.598  17.378  27.893
  173    HA   GLU  24           HA       GLU  24  35.973  14.736  27.734
  174    HB2  GLU  24           HB2      GLU  24  33.365  15.582  26.412
  175    HB3  GLU  24           HB3      GLU  24  34.189  14.026  26.223
  176    HG2  GLU  24           HG2      GLU  24  33.958  13.635  28.682
  177    HG3  GLU  24           HG3      GLU  24  33.029  15.132  28.783
  178    H    ASP  25           H        ASP  25  36.663  17.669  26.903
  179    HA   ASP  25           HA       ASP  25  37.417  18.905  25.193
  180    HB2  ASP  25           HB2      ASP  25  38.673  16.266  24.438
  181    HB3  ASP  25           HB3      ASP  25  39.125  17.820  23.734
  182    H    LYS  26           H        LYS  26  34.856  18.456  24.833
  183    HA   LYS  26           HA       LYS  26  34.434  18.263  21.874
  184    HB2  LYS  26           HB2      LYS  26  32.747  17.427  24.265
  185    HB3  LYS  26           HB3      LYS  26  32.040  17.676  22.688
  186    HG2  LYS  26           HG2      LYS  26  34.421  15.861  22.654
  187    HG3  LYS  26           HG3      LYS  26  33.059  15.290  23.633
  188    HD2  LYS  26           HD2      LYS  26  31.521  15.642  21.751
  189    HD3  LYS  26           HD3      LYS  26  32.872  16.220  20.755
  190    HE2  LYS  26           HE2      LYS  26  33.865  14.027  20.695
  191    HE3  LYS  26           HE3      LYS  26  32.745  13.415  21.921
  192    HZ1  LYS  26           HZ1      LYS  26  30.924  13.676  20.375
  193    HZ2  LYS  26           HZ2      LYS  26  31.825  14.428  19.270
  194    HZ3  LYS  26           HZ3      LYS  26  32.077  12.842  19.582
  195    H    GLU  27           H        GLU  27  32.711  19.563  21.010
  196    HA   GLU  27           HA       GLU  27  32.388  22.225  22.206
  197    HB2  GLU  27           HB2      GLU  27  31.218  20.891  19.754
  198    HB3  GLU  27           HB3      GLU  27  30.895  22.560  20.214
  199    HG2  GLU  27           HG2      GLU  27  33.727  21.528  19.742
  200    HG3  GLU  27           HG3      GLU  27  32.698  22.129  18.450
  201    H    GLY  28           H        GLY  28  30.484  23.040  23.085
  202    HA2  GLY  28           HA2      GLY  28  28.301  21.089  23.742
  203    HA3  GLY  28           HA3      GLY  28  29.030  22.076  25.001
  204    H    ILE  29           H        ILE  29  26.247  21.797  23.755
  205    HA   ILE  29           HA       ILE  29  25.575  24.648  23.498
  206    HB   ILE  29           HB       ILE  29  26.220  24.035  21.298
  207   HG12  ILE  29          HG12      ILE  29  24.086  25.424  21.767
  208   HG13  ILE  29          HG13      ILE  29  24.579  25.009  20.138
  209   HG21  ILE  29          HG21      ILE  29  26.079  21.686  21.258
  210   HG22  ILE  29          HG22      ILE  29  24.308  21.702  21.389
  211   HG23  ILE  29          HG23      ILE  29  25.115  22.322  19.926
  212   HD11  ILE  29          HD11      ILE  29  22.476  23.437  21.659
  213   HD12  ILE  29          HD12      ILE  29  22.119  24.805  20.583
  214   HD13  ILE  29          HD13      ILE  29  22.869  23.336  19.932
  215    H    CYS  30           H        CYS  30  23.491  25.123  24.107
  216    HA   CYS  30           HA       CYS  30  22.141  23.065  25.653
  217    HB2  CYS  30           HB2      CYS  30  21.488  25.958  25.094
  218    HB3  CYS  30           HB3      CYS  30  20.526  24.905  26.149
  219    H    HIS  31           H        HIS  31  20.793  21.632  24.866
  220    HA   HIS  31           HA       HIS  31  18.926  22.259  22.605
  221    HB2  HIS  31           HB2      HIS  31  20.137  19.715  23.648
  222    HB3  HIS  31           HB3      HIS  31  18.497  19.662  22.992
  223    HD2  HIS  31           HD2      HIS  31  21.999  20.920  21.802
  224    HE1  HIS  31           HE1      HIS  31  19.777  19.730  18.365
  225    HE2  HIS  31           HE2      HIS  31  22.013  20.625  19.179
  226    H    GLY  32           H        GLY  32  17.448  23.487  23.627
  227    HA2  GLY  32           HA2      GLY  32  15.594  24.014  24.867
  228    HA3  GLY  32           HA3      GLY  32  15.360  22.288  25.158
  229    H    THR  33           H        THR  33  16.050  21.390  27.010
  230    HA   THR  33           HA       THR  33  16.945  23.129  29.265
  231    HB   THR  33           HB       THR  33  15.471  21.502  30.635
  232    HG1  THR  33           HG1      THR  33  14.886  19.925  29.296
  233   HG21  THR  33          HG21      THR  33  13.454  22.776  30.119
  234   HG22  THR  33          HG22      THR  33  14.857  23.850  30.064
  235   HG23  THR  33          HG23      THR  33  14.120  23.286  28.552
  236    H    LYS  34           H        LYS  34  18.379  21.058  27.411
  237    HA   LYS  34           HA       LYS  34  20.180  20.085  29.568
  238    HB2  LYS  34           HB2      LYS  34  19.162  18.507  27.149
  239    HB3  LYS  34           HB3      LYS  34  20.476  17.964  28.189
  240    HG2  LYS  34           HG2      LYS  34  17.629  18.457  29.120
  241    HG3  LYS  34           HG3      LYS  34  18.321  16.883  28.708
  242    HD2  LYS  34           HD2      LYS  34  20.052  17.216  30.485
  243    HD3  LYS  34           HD3      LYS  34  19.229  18.692  31.011
  244    HE2  LYS  34           HE2      LYS  34  17.933  15.969  30.777
  245    HE3  LYS  34           HE3      LYS  34  18.680  16.570  32.271
  246    HZ1  LYS  34           HZ1      LYS  34  17.017  18.284  32.407
  247    HZ2  LYS  34           HZ2      LYS  34  16.409  17.915  30.908
  248    HZ3  LYS  34           HZ3      LYS  34  16.244  16.859  32.127
  249    H    CYS  35           H        CYS  35  22.286  19.311  28.652
  250    HA   CYS  35           HA       CYS  35  23.322  21.128  26.526
  251    HB2  CYS  35           HB2      CYS  35  24.319  21.121  28.846
  252    HB3  CYS  35           HB3      CYS  35  24.786  19.442  28.576
  253    H    LYS  36           H        LYS  36  24.279  20.228  24.649
  254    HA   LYS  36           HA       LYS  36  24.383  17.257  24.405
  255    HB2  LYS  36           HB2      LYS  36  22.352  18.354  23.337
  256    HB3  LYS  36           HB3      LYS  36  23.450  19.151  22.209
  257    HG2  LYS  36           HG2      LYS  36  23.479  16.132  22.578
  258    HG3  LYS  36           HG3      LYS  36  22.230  16.895  21.608
  259    HD2  LYS  36           HD2      LYS  36  25.170  17.356  20.995
  260    HD3  LYS  36           HD3      LYS  36  24.286  15.960  20.376
  261    HE2  LYS  36           HE2      LYS  36  22.688  17.331  19.218
  262    HE3  LYS  36           HE3      LYS  36  23.298  18.803  19.983
  263    HZ1  LYS  36           HZ1      LYS  36  24.970  17.177  18.122
  264    HZ2  LYS  36           HZ2      LYS  36  24.102  18.504  17.698
  265    HZ3  LYS  36           HZ3      LYS  36  25.313  18.617  18.799
  266    H    CYS  37           H        CYS  37  26.366  16.644  24.032
  267    HA   CYS  37           HA       CYS  37  28.350  18.604  23.194
  268    HB2  CYS  37           HB2      CYS  37  28.738  15.732  23.950
  269    HB3  CYS  37           HB3      CYS  37  30.012  16.924  23.718
  270    H    GLY  38           H        GLY  38  29.310  18.866  21.374
  271    HA2  GLY  38           HA2      GLY  38  28.315  17.449  18.993
  272    HA3  GLY  38           HA3      GLY  38  29.055  19.048  19.084
  273    H    VAL  39           H        VAL  39  30.798  19.073  17.830
  274    HA   VAL  39           HA       VAL  39  32.415  16.731  17.392
  275    HB   VAL  39           HB       VAL  39  33.872  18.255  16.018
  276   HG11  VAL  39          HG11      VAL  39  30.911  18.273  15.360
  277   HG12  VAL  39          HG12      VAL  39  32.264  18.451  14.221
  278   HG13  VAL  39          HG13      VAL  39  32.045  16.922  15.097
  279   HG21  VAL  39          HG21      VAL  39  33.052  20.477  15.435
  280   HG22  VAL  39          HG22      VAL  39  31.800  20.371  16.683
  281   HG23  VAL  39          HG23      VAL  39  33.521  20.372  17.142
  282    HA   PRO  40           HA       PRO  40  35.617  17.283  20.396
  283    HB2  PRO  40           HB2      PRO  40  37.783  16.159  19.144
  284    HB3  PRO  40           HB3      PRO  40  36.400  15.213  19.772
  285    HG2  PRO  40           HG2      PRO  40  36.881  16.146  16.936
  286    HG3  PRO  40           HG3      PRO  40  36.403  14.517  17.515
  287    HD2  PRO  40           HD2      PRO  40  34.577  16.318  16.574
  288    HD3  PRO  40           HD3      PRO  40  34.153  15.261  17.940
  289    H    ILE  41           H        ILE  41  37.360  18.700  20.909
  290    HA   ILE  41           HA       ILE  41  37.208  21.094  19.377
  291    HB   ILE  41           HB       ILE  41  38.634  22.108  21.032
  292   HG12  ILE  41          HG12      ILE  41  39.196  20.744  23.118
  293   HG13  ILE  41          HG13      ILE  41  39.003  19.308  22.109
  294   HG21  ILE  41          HG21      ILE  41  36.473  20.344  22.251
  295   HG22  ILE  41          HG22      ILE  41  37.085  21.872  22.902
  296   HG23  ILE  41          HG23      ILE  41  36.204  21.862  21.373
  297   HD11  ILE  41          HD11      ILE  41  40.910  21.569  21.372
  298   HD12  ILE  41          HD12      ILE  41  41.384  20.224  22.436
  299   HD13  ILE  41          HD13      ILE  41  40.906  19.902  20.768
  300    H    SER  42           H        SER  42  39.486  18.570  19.016
  301    HA   SER  42           HA       SER  42  41.257  20.214  17.405
  302    HB2  SER  42           HB2      SER  42  42.436  18.006  16.960
  303    HB3  SER  42           HB3      SER  42  42.423  18.604  18.616
  304    HG   SER  42           HG       SER  42  41.090  16.367  17.526
  305    H    TYR  43           H        TYR  43  38.467  19.537  16.879
  306    HA   TYR  43           HA       TYR  43  36.967  19.179  15.191
  307    HB2  TYR  43           HB2      TYR  43  38.972  21.059  13.910
  308    HB3  TYR  43           HB3      TYR  43  37.301  20.851  13.405
  309    HD1  TYR  43           HD1      TYR  43  39.380  22.864  15.392
  310    HD2  TYR  43           HD2      TYR  43  35.482  21.037  15.351
  311    HE1  TYR  43           HE1      TYR  43  38.607  24.453  17.168
  312    HE2  TYR  43           HE2      TYR  43  34.703  22.638  17.085
  313    HH   TYR  43           HH       TYR  43  35.248  24.397  18.435
  314    H    LEU  44           H        LEU  44  38.672  16.950  15.175
  315    HA   LEU  44           HA       LEU  44  37.918  15.922  12.556
  316    HB2  LEU  44           HB2      LEU  44  40.319  16.764  12.353
  317    HB3  LEU  44           HB3      LEU  44  40.773  15.563  13.568
  318    HG   LEU  44           HG       LEU  44  39.872  13.788  11.995
  319   HD11  LEU  44          HD11      LEU  44  39.653  14.370   9.605
  320   HD12  LEU  44          HD12      LEU  44  38.428  15.194  10.571
  321   HD13  LEU  44          HD13      LEU  44  39.854  16.090  10.004
  322   HD21  LEU  44          HD21      LEU  44  42.276  14.260  12.171
  323   HD22  LEU  44          HD22      LEU  44  41.849  13.888  10.494
  324   HD23  LEU  44          HD23      LEU  44  42.121  15.573  10.982
  Start of MODEL   15
    1    H1   ALA   1           H1       ALA   1  28.499  21.418  37.003
    2    H2   ALA   1           H2       ALA   1  28.077  20.184  38.003
    3    H3   ALA   1           H3       ALA   1  28.041  21.734  38.555
    4    HA   ALA   1           HA       ALA   1  25.849  21.111  38.197
    5    HB1  ALA   1           HB1      ALA   1  25.107  22.766  36.553
    6    HB2  ALA   1           HB2      ALA   1  26.434  23.425  37.528
    7    HB3  ALA   1           HB3      ALA   1  26.743  22.857  35.871
    8    H    LYS   2           H        LYS   2  24.429  19.763  37.288
    9    HA   LYS   2           HA       LYS   2  25.130  18.198  34.824
   10    HB2  LYS   2           HB2      LYS   2  24.616  17.063  37.620
   11    HB3  LYS   2           HB3      LYS   2  24.728  16.102  36.174
   12    HG2  LYS   2           HG2      LYS   2  27.118  17.819  36.861
   13    HG3  LYS   2           HG3      LYS   2  26.716  16.491  37.932
   14    HD2  LYS   2           HD2      LYS   2  28.292  15.699  36.303
   15    HD3  LYS   2           HD3      LYS   2  26.714  14.931  36.060
   16    HE2  LYS   2           HE2      LYS   2  26.234  16.472  34.191
   17    HE3  LYS   2           HE3      LYS   2  27.822  17.246  34.414
   18    HZ1  LYS   2           HZ1      LYS   2  27.399  14.374  33.808
   19    HZ2  LYS   2           HZ2      LYS   2  27.837  15.509  32.676
   20    HZ3  LYS   2           HZ3      LYS   2  28.863  15.149  33.894
   21    H    ASN   3           H        ASN   3  22.711  18.900  37.378
   22    HA   ASN   3           HA       ASN   3  20.789  17.103  36.261
   23    HB2  ASN   3           HB2      ASN   3  20.543  19.271  38.378
   24    HB3  ASN   3           HB3      ASN   3  19.240  18.168  37.931
   25   HD21  ASN   3          HD21      ASN   3  22.417  16.663  40.051
   26   HD22  ASN   3          HD22      ASN   3  22.423  18.339  39.522
   27    H    GLN   4           H        GLN   4  21.341  20.533  35.570
   28    HA   GLN   4           HA       GLN   4  19.688  20.047  33.151
   29    HB2  GLN   4           HB2      GLN   4  18.611  22.158  33.191
   30    HB3  GLN   4           HB3      GLN   4  18.247  21.331  34.703
   31    HG2  GLN   4           HG2      GLN   4  19.870  22.721  35.903
   32    HG3  GLN   4           HG3      GLN   4  20.373  23.507  34.398
   33   HE21  GLN   4          HE21      GLN   4  18.402  24.540  33.108
   34   HE22  GLN   4          HE22      GLN   4  17.260  25.395  34.154
   35    H    PHE   5           H        PHE   5  22.661  20.566  34.219
   36    HA   PHE   5           HA       PHE   5  24.617  21.397  33.461
   37    HB2  PHE   5           HB2      PHE   5  23.283  21.468  30.754
   38    HB3  PHE   5           HB3      PHE   5  25.003  21.375  31.084
   39    HD1  PHE   5           HD1      PHE   5  26.029  19.280  31.949
   40    HD2  PHE   5           HD2      PHE   5  21.860  19.499  30.870
   41    HE1  PHE   5           HE1      PHE   5  25.918  16.799  31.814
   42    HE2  PHE   5           HE2      PHE   5  21.766  17.014  30.739
   43    HZ   PHE   5           HZ       PHE   5  23.802  15.673  31.187
   44    H    GLY   6           H        GLY   6  22.325  23.473  34.008
   45    HA2  GLY   6           HA2      GLY   6  22.278  25.804  34.127
   46    HA3  GLY   6           HA3      GLY   6  23.758  25.875  33.167
   47    H    CYS   7           H        CYS   7  21.638  23.923  31.437
   48    HA   CYS   7           HA       CYS   7  21.012  26.092  29.553
   49    HB2  CYS   7           HB2      CYS   7  20.583  23.081  29.500
   50    HB3  CYS   7           HB3      CYS   7  20.170  24.162  28.191
   51    H    PHE   8           H        PHE   8  19.027  26.960  29.162
   52    HA   PHE   8           HA       PHE   8  16.681  25.308  29.793
   53    HB2  PHE   8           HB2      PHE   8  17.039  26.559  31.908
   54    HB3  PHE   8           HB3      PHE   8  16.829  28.064  31.031
   55    HD1  PHE   8           HD1      PHE   8  14.657  28.879  30.472
   56    HD2  PHE   8           HD2      PHE   8  15.132  24.881  32.006
   57    HE1  PHE   8           HE1      PHE   8  12.185  28.678  30.727
   58    HE2  PHE   8           HE2      PHE   8  12.667  24.694  32.301
   59    HZ   PHE   8           HZ       PHE   8  11.195  26.590  31.655
   60    H    ALA   9           H        ALA   9  15.167  25.399  28.351
   61    HA   ALA   9           HA       ALA   9  14.173  25.776  26.367
   62    HB1  ALA   9           HB1      ALA   9  12.850  27.103  27.907
   63    HB2  ALA   9           HB2      ALA   9  13.875  28.523  27.620
   64    HB3  ALA   9           HB3      ALA   9  12.882  27.860  26.303
   65    H    ASN  10           H        ASN  10  16.622  25.529  25.754
   66    HA   ASN  10           HA       ASN  10  18.167  25.762  24.148
   67    HB2  ASN  10           HB2      ASN  10  15.894  27.256  22.803
   68    HB3  ASN  10           HB3      ASN  10  17.428  27.041  21.999
   69   HD21  ASN  10          HD21      ASN  10  15.059  24.488  21.258
   70   HD22  ASN  10          HD22      ASN  10  14.494  25.752  22.311
   71    H    VAL  11           H        VAL  11  18.024  27.953  26.358
   72    HA   VAL  11           HA       VAL  11  20.118  29.679  25.083
   73    HB   VAL  11           HB       VAL  11  18.151  30.530  27.229
   74   HG11  VAL  11          HG11      VAL  11  20.307  31.820  27.244
   75   HG12  VAL  11          HG12      VAL  11  20.116  32.127  25.504
   76   HG13  VAL  11          HG13      VAL  11  18.971  32.806  26.669
   77   HG21  VAL  11          HG21      VAL  11  16.953  30.270  25.074
   78   HG22  VAL  11          HG22      VAL  11  17.147  31.972  25.465
   79   HG23  VAL  11          HG23      VAL  11  18.199  31.219  24.251
   80    H    ASP  12           H        ASP  12  21.873  30.238  26.241
   81    HA   ASP  12           HA       ASP  12  22.821  28.445  28.314
   82    HB2  ASP  12           HB2      ASP  12  23.949  29.696  26.187
   83    HB3  ASP  12           HB3      ASP  12  24.323  30.906  27.389
   84    H    VAL  13           H        VAL  13  20.608  29.831  29.267
   85    HA   VAL  13           HA       VAL  13  21.159  32.337  30.516
   86    HB   VAL  13           HB       VAL  13  18.962  31.615  31.892
   87   HG11  VAL  13          HG11      VAL  13  19.133  33.492  30.374
   88   HG12  VAL  13          HG12      VAL  13  18.964  32.398  28.989
   89   HG13  VAL  13          HG13      VAL  13  17.621  32.596  30.134
   90   HG21  VAL  13          HG21      VAL  13  18.646  29.929  29.400
   91   HG22  VAL  13          HG22      VAL  13  18.952  29.267  31.019
   92   HG23  VAL  13          HG23      VAL  13  17.480  30.210  30.693
   93    H    LYS  14           H        LYS  14  21.062  29.093  31.966
   94    HA   LYS  14           HA       LYS  14  21.529  30.340  34.642
   95    HB2  LYS  14           HB2      LYS  14  20.590  27.510  34.038
   96    HB3  LYS  14           HB3      LYS  14  20.690  28.289  35.604
   97    HG2  LYS  14           HG2      LYS  14  18.740  28.867  33.370
   98    HG3  LYS  14           HG3      LYS  14  18.408  28.249  34.985
   99    HD2  LYS  14           HD2      LYS  14  19.317  31.048  34.246
  100    HD3  LYS  14           HD3      LYS  14  17.723  30.576  34.828
  101    HE2  LYS  14           HE2      LYS  14  18.647  30.007  37.029
  102    HE3  LYS  14           HE3      LYS  14  20.292  30.279  36.449
  103    HZ1  LYS  14           HZ1      LYS  14  18.199  32.358  36.630
  104    HZ2  LYS  14           HZ2      LYS  14  19.526  32.215  37.618
  105    HZ3  LYS  14           HZ3      LYS  14  19.701  32.603  36.031
  106    H    GLY  15           H        GLY  15  23.340  28.515  32.333
  107    HA2  GLY  15           HA2      GLY  15  25.734  29.000  33.743
  108    HA3  GLY  15           HA3      GLY  15  25.222  27.377  34.183
  109    H    ASP  16           H        ASP  16  27.574  27.631  33.102
  110    HA   ASP  16           HA       ASP  16  27.559  27.506  30.194
  111    HB2  ASP  16           HB2      ASP  16  29.962  27.658  30.376
  112    HB3  ASP  16           HB3      ASP  16  29.155  28.916  31.301
  113    H    CYS  17           H        CYS  17  26.370  25.591  29.972
  114    HA   CYS  17           HA       CYS  17  27.043  22.929  30.486
  115    HB2  CYS  17           HB2      CYS  17  25.103  23.030  29.363
  116    HB3  CYS  17           HB3      CYS  17  25.504  24.531  28.583
  117    H    LYS  18           H        LYS  18  28.736  25.060  28.271
  118    HA   LYS  18           HA       LYS  18  30.572  23.659  26.857
  119    HB2  LYS  18           HB2      LYS  18  30.743  26.082  27.223
  120    HB3  LYS  18           HB3      LYS  18  31.027  25.846  28.937
  121    HG2  LYS  18           HG2      LYS  18  33.101  26.479  28.085
  122    HG3  LYS  18           HG3      LYS  18  33.255  24.772  28.404
  123    HD2  LYS  18           HD2      LYS  18  34.354  25.148  26.355
  124    HD3  LYS  18           HD3      LYS  18  32.822  24.396  25.881
  125    HE2  LYS  18           HE2      LYS  18  31.862  26.634  25.380
  126    HE3  LYS  18           HE3      LYS  18  33.318  27.421  26.002
  127    HZ1  LYS  18           HZ1      LYS  18  34.566  26.386  24.160
  128    HZ2  LYS  18           HZ2      LYS  18  33.168  25.712  23.572
  129    HZ3  LYS  18           HZ3      LYS  18  33.349  27.316  23.602
  130    H    ARG  19           H        ARG  19  30.761  23.805  30.468
  131    HA   ARG  19           HA       ARG  19  33.276  22.400  30.522
  132    HB2  ARG  19           HB2      ARG  19  31.292  23.163  32.678
  133    HB3  ARG  19           HB3      ARG  19  32.723  22.181  33.027
  134    HG2  ARG  19           HG2      ARG  19  34.172  23.907  31.970
  135    HG3  ARG  19           HG3      ARG  19  32.773  24.964  31.773
  136    HD2  ARG  19           HD2      ARG  19  33.613  23.847  34.480
  137    HD3  ARG  19           HD3      ARG  19  34.352  25.303  33.797
  138    HE   ARG  19           HE       ARG  19  31.827  26.062  33.605
  139   HH11  ARG  19          HH11      ARG  19  32.485  25.611  37.511
  140   HH12  ARG  19          HH12      ARG  19  33.577  24.836  36.382
  141   HH21  ARG  19          HH21      ARG  19  30.544  27.007  35.047
  142   HH22  ARG  19          HH22      ARG  19  30.805  26.836  36.779
  143    H    HIS  20           H        HIS  20  29.984  21.025  30.744
  144    HA   HIS  20           HA       HIS  20  30.949  18.360  31.496
  145    HB2  HIS  20           HB2      HIS  20  28.722  18.647  32.042
  146    HB3  HIS  20           HB3      HIS  20  28.349  19.545  30.573
  147    HD2  HIS  20           HD2      HIS  20  27.415  18.292  28.535
  148    HE1  HIS  20           HE1      HIS  20  27.668  14.287  29.950
  149    HE2  HIS  20           HE2      HIS  20  26.797  15.779  28.078
  150    H    CYS  21           H        CYS  21  30.420  19.988  28.376
  151    HA   CYS  21           HA       CYS  21  31.091  17.545  26.886
  152    HB2  CYS  21           HB2      CYS  21  30.679  20.419  26.050
  153    HB3  CYS  21           HB3      CYS  21  30.921  19.088  24.938
  154    H    LYS  22           H        LYS  22  32.851  20.561  27.822
  155    HA   LYS  22           HA       LYS  22  35.247  20.008  26.453
  156    HB2  LYS  22           HB2      LYS  22  34.519  22.162  27.465
  157    HB3  LYS  22           HB3      LYS  22  34.780  21.476  29.081
  158    HG2  LYS  22           HG2      LYS  22  37.195  21.116  28.456
  159    HG3  LYS  22           HG3      LYS  22  36.857  21.906  26.900
  160    HD2  LYS  22           HD2      LYS  22  36.152  23.971  28.155
  161    HD3  LYS  22           HD3      LYS  22  36.564  23.128  29.680
  162    HE2  LYS  22           HE2      LYS  22  38.823  22.655  28.711
  163    HE3  LYS  22           HE3      LYS  22  38.386  23.656  27.313
  164    HZ1  LYS  22           HZ1      LYS  22  38.182  25.556  28.826
  165    HZ2  LYS  22           HZ2      LYS  22  38.488  24.638  30.128
  166    HZ3  LYS  22           HZ3      LYS  22  39.681  24.894  29.003
  167    H    ALA  23           H        ALA  23  34.059  18.784  29.571
  168    HA   ALA  23           HA       ALA  23  36.439  17.613  30.581
  169    HB1  ALA  23           HB1      ALA  23  34.874  16.216  31.880
  170    HB2  ALA  23           HB2      ALA  23  34.345  17.909  31.864
  171    HB3  ALA  23           HB3      ALA  23  33.535  16.711  30.828
  172    H    GLU  24           H        GLU  24  34.452  16.610  27.884
  173    HA   GLU  24           HA       GLU  24  36.092  14.141  27.548
  174    HB2  GLU  24           HB2      GLU  24  33.191  14.524  26.762
  175    HB3  GLU  24           HB3      GLU  24  34.170  13.075  26.517
  176    HG2  GLU  24           HG2      GLU  24  34.509  12.910  28.988
  177    HG3  GLU  24           HG3      GLU  24  33.385  14.251  29.219
  178    H    ASP  25           H        ASP  25  36.490  16.966  26.617
  179    HA   ASP  25           HA       ASP  25  37.209  18.127  24.781
  180    HB2  ASP  25           HB2      ASP  25  38.828  16.229  25.003
  181    HB3  ASP  25           HB3      ASP  25  37.903  15.331  23.811
  182    H    LYS  26           H        LYS  26  34.681  18.178  24.767
  183    HA   LYS  26           HA       LYS  26  33.901  18.256  21.883
  184    HB2  LYS  26           HB2      LYS  26  32.184  17.525  24.297
  185    HB3  LYS  26           HB3      LYS  26  31.581  17.743  22.660
  186    HG2  LYS  26           HG2      LYS  26  33.608  15.628  23.459
  187    HG3  LYS  26           HG3      LYS  26  31.870  15.378  23.510
  188    HD2  LYS  26           HD2      LYS  26  31.576  15.717  21.215
  189    HD3  LYS  26           HD3      LYS  26  33.240  16.288  20.945
  190    HE2  LYS  26           HE2      LYS  26  32.363  13.490  21.795
  191    HE3  LYS  26           HE3      LYS  26  32.974  13.949  20.203
  192    HZ1  LYS  26           HZ1      LYS  26  34.688  12.915  21.560
  193    HZ2  LYS  26           HZ2      LYS  26  35.118  14.444  21.226
  194    HZ3  LYS  26           HZ3      LYS  26  34.552  14.076  22.719
  195    H    GLU  27           H        GLU  27  32.641  20.012  21.285
  196    HA   GLU  27           HA       GLU  27  32.384  22.315  23.023
  197    HB2  GLU  27           HB2      GLU  27  31.395  21.585  20.250
  198    HB3  GLU  27           HB3      GLU  27  30.633  22.925  21.095
  199    HG2  GLU  27           HG2      GLU  27  33.592  22.732  20.467
  200    HG3  GLU  27           HG3      GLU  27  32.403  23.679  19.583
  201    H    GLY  28           H        GLY  28  30.566  23.076  23.985
  202    HA2  GLY  28           HA2      GLY  28  28.230  21.196  24.265
  203    HA3  GLY  28           HA3      GLY  28  28.836  22.129  25.622
  204    H    ILE  29           H        ILE  29  26.243  21.966  23.874
  205    HA   ILE  29           HA       ILE  29  25.713  24.867  23.825
  206    HB   ILE  29           HB       ILE  29  26.550  24.306  21.640
  207   HG12  ILE  29          HG12      ILE  29  24.630  25.958  22.061
  208   HG13  ILE  29          HG13      ILE  29  25.133  25.569  20.426
  209   HG21  ILE  29          HG21      ILE  29  24.322  22.293  21.330
  210   HG22  ILE  29          HG22      ILE  29  25.372  22.881  20.030
  211   HG23  ILE  29          HG23      ILE  29  26.063  21.970  21.377
  212   HD11  ILE  29          HD11      ILE  29  22.668  25.718  20.688
  213   HD12  ILE  29          HD12      ILE  29  23.209  24.148  20.072
  214   HD13  ILE  29          HD13      ILE  29  22.717  24.313  21.768
  215    H    CYS  30           H        CYS  30  23.618  25.405  24.344
  216    HA   CYS  30           HA       CYS  30  22.166  23.310  25.702
  217    HB2  CYS  30           HB2      CYS  30  21.581  26.257  25.341
  218    HB3  CYS  30           HB3      CYS  30  20.637  25.154  26.348
  219    H    HIS  31           H        HIS  31  20.817  21.968  24.892
  220    HA   HIS  31           HA       HIS  31  18.968  22.661  22.639
  221    HB2  HIS  31           HB2      HIS  31  20.414  20.128  23.419
  222    HB3  HIS  31           HB3      HIS  31  18.828  20.016  22.683
  223    HD2  HIS  31           HD2      HIS  31  22.013  22.105  21.762
  224    HE1  HIS  31           HE1      HIS  31  20.490  20.335  18.200
  225    HE2  HIS  31           HE2      HIS  31  22.349  21.766  19.149
  226    H    GLY  32           H        GLY  32  17.215  23.405  23.598
  227    HA2  GLY  32           HA2      GLY  32  15.342  23.570  24.987
  228    HA3  GLY  32           HA3      GLY  32  15.489  21.830  25.246
  229    H    THR  33           H        THR  33  15.761  21.283  27.343
  230    HA   THR  33           HA       THR  33  17.112  23.131  29.255
  231    HB   THR  33           HB       THR  33  16.057  21.790  31.018
  232    HG1  THR  33           HG1      THR  33  14.478  20.301  30.408
  233   HG21  THR  33          HG21      THR  33  13.854  22.621  30.756
  234   HG22  THR  33          HG22      THR  33  14.884  23.757  29.866
  235   HG23  THR  33          HG23      THR  33  13.943  22.545  28.985
  236    H    LYS  34           H        LYS  34  18.350  21.057  27.281
  237    HA   LYS  34           HA       LYS  34  20.153  19.692  29.244
  238    HB2  LYS  34           HB2      LYS  34  18.983  18.708  26.603
  239    HB3  LYS  34           HB3      LYS  34  20.195  17.841  27.526
  240    HG2  LYS  34           HG2      LYS  34  17.408  18.518  28.540
  241    HG3  LYS  34           HG3      LYS  34  17.907  16.970  27.856
  242    HD2  LYS  34           HD2      LYS  34  19.660  16.837  29.692
  243    HD3  LYS  34           HD3      LYS  34  18.865  18.210  30.477
  244    HE2  LYS  34           HE2      LYS  34  17.455  15.627  29.680
  245    HE3  LYS  34           HE3      LYS  34  18.214  15.867  31.252
  246    HZ1  LYS  34           HZ1      LYS  34  16.699  17.782  31.591
  247    HZ2  LYS  34           HZ2      LYS  34  15.915  17.394  30.192
  248    HZ3  LYS  34           HZ3      LYS  34  15.926  16.335  31.445
  249    H    CYS  35           H        CYS  35  22.207  18.942  28.267
  250    HA   CYS  35           HA       CYS  35  23.397  21.072  26.525
  251    HB2  CYS  35           HB2      CYS  35  24.249  20.832  28.839
  252    HB3  CYS  35           HB3      CYS  35  24.720  19.172  28.470
  253    H    LYS  36           H        LYS  36  23.920  20.483  24.473
  254    HA   LYS  36           HA       LYS  36  24.046  17.651  23.664
  255    HB2  LYS  36           HB2      LYS  36  22.398  19.059  22.510
  256    HB3  LYS  36           HB3      LYS  36  23.586  20.342  22.306
  257    HG2  LYS  36           HG2      LYS  36  23.302  19.310  20.202
  258    HG3  LYS  36           HG3      LYS  36  24.908  18.883  20.786
  259    HD2  LYS  36           HD2      LYS  36  23.941  16.656  21.566
  260    HD3  LYS  36           HD3      LYS  36  22.401  17.138  20.808
  261    HE2  LYS  36           HE2      LYS  36  23.703  17.554  18.680
  262    HE3  LYS  36           HE3      LYS  36  25.126  16.883  19.499
  263    HZ1  LYS  36           HZ1      LYS  36  22.578  15.433  18.958
  264    HZ2  LYS  36           HZ2      LYS  36  24.000  15.140  18.215
  265    HZ3  LYS  36           HZ3      LYS  36  23.849  14.814  19.820
  266    H    CYS  37           H        CYS  37  26.043  16.918  23.579
  267    HA   CYS  37           HA       CYS  37  28.319  18.733  23.241
  268    HB2  CYS  37           HB2      CYS  37  28.416  15.746  23.533
  269    HB3  CYS  37           HB3      CYS  37  29.761  16.856  23.550
  270    H    GLY  38           H        GLY  38  29.552  19.012  21.552
  271    HA2  GLY  38           HA2      GLY  38  28.544  18.087  18.893
  272    HA3  GLY  38           HA3      GLY  38  29.184  19.675  19.309
  273    H    VAL  39           H        VAL  39  30.970  20.031  18.262
  274    HA   VAL  39           HA       VAL  39  32.784  17.929  17.391
  275    HB   VAL  39           HB       VAL  39  33.951  19.852  16.286
  276   HG11  VAL  39          HG11      VAL  39  30.988  19.575  15.672
  277   HG12  VAL  39          HG12      VAL  39  32.274  20.051  14.547
  278   HG13  VAL  39          HG13      VAL  39  32.245  18.407  15.219
  279   HG21  VAL  39          HG21      VAL  39  31.578  21.527  17.152
  280   HG22  VAL  39          HG22      VAL  39  33.231  21.688  17.790
  281   HG23  VAL  39          HG23      VAL  39  32.901  22.001  16.076
  282    HA   PRO  40           HA       PRO  40  35.867  18.247  20.451
  283    HB2  PRO  40           HB2      PRO  40  38.272  18.013  19.093
  284    HB3  PRO  40           HB3      PRO  40  37.125  16.680  19.364
  285    HG2  PRO  40           HG2      PRO  40  37.352  18.449  16.925
  286    HG3  PRO  40           HG3      PRO  40  37.251  16.657  16.983
  287    HD2  PRO  40           HD2      PRO  40  35.065  18.142  16.477
  288    HD3  PRO  40           HD3      PRO  40  34.911  16.752  17.575
  289    H    ILE  41           H        ILE  41  37.619  19.456  21.475
  290    HA   ILE  41           HA       ILE  41  37.632  22.290  20.576
  291    HB   ILE  41           HB       ILE  41  37.584  22.953  22.840
  292   HG12  ILE  41          HG12      ILE  41  36.750  21.236  24.597
  293   HG13  ILE  41          HG13      ILE  41  37.511  20.027  23.565
  294   HG21  ILE  41          HG21      ILE  41  35.277  22.402  23.289
  295   HG22  ILE  41          HG22      ILE  41  35.498  22.438  21.524
  296   HG23  ILE  41          HG23      ILE  41  35.443  20.877  22.397
  297   HD11  ILE  41          HD11      ILE  41  38.979  22.430  24.740
  298   HD12  ILE  41          HD12      ILE  41  38.827  20.874  25.575
  299   HD13  ILE  41          HD13      ILE  41  39.698  20.957  24.053
  300    H    SER  42           H        SER  42  39.726  19.700  21.741
  301    HA   SER  42           HA       SER  42  41.876  19.564  22.176
  302    HB2  SER  42           HB2      SER  42  41.916  20.940  19.488
  303    HB3  SER  42           HB3      SER  42  43.094  19.765  20.142
  304    HG   SER  42           HG       SER  42  41.344  19.077  18.606
  305    H    TYR  43           H        TYR  43  41.052  21.911  23.479
  306    HA   TYR  43           HA       TYR  43  43.700  23.126  23.897
  307    HB2  TYR  43           HB2      TYR  43  42.903  25.323  24.270
  308    HB3  TYR  43           HB3      TYR  43  42.597  24.787  22.634
  309    HD1  TYR  43           HD1      TYR  43  40.508  25.166  21.700
  310    HD2  TYR  43           HD2      TYR  43  40.871  25.023  25.997
  311    HE1  TYR  43           HE1      TYR  43  38.141  25.785  21.915
  312    HE2  TYR  43           HE2      TYR  43  38.496  25.620  26.208
  313    HH   TYR  43           HH       TYR  43  36.491  26.423  23.343
  314    H    LEU  44           H        LEU  44  43.880  24.206  26.048
  315    HA   LEU  44           HA       LEU  44  43.295  22.287  28.049
  316    HB2  LEU  44           HB2      LEU  44  44.681  23.558  29.451
  317    HB3  LEU  44           HB3      LEU  44  45.362  23.654  27.840
  318    HG   LEU  44           HG       LEU  44  43.847  25.851  29.311
  319   HD11  LEU  44          HD11      LEU  44  46.756  25.579  28.466
  320   HD12  LEU  44          HD12      LEU  44  46.040  26.928  29.370
  321   HD13  LEU  44          HD13      LEU  44  46.128  25.314  30.107
  322   HD21  LEU  44          HD21      LEU  44  45.176  25.915  26.559
  323   HD22  LEU  44          HD22      LEU  44  43.442  26.156  26.905
  324   HD23  LEU  44          HD23      LEU  44  44.623  27.339  27.461
  Start of MODEL   16
    1    H1   ALA   1           H1       ALA   1  21.922  25.142  37.134
    2    H2   ALA   1           H2       ALA   1  23.247  24.879  38.093
    3    H3   ALA   1           H3       ALA   1  21.832  25.429  38.737
    4    HA   ALA   1           HA       ALA   1  22.246  23.088  39.205
    5    HB1  ALA   1           HB1      ALA   1  19.785  23.762  37.548
    6    HB2  ALA   1           HB2      ALA   1  19.997  22.276  38.493
    7    HB3  ALA   1           HB3      ALA   1  19.971  23.847  39.307
    8    H    LYS   2           H        LYS   2  22.664  21.049  38.442
    9    HA   LYS   2           HA       LYS   2  24.097  21.095  35.830
   10    HB2  LYS   2           HB2      LYS   2  25.515  19.375  36.691
   11    HB3  LYS   2           HB3      LYS   2  25.488  20.750  37.787
   12    HG2  LYS   2           HG2      LYS   2  23.958  19.513  39.308
   13    HG3  LYS   2           HG3      LYS   2  23.910  18.164  38.172
   14    HD2  LYS   2           HD2      LYS   2  25.409  17.661  40.001
   15    HD3  LYS   2           HD3      LYS   2  26.329  17.775  38.496
   16    HE2  LYS   2           HE2      LYS   2  27.201  19.949  39.072
   17    HE3  LYS   2           HE3      LYS   2  26.062  20.125  40.415
   18    HZ1  LYS   2           HZ1      LYS   2  27.159  18.396  41.592
   19    HZ2  LYS   2           HZ2      LYS   2  28.173  18.045  40.349
   20    HZ3  LYS   2           HZ3      LYS   2  28.317  19.480  41.138
   21    H    ASN   3           H        ASN   3  21.510  19.472  37.506
   22    HA   ASN   3           HA       ASN   3  21.100  17.340  35.601
   23    HB2  ASN   3           HB2      ASN   3  18.701  17.594  36.446
   24    HB3  ASN   3           HB3      ASN   3  19.956  17.147  37.622
   25   HD21  ASN   3          HD21      ASN   3  18.810  19.715  39.714
   26   HD22  ASN   3          HD22      ASN   3  19.185  17.988  39.540
   27    H    GLN   4           H        GLN   4  20.350  20.771  35.529
   28    HA   GLN   4           HA       GLN   4  19.271  20.411  32.748
   29    HB2  GLN   4           HB2      GLN   4  18.315  22.518  32.788
   30    HB3  GLN   4           HB3      GLN   4  17.924  21.792  34.340
   31    HG2  GLN   4           HG2      GLN   4  19.711  23.129  35.411
   32    HG3  GLN   4           HG3      GLN   4  20.121  23.833  33.837
   33   HE21  GLN   4          HE21      GLN   4  18.031  24.858  32.648
   34   HE22  GLN   4          HE22      GLN   4  17.176  25.944  33.754
   35    H    PHE   5           H        PHE   5  22.246  20.678  34.060
   36    HA   PHE   5           HA       PHE   5  24.266  21.530  33.551
   37    HB2  PHE   5           HB2      PHE   5  23.219  21.313  30.721
   38    HB3  PHE   5           HB3      PHE   5  24.905  21.514  31.158
   39    HD1  PHE   5           HD1      PHE   5  26.272  19.706  31.899
   40    HD2  PHE   5           HD2      PHE   5  22.033  19.136  31.356
   41    HE1  PHE   5           HE1      PHE   5  26.575  17.247  32.065
   42    HE2  PHE   5           HE2      PHE   5  22.338  16.686  31.570
   43    HZ   PHE   5           HZ       PHE   5  24.609  15.734  31.893
   44    H    GLY   6           H        GLY   6  22.120  23.534  34.052
   45    HA2  GLY   6           HA2      GLY   6  21.958  25.856  34.162
   46    HA3  GLY   6           HA3      GLY   6  23.475  25.979  33.272
   47    H    CYS   7           H        CYS   7  21.582  24.081  31.324
   48    HA   CYS   7           HA       CYS   7  21.071  26.227  29.443
   49    HB2  CYS   7           HB2      CYS   7  20.370  23.277  29.374
   50    HB3  CYS   7           HB3      CYS   7  20.196  24.373  28.044
   51    H    PHE   8           H        PHE   8  19.190  27.251  29.032
   52    HA   PHE   8           HA       PHE   8  16.637  25.871  29.533
   53    HB2  PHE   8           HB2      PHE   8  16.990  27.154  31.605
   54    HB3  PHE   8           HB3      PHE   8  17.170  28.631  30.673
   55    HD1  PHE   8           HD1      PHE   8  15.263  29.730  29.614
   56    HD2  PHE   8           HD2      PHE   8  14.786  26.068  31.849
   57    HE1  PHE   8           HE1      PHE   8  12.783  29.998  29.551
   58    HE2  PHE   8           HE2      PHE   8  12.317  26.349  31.793
   59    HZ   PHE   8           HZ       PHE   8  11.316  28.305  30.630
   60    H    ALA   9           H        ALA   9  15.108  26.282  28.020
   61    HA   ALA   9           HA       ALA   9  14.467  26.647  25.876
   62    HB1  ALA   9           HB1      ALA   9  13.392  28.420  27.135
   63    HB2  ALA   9           HB2      ALA   9  14.762  29.508  26.837
   64    HB3  ALA   9           HB3      ALA   9  13.754  28.951  25.488
   65    H    ASN  10           H        ASN  10  16.801  25.751  25.630
   66    HA   ASN  10           HA       ASN  10  18.588  25.442  24.364
   67    HB2  ASN  10           HB2      ASN  10  17.308  27.167  22.239
   68    HB3  ASN  10           HB3      ASN  10  18.335  25.767  22.048
   69   HD21  ASN  10          HD21      ASN  10  15.268  24.578  21.071
   70   HD22  ASN  10          HD22      ASN  10  16.774  25.277  20.496
   71    H    VAL  11           H        VAL  11  18.837  27.793  26.170
   72    HA   VAL  11           HA       VAL  11  21.319  28.932  24.970
   73    HB   VAL  11           HB       VAL  11  19.210  30.488  26.536
   74   HG11  VAL  11          HG11      VAL  11  20.613  32.479  25.971
   75   HG12  VAL  11          HG12      VAL  11  21.481  31.366  27.018
   76   HG13  VAL  11          HG13      VAL  11  21.846  31.412  25.282
   77   HG21  VAL  11          HG21      VAL  11  18.979  31.821  24.445
   78   HG22  VAL  11          HG22      VAL  11  20.068  30.694  23.608
   79   HG23  VAL  11          HG23      VAL  11  18.488  30.150  24.201
   80    H    ASP  12           H        ASP  12  23.015  29.234  26.399
   81    HA   ASP  12           HA       ASP  12  22.962  27.899  28.975
   82    HB2  ASP  12           HB2      ASP  12  25.305  28.282  29.062
   83    HB3  ASP  12           HB3      ASP  12  24.868  27.702  27.472
   84    H    VAL  13           H        VAL  13  21.052  29.692  29.352
   85    HA   VAL  13           HA       VAL  13  21.955  32.276  30.287
   86    HB   VAL  13           HB       VAL  13  19.543  32.242  31.399
   87   HG11  VAL  13          HG11      VAL  13  18.617  33.085  29.320
   88   HG12  VAL  13          HG12      VAL  13  20.263  33.690  29.555
   89   HG13  VAL  13          HG13      VAL  13  19.955  32.375  28.399
   90   HG21  VAL  13          HG21      VAL  13  19.162  29.785  30.924
   91   HG22  VAL  13          HG22      VAL  13  17.929  30.893  30.293
   92   HG23  VAL  13          HG23      VAL  13  19.121  30.190  29.194
   93    H    LYS  14           H        LYS  14  20.872  29.399  32.141
   94    HA   LYS  14           HA       LYS  14  21.425  30.850  34.682
   95    HB2  LYS  14           HB2      LYS  14  20.209  28.093  34.322
   96    HB3  LYS  14           HB3      LYS  14  20.218  29.075  35.780
   97    HG2  LYS  14           HG2      LYS  14  18.674  29.593  33.221
   98    HG3  LYS  14           HG3      LYS  14  18.019  29.099  34.770
   99    HD2  LYS  14           HD2      LYS  14  19.380  31.790  34.305
  100    HD3  LYS  14           HD3      LYS  14  17.652  31.497  34.138
  101    HE2  LYS  14           HE2      LYS  14  17.504  30.786  36.500
  102    HE3  LYS  14           HE3      LYS  14  19.243  31.065  36.702
  103    HZ1  LYS  14           HZ1      LYS  14  17.276  33.163  35.939
  104    HZ2  LYS  14           HZ2      LYS  14  17.906  32.979  37.453
  105    HZ3  LYS  14           HZ3      LYS  14  18.894  33.397  36.236
  106    H    GLY  15           H        GLY  15  23.102  28.725  32.673
  107    HA2  GLY  15           HA2      GLY  15  25.504  29.052  34.075
  108    HA3  GLY  15           HA3      GLY  15  24.900  27.438  34.487
  109    H    ASP  16           H        ASP  16  27.230  27.448  33.198
  110    HA   ASP  16           HA       ASP  16  26.774  27.145  30.297
  111    HB2  ASP  16           HB2      ASP  16  29.153  27.048  30.065
  112    HB3  ASP  16           HB3      ASP  16  28.723  28.444  31.051
  113    H    CYS  17           H        CYS  17  27.044  25.355  29.135
  114    HA   CYS  17           HA       CYS  17  27.386  22.748  30.545
  115    HB2  CYS  17           HB2      CYS  17  25.337  23.083  29.248
  116    HB3  CYS  17           HB3      CYS  17  26.303  23.398  27.806
  117    H    LYS  18           H        LYS  18  29.115  25.037  28.596
  118    HA   LYS  18           HA       LYS  18  30.789  23.492  27.052
  119    HB2  LYS  18           HB2      LYS  18  30.654  25.985  27.173
  120    HB3  LYS  18           HB3      LYS  18  31.613  25.960  28.657
  121    HG2  LYS  18           HG2      LYS  18  32.628  24.628  26.114
  122    HG3  LYS  18           HG3      LYS  18  32.703  26.375  26.263
  123    HD2  LYS  18           HD2      LYS  18  33.969  24.533  28.320
  124    HD3  LYS  18           HD3      LYS  18  34.803  25.107  26.869
  125    HE2  LYS  18           HE2      LYS  18  34.301  27.470  27.594
  126    HE3  LYS  18           HE3      LYS  18  33.653  26.826  29.108
  127    HZ1  LYS  18           HZ1      LYS  18  36.423  26.537  28.115
  128    HZ2  LYS  18           HZ2      LYS  18  35.937  27.476  29.363
  129    HZ3  LYS  18           HZ3      LYS  18  35.864  25.829  29.512
  130    H    ARG  19           H        ARG  19  31.242  24.085  30.573
  131    HA   ARG  19           HA       ARG  19  33.652  22.611  30.899
  132    HB2  ARG  19           HB2      ARG  19  31.382  23.501  32.649
  133    HB3  ARG  19           HB3      ARG  19  32.361  22.170  33.274
  134    HG2  ARG  19           HG2      ARG  19  34.390  23.421  33.097
  135    HG3  ARG  19           HG3      ARG  19  33.593  24.757  32.253
  136    HD2  ARG  19           HD2      ARG  19  32.703  23.914  35.030
  137    HD3  ARG  19           HD3      ARG  19  34.137  24.924  34.802
  138    HE   ARG  19           HE       ARG  19  31.582  25.783  33.518
  139   HH11  ARG  19          HH11      ARG  19  34.027  26.533  36.031
  140   HH12  ARG  19          HH12      ARG  19  33.419  28.183  36.094
  141   HH21  ARG  19          HH21      ARG  19  30.892  27.810  33.944
  142   HH22  ARG  19          HH22      ARG  19  31.851  28.867  35.003
  143    H    HIS  20           H        HIS  20  30.350  21.285  30.806
  144    HA   HIS  20           HA       HIS  20  31.080  18.590  31.580
  145    HB2  HIS  20           HB2      HIS  20  28.789  19.075  31.757
  146    HB3  HIS  20           HB3      HIS  20  28.712  19.863  30.191
  147    HD2  HIS  20           HD2      HIS  20  27.581  18.519  28.347
  148    HE1  HIS  20           HE1      HIS  20  28.474  14.561  29.620
  149    HE2  HIS  20           HE2      HIS  20  27.287  15.933  27.857
  150    H    CYS  21           H        CYS  21  30.712  20.146  28.353
  151    HA   CYS  21           HA       CYS  21  31.574  17.699  27.050
  152    HB2  CYS  21           HB2      CYS  21  30.946  20.479  26.062
  153    HB3  CYS  21           HB3      CYS  21  31.381  19.143  24.988
  154    H    LYS  22           H        LYS  22  33.295  20.714  27.995
  155    HA   LYS  22           HA       LYS  22  35.665  20.176  26.562
  156    HB2  LYS  22           HB2      LYS  22  34.884  22.330  27.688
  157    HB3  LYS  22           HB3      LYS  22  35.386  21.646  29.227
  158    HG2  LYS  22           HG2      LYS  22  37.069  23.166  28.344
  159    HG3  LYS  22           HG3      LYS  22  37.741  21.528  28.340
  160    HD2  LYS  22           HD2      LYS  22  37.346  21.326  25.921
  161    HD3  LYS  22           HD3      LYS  22  36.378  22.805  25.923
  162    HE2  LYS  22           HE2      LYS  22  38.414  23.424  25.033
  163    HE3  LYS  22           HE3      LYS  22  38.421  24.047  26.689
  164    HZ1  LYS  22           HZ1      LYS  22  39.624  21.410  26.054
  165    HZ2  LYS  22           HZ2      LYS  22  40.504  22.730  25.806
  166    HZ3  LYS  22           HZ3      LYS  22  39.969  22.441  27.334
  167    H    ALA  23           H        ALA  23  34.509  18.758  29.588
  168    HA   ALA  23           HA       ALA  23  36.951  17.528  30.439
  169    HB1  ALA  23           HB1      ALA  23  34.830  17.681  31.743
  170    HB2  ALA  23           HB2      ALA  23  34.084  16.527  30.621
  171    HB3  ALA  23           HB3      ALA  23  35.440  16.015  31.639
  172    H    GLU  24           H        GLU  24  34.726  16.750  27.812
  173    HA   GLU  24           HA       GLU  24  36.309  14.362  26.979
  174    HB2  GLU  24           HB2      GLU  24  33.623  15.430  26.020
  175    HB3  GLU  24           HB3      GLU  24  34.384  13.937  25.486
  176    HG2  GLU  24           HG2      GLU  24  33.470  14.499  28.353
  177    HG3  GLU  24           HG3      GLU  24  32.549  13.628  27.151
  178    H    ASP  25           H        ASP  25  36.709  17.481  26.686
  179    HA   ASP  25           HA       ASP  25  37.368  19.050  25.325
  180    HB2  ASP  25           HB2      ASP  25  39.224  17.219  25.349
  181    HB3  ASP  25           HB3      ASP  25  38.865  17.099  23.629
  182    H    LYS  26           H        LYS  26  34.825  18.221  24.672
  183    HA   LYS  26           HA       LYS  26  34.521  18.951  21.781
  184    HB2  LYS  26           HB2      LYS  26  32.653  17.490  23.690
  185    HB3  LYS  26           HB3      LYS  26  32.168  18.122  22.126
  186    HG2  LYS  26           HG2      LYS  26  34.419  16.622  21.451
  187    HG3  LYS  26           HG3      LYS  26  33.682  15.690  22.776
  188    HD2  LYS  26           HD2      LYS  26  31.498  15.734  21.592
  189    HD3  LYS  26           HD3      LYS  26  32.249  16.691  20.292
  190    HE2  LYS  26           HE2      LYS  26  33.811  14.844  19.806
  191    HE3  LYS  26           HE3      LYS  26  33.087  13.887  21.108
  192    HZ1  LYS  26           HZ1      LYS  26  32.150  13.294  18.940
  193    HZ2  LYS  26           HZ2      LYS  26  30.968  13.931  19.882
  194    HZ3  LYS  26           HZ3      LYS  26  31.644  14.817  18.669
  195    H    GLU  27           H        GLU  27  32.703  20.268  21.247
  196    HA   GLU  27           HA       GLU  27  32.244  22.629  22.883
  197    HB2  GLU  27           HB2      GLU  27  30.964  21.513  20.352
  198    HB3  GLU  27           HB3      GLU  27  30.487  23.041  21.083
  199    HG2  GLU  27           HG2      GLU  27  33.336  22.483  20.191
  200    HG3  GLU  27           HG3      GLU  27  32.118  23.118  19.106
  201    H    GLY  28           H        GLY  28  30.388  23.063  24.041
  202    HA2  GLY  28           HA2      GLY  28  28.417  20.861  24.544
  203    HA3  GLY  28           HA3      GLY  28  28.646  22.244  25.587
  204    H    ILE  29           H        ILE  29  26.113  21.210  24.323
  205    HA   ILE  29           HA       ILE  29  25.285  23.698  22.969
  206    HB   ILE  29           HB       ILE  29  25.883  22.301  21.191
  207   HG12  ILE  29          HG12      ILE  29  23.802  23.677  21.080
  208   HG13  ILE  29          HG13      ILE  29  24.086  22.467  19.836
  209   HG21  ILE  29          HG21      ILE  29  24.190  20.075  22.276
  210   HG22  ILE  29          HG22      ILE  29  24.850  20.148  20.626
  211   HG23  ILE  29          HG23      ILE  29  25.949  20.095  22.001
  212   HD11  ILE  29          HD11      ILE  29  22.146  22.154  22.127
  213   HD12  ILE  29          HD12      ILE  29  21.736  22.511  20.455
  214   HD13  ILE  29          HD13      ILE  29  22.453  20.948  20.862
  215    H    CYS  30           H        CYS  30  23.701  24.529  23.999
  216    HA   CYS  30           HA       CYS  30  21.877  22.937  25.690
  217    HB2  CYS  30           HB2      CYS  30  22.011  25.911  25.056
  218    HB3  CYS  30           HB3      CYS  30  20.849  25.155  26.142
  219    H    HIS  31           H        HIS  31  20.486  21.721  24.482
  220    HA   HIS  31           HA       HIS  31  18.969  23.072  22.272
  221    HB2  HIS  31           HB2      HIS  31  18.325  20.781  21.606
  222    HB3  HIS  31           HB3      HIS  31  20.048  21.060  21.566
  223    HD2  HIS  31           HD2      HIS  31  21.593  19.650  23.109
  224    HE1  HIS  31           HE1      HIS  31  18.555  17.488  25.238
  225    HE2  HIS  31           HE2      HIS  31  21.052  17.680  24.846
  226    H    GLY  32           H        GLY  32  18.450  22.969  25.416
  227    HA2  GLY  32           HA2      GLY  32  15.733  23.726  25.307
  228    HA3  GLY  32           HA3      GLY  32  15.763  21.999  25.626
  229    H    THR  33           H        THR  33  15.153  21.909  27.693
  230    HA   THR  33           HA       THR  33  16.448  23.367  29.882
  231    HB   THR  33           HB       THR  33  14.975  21.897  31.286
  232    HG1  THR  33           HG1      THR  33  13.609  20.533  30.297
  233   HG21  THR  33          HG21      THR  33  13.477  23.274  29.001
  234   HG22  THR  33          HG22      THR  33  12.845  22.875  30.610
  235   HG23  THR  33          HG23      THR  33  14.124  24.086  30.444
  236    H    LYS  34           H        LYS  34  17.856  21.430  27.981
  237    HA   LYS  34           HA       LYS  34  19.457  19.815  29.851
  238    HB2  LYS  34           HB2      LYS  34  17.863  18.635  27.522
  239    HB3  LYS  34           HB3      LYS  34  19.089  17.762  28.410
  240    HG2  LYS  34           HG2      LYS  34  16.443  18.736  29.533
  241    HG3  LYS  34           HG3      LYS  34  16.826  17.098  29.064
  242    HD2  LYS  34           HD2      LYS  34  18.307  18.551  31.303
  243    HD3  LYS  34           HD3      LYS  34  16.856  17.595  31.534
  244    HE2  LYS  34           HE2      LYS  34  18.092  15.634  30.447
  245    HE3  LYS  34           HE3      LYS  34  19.560  16.619  30.566
  246    HZ1  LYS  34           HZ1      LYS  34  17.858  15.692  32.817
  247    HZ2  LYS  34           HZ2      LYS  34  19.449  15.289  32.538
  248    HZ3  LYS  34           HZ3      LYS  34  19.055  16.791  32.991
  249    H    CYS  35           H        CYS  35  21.190  18.652  28.491
  250    HA   CYS  35           HA       CYS  35  22.156  20.430  26.292
  251    HB2  CYS  35           HB2      CYS  35  23.082  21.025  28.556
  252    HB3  CYS  35           HB3      CYS  35  23.841  19.428  28.603
  253    H    LYS  36           H        LYS  36  24.207  19.483  25.306
  254    HA   LYS  36           HA       LYS  36  24.563  16.604  25.050
  255    HB2  LYS  36           HB2      LYS  36  22.976  18.293  23.215
  256    HB3  LYS  36           HB3      LYS  36  24.287  17.670  22.400
  257    HG2  LYS  36           HG2      LYS  36  23.515  15.324  23.183
  258    HG3  LYS  36           HG3      LYS  36  22.101  16.152  23.884
  259    HD2  LYS  36           HD2      LYS  36  21.491  15.256  21.712
  260    HD3  LYS  36           HD3      LYS  36  21.507  17.021  21.622
  261    HE2  LYS  36           HE2      LYS  36  23.873  16.857  20.679
  262    HE3  LYS  36           HE3      LYS  36  23.670  15.101  20.627
  263    HZ1  LYS  36           HZ1      LYS  36  21.980  17.069  19.171
  264    HZ2  LYS  36           HZ2      LYS  36  23.204  16.196  18.527
  265    HZ3  LYS  36           HZ3      LYS  36  21.854  15.414  19.093
  266    H    CYS  37           H        CYS  37  26.461  16.313  23.607
  267    HA   CYS  37           HA       CYS  37  28.195  18.725  23.386
  268    HB2  CYS  37           HB2      CYS  37  29.053  15.826  23.251
  269    HB3  CYS  37           HB3      CYS  37  30.079  17.259  23.200
  270    H    GLY  38           H        GLY  38  29.274  19.240  21.576
  271    HA2  GLY  38           HA2      GLY  38  27.943  18.625  18.988
  272    HA3  GLY  38           HA3      GLY  38  28.935  20.017  19.407
  273    H    VAL  39           H        VAL  39  30.743  20.051  18.302
  274    HA   VAL  39           HA       VAL  39  32.192  17.604  17.556
  275    HB   VAL  39           HB       VAL  39  33.448  19.127  16.010
  276   HG11  VAL  39          HG11      VAL  39  30.438  19.121  15.618
  277   HG12  VAL  39          HG12      VAL  39  31.681  19.287  14.362
  278   HG13  VAL  39          HG13      VAL  39  31.532  17.767  15.258
  279   HG21  VAL  39          HG21      VAL  39  31.353  21.214  16.723
  280   HG22  VAL  39          HG22      VAL  39  33.069  21.282  17.186
  281   HG23  VAL  39          HG23      VAL  39  32.608  21.329  15.479
  282    HA   PRO  40           HA       PRO  40  35.794  18.261  20.169
  283    HB2  PRO  40           HB2      PRO  40  37.254  18.188  17.517
  284    HB3  PRO  40           HB3      PRO  40  37.678  17.380  19.056
  285    HG2  PRO  40           HG2      PRO  40  36.485  15.987  17.077
  286    HG3  PRO  40           HG3      PRO  40  35.948  15.781  18.779
  287    HD2  PRO  40           HD2      PRO  40  34.606  17.401  16.592
  288    HD3  PRO  40           HD3      PRO  40  33.909  16.358  17.859
  289    H    ILE  41           H        ILE  41  36.930  20.074  20.954
  290    HA   ILE  41           HA       ILE  41  36.489  22.594  19.559
  291    HB   ILE  41           HB       ILE  41  37.199  23.662  21.502
  292   HG12  ILE  41          HG12      ILE  41  37.848  21.941  23.536
  293   HG13  ILE  41          HG13      ILE  41  38.634  21.137  22.187
  294   HG21  ILE  41          HG21      ILE  41  35.698  22.827  23.194
  295   HG22  ILE  41          HG22      ILE  41  34.972  22.539  21.604
  296   HG23  ILE  41          HG23      ILE  41  35.753  21.206  22.498
  297   HD11  ILE  41          HD11      ILE  41  40.065  22.813  23.380
  298   HD12  ILE  41          HD12      ILE  41  39.843  23.240  21.678
  299   HD13  ILE  41          HD13      ILE  41  38.937  24.098  22.939
  300    H    SER  42           H        SER  42  39.091  20.399  19.772
  301    HA   SER  42           HA       SER  42  41.280  20.371  19.202
  302    HB2  SER  42           HB2      SER  42  39.949  21.501  16.744
  303    HB3  SER  42           HB3      SER  42  41.327  20.380  16.840
  304    HG   SER  42           HG       SER  42  39.924  18.804  17.721
  305    H    TYR  43           H        TYR  43  41.339  22.693  20.646
  306    HA   TYR  43           HA       TYR  43  43.538  24.112  19.297
  307    HB2  TYR  43           HB2      TYR  43  42.704  26.149  19.010
  308    HB3  TYR  43           HB3      TYR  43  41.214  25.271  18.778
  309    HD1  TYR  43           HD1      TYR  43  39.392  25.458  20.470
  310    HD2  TYR  43           HD2      TYR  43  43.173  27.463  20.993
  311    HE1  TYR  43           HE1      TYR  43  38.425  26.808  22.317
  312    HE2  TYR  43           HE2      TYR  43  42.220  28.805  22.827
  313    HH   TYR  43           HH       TYR  43  38.775  28.551  23.802
  314    H    LEU  44           H        LEU  44  41.803  23.552  22.288
  315    HA   LEU  44           HA       LEU  44  44.214  24.301  23.882
  316    HB2  LEU  44           HB2      LEU  44  42.684  26.099  24.171
  317    HB3  LEU  44           HB3      LEU  44  41.304  25.017  24.350
  318    HG   LEU  44           HG       LEU  44  42.043  24.284  26.535
  319   HD11  LEU  44          HD11      LEU  44  44.484  24.276  26.278
  320   HD12  LEU  44          HD12      LEU  44  44.486  26.041  26.091
  321   HD13  LEU  44          HD13      LEU  44  44.021  25.295  27.638
  322   HD21  LEU  44          HD21      LEU  44  40.772  26.394  26.325
  323   HD22  LEU  44          HD22      LEU  44  41.848  26.398  27.737
  324   HD23  LEU  44          HD23      LEU  44  42.301  27.303  26.276
  Start of MODEL   17
    1    H1   ALA   1           H1       ALA   1  27.172  21.658  38.259
    2    H2   ALA   1           H2       ALA   1  26.166  20.795  39.208
    3    H3   ALA   1           H3       ALA   1  26.123  22.439  39.272
    4    HA   ALA   1           HA       ALA   1  24.237  21.659  38.046
    5    HB1  ALA   1           HB1      ALA   1  26.398  23.033  36.392
    6    HB2  ALA   1           HB2      ALA   1  24.721  22.841  35.855
    7    HB3  ALA   1           HB3      ALA   1  25.069  23.770  37.324
    8    H    LYS   2           H        LYS   2  23.638  19.652  37.555
    9    HA   LYS   2           HA       LYS   2  24.961  18.203  35.274
   10    HB2  LYS   2           HB2      LYS   2  25.641  17.413  37.546
   11    HB3  LYS   2           HB3      LYS   2  23.948  17.066  37.914
   12    HG2  LYS   2           HG2      LYS   2  23.933  15.406  36.010
   13    HG3  LYS   2           HG3      LYS   2  25.658  15.717  35.781
   14    HD2  LYS   2           HD2      LYS   2  24.303  14.542  38.254
   15    HD3  LYS   2           HD3      LYS   2  25.329  13.684  37.092
   16    HE2  LYS   2           HE2      LYS   2  27.241  15.165  37.727
   17    HE3  LYS   2           HE3      LYS   2  26.207  15.963  38.915
   18    HZ1  LYS   2           HZ1      LYS   2  27.052  13.107  38.975
   19    HZ2  LYS   2           HZ2      LYS   2  27.540  14.287  39.987
   20    HZ3  LYS   2           HZ3      LYS   2  25.984  13.799  40.051
   21    H    ASN   3           H        ASN   3  21.986  18.941  37.054
   22    HA   ASN   3           HA       ASN   3  20.434  17.061  35.436
   23    HB2  ASN   3           HB2      ASN   3  19.542  18.922  37.661
   24    HB3  ASN   3           HB3      ASN   3  18.611  17.603  36.948
   25   HD21  ASN   3          HD21      ASN   3  20.533  15.048  38.608
   26   HD22  ASN   3          HD22      ASN   3  19.636  15.338  37.132
   27    H    GLN   4           H        GLN   4  21.022  20.549  35.254
   28    HA   GLN   4           HA       GLN   4  19.576  20.377  32.673
   29    HB2  GLN   4           HB2      GLN   4  18.616  22.508  32.819
   30    HB3  GLN   4           HB3      GLN   4  18.137  21.633  34.264
   31    HG2  GLN   4           HG2      GLN   4  19.786  22.901  35.602
   32    HG3  GLN   4           HG3      GLN   4  20.358  23.729  34.146
   33   HE21  GLN   4          HE21      GLN   4  18.459  24.862  32.844
   34   HE22  GLN   4          HE22      GLN   4  17.407  25.824  33.914
   35    H    PHE   5           H        PHE   5  22.475  20.826  34.194
   36    HA   PHE   5           HA       PHE   5  24.525  21.543  33.633
   37    HB2  PHE   5           HB2      PHE   5  23.579  21.527  30.769
   38    HB3  PHE   5           HB3      PHE   5  25.227  21.466  31.358
   39    HD1  PHE   5           HD1      PHE   5  26.181  19.423  32.337
   40    HD2  PHE   5           HD2      PHE   5  22.144  19.544  30.828
   41    HE1  PHE   5           HE1      PHE   5  26.137  16.945  32.252
   42    HE2  PHE   5           HE2      PHE   5  22.111  17.048  30.721
   43    HZ   PHE   5           HZ       PHE   5  24.102  15.761  31.439
   44    H    GLY   6           H        GLY   6  22.357  23.632  34.040
   45    HA2  GLY   6           HA2      GLY   6  22.369  25.949  34.135
   46    HA3  GLY   6           HA3      GLY   6  23.782  26.018  33.109
   47    H    CYS   7           H        CYS   7  21.890  24.087  31.304
   48    HA   CYS   7           HA       CYS   7  21.102  26.238  29.507
   49    HB2  CYS   7           HB2      CYS   7  20.823  23.215  29.397
   50    HB3  CYS   7           HB3      CYS   7  20.329  24.286  28.114
   51    H    PHE   8           H        PHE   8  19.120  27.002  29.067
   52    HA   PHE   8           HA       PHE   8  16.748  25.350  29.567
   53    HB2  PHE   8           HB2      PHE   8  17.104  26.626  31.707
   54    HB3  PHE   8           HB3      PHE   8  16.894  28.111  30.824
   55    HD1  PHE   8           HD1      PHE   8  14.675  28.774  29.965
   56    HD2  PHE   8           HD2      PHE   8  15.240  25.145  32.224
   57    HE1  PHE   8           HE1      PHE   8  12.219  28.664  30.419
   58    HE2  PHE   8           HE2      PHE   8  12.791  25.027  32.655
   59    HZ   PHE   8           HZ       PHE   8  11.294  26.799  31.759
   60    H    ALA   9           H        ALA   9  15.277  25.621  27.955
   61    HA   ALA   9           HA       ALA   9  14.436  26.253  25.954
   62    HB1  ALA   9           HB1      ALA   9  13.391  27.779  27.557
   63    HB2  ALA   9           HB2      ALA   9  14.640  28.994  27.228
   64    HB3  ALA   9           HB3      ALA   9  13.524  28.508  25.935
   65    H    ASN  10           H        ASN  10  16.905  25.633  25.438
   66    HA   ASN  10           HA       ASN  10  18.700  25.809  24.108
   67    HB2  ASN  10           HB2      ASN  10  17.013  27.705  22.433
   68    HB3  ASN  10           HB3      ASN  10  18.376  26.752  21.883
   69   HD21  ASN  10          HD21      ASN  10  15.498  25.194  20.679
   70   HD22  ASN  10          HD22      ASN  10  16.551  26.570  20.347
   71    H    VAL  11           H        VAL  11  18.535  27.924  26.300
   72    HA   VAL  11           HA       VAL  11  20.767  29.656  25.314
   73    HB   VAL  11           HB       VAL  11  18.317  30.444  26.922
   74   HG11  VAL  11          HG11      VAL  11  20.273  31.641  27.914
   75   HG12  VAL  11          HG12      VAL  11  20.753  32.179  26.287
   76   HG13  VAL  11          HG13      VAL  11  19.236  32.736  27.024
   77   HG21  VAL  11          HG21      VAL  11  18.013  32.112  25.109
   78   HG22  VAL  11          HG22      VAL  11  19.423  31.450  24.265
   79   HG23  VAL  11          HG23      VAL  11  17.965  30.461  24.485
   80    H    ASP  12           H        ASP  12  22.332  30.173  26.815
   81    HA   ASP  12           HA       ASP  12  22.855  28.270  28.936
   82    HB2  ASP  12           HB2      ASP  12  24.416  30.805  28.329
   83    HB3  ASP  12           HB3      ASP  12  25.016  29.301  29.008
   84    H    VAL  13           H        VAL  13  20.488  29.611  29.588
   85    HA   VAL  13           HA       VAL  13  20.691  32.100  30.822
   86    HB   VAL  13           HB       VAL  13  18.575  30.389  32.038
   87   HG11  VAL  13          HG11      VAL  13  18.548  32.943  30.388
   88   HG12  VAL  13          HG12      VAL  13  17.205  32.302  31.368
   89   HG13  VAL  13          HG13      VAL  13  18.673  32.884  32.166
   90   HG21  VAL  13          HG21      VAL  13  18.477  30.908  29.064
   91   HG22  VAL  13          HG22      VAL  13  18.623  29.305  29.830
   92   HG23  VAL  13          HG23      VAL  13  17.172  30.283  30.075
   93    H    LYS  14           H        LYS  14  20.893  28.946  32.475
   94    HA   LYS  14           HA       LYS  14  21.225  30.303  35.102
   95    HB2  LYS  14           HB2      LYS  14  20.921  27.377  34.418
   96    HB3  LYS  14           HB3      LYS  14  21.113  28.031  36.039
   97    HG2  LYS  14           HG2      LYS  14  18.795  28.614  34.149
   98    HG3  LYS  14           HG3      LYS  14  18.800  27.418  35.442
   99    HD2  LYS  14           HD2      LYS  14  19.162  29.240  37.121
  100    HD3  LYS  14           HD3      LYS  14  19.045  30.437  35.803
  101    HE2  LYS  14           HE2      LYS  14  16.831  29.490  35.191
  102    HE3  LYS  14           HE3      LYS  14  16.933  28.375  36.562
  103    HZ1  LYS  14           HZ1      LYS  14  17.053  30.376  38.014
  104    HZ2  LYS  14           HZ2      LYS  14  16.813  31.330  36.710
  105    HZ3  LYS  14           HZ3      LYS  14  15.628  30.286  37.170
  106    H    GLY  15           H        GLY  15  23.061  28.606  32.642
  107    HA2  GLY  15           HA2      GLY  15  25.586  29.604  33.382
  108    HA3  GLY  15           HA3      GLY  15  25.435  28.000  34.110
  109    H    ASP  16           H        ASP  16  27.420  28.265  32.372
  110    HA   ASP  16           HA       ASP  16  26.612  27.374  29.688
  111    HB2  ASP  16           HB2      ASP  16  28.883  27.477  29.073
  112    HB3  ASP  16           HB3      ASP  16  28.561  28.906  30.048
  113    H    CYS  17           H        CYS  17  26.865  25.406  28.780
  114    HA   CYS  17           HA       CYS  17  27.477  23.122  30.570
  115    HB2  CYS  17           HB2      CYS  17  26.101  21.819  29.447
  116    HB3  CYS  17           HB3      CYS  17  25.235  23.341  29.502
  117    H    LYS  18           H        LYS  18  29.060  24.969  28.355
  118    HA   LYS  18           HA       LYS  18  30.527  23.141  26.752
  119    HB2  LYS  18           HB2      LYS  18  30.651  25.575  26.511
  120    HB3  LYS  18           HB3      LYS  18  31.573  25.724  28.008
  121    HG2  LYS  18           HG2      LYS  18  32.559  23.916  25.774
  122    HG3  LYS  18           HG3      LYS  18  32.734  25.646  25.605
  123    HD2  LYS  18           HD2      LYS  18  33.817  24.272  28.078
  124    HD3  LYS  18           HD3      LYS  18  34.738  24.229  26.584
  125    HE2  LYS  18           HE2      LYS  18  33.735  26.839  27.779
  126    HE3  LYS  18           HE3      LYS  18  35.240  26.089  28.309
  127    HZ1  LYS  18           HZ1      LYS  18  34.700  26.816  25.482
  128    HZ2  LYS  18           HZ2      LYS  18  35.544  27.738  26.548
  129    HZ3  LYS  18           HZ3      LYS  18  36.142  26.277  26.093
  130    H    ARG  19           H        ARG  19  31.165  24.074  30.166
  131    HA   ARG  19           HA       ARG  19  33.632  22.656  30.366
  132    HB2  ARG  19           HB2      ARG  19  31.612  23.516  32.445
  133    HB3  ARG  19           HB3      ARG  19  33.149  22.763  32.858
  134    HG2  ARG  19           HG2      ARG  19  34.454  24.502  31.843
  135    HG3  ARG  19           HG3      ARG  19  33.027  25.249  31.117
  136    HD2  ARG  19           HD2      ARG  19  33.507  24.988  34.099
  137    HD3  ARG  19           HD3      ARG  19  33.837  26.448  33.146
  138    HE   ARG  19           HE       ARG  19  31.365  26.367  32.504
  139   HH11  ARG  19          HH11      ARG  19  32.280  25.044  35.679
  140   HH12  ARG  19          HH12      ARG  19  30.610  25.207  36.214
  141   HH21  ARG  19          HH21      ARG  19  29.500  26.777  33.444
  142   HH22  ARG  19          HH22      ARG  19  29.120  26.098  35.046
  143    H    HIS  20           H        HIS  20  30.335  21.394  30.953
  144    HA   HIS  20           HA       HIS  20  31.116  18.761  31.770
  145    HB2  HIS  20           HB2      HIS  20  28.890  19.213  32.160
  146    HB3  HIS  20           HB3      HIS  20  28.649  20.026  30.621
  147    HD2  HIS  20           HD2      HIS  20  27.553  18.738  28.722
  148    HE1  HIS  20           HE1      HIS  20  27.899  14.757  30.171
  149    HE2  HIS  20           HE2      HIS  20  26.966  16.211  28.297
  150    H    CYS  21           H        CYS  21  30.476  19.962  28.428
  151    HA   CYS  21           HA       CYS  21  31.255  17.431  27.167
  152    HB2  CYS  21           HB2      CYS  21  30.784  20.252  26.180
  153    HB3  CYS  21           HB3      CYS  21  31.118  18.909  25.113
  154    H    LYS  22           H        LYS  22  33.011  20.395  28.026
  155    HA   LYS  22           HA       LYS  22  35.408  19.874  26.648
  156    HB2  LYS  22           HB2      LYS  22  34.685  22.039  27.582
  157    HB3  LYS  22           HB3      LYS  22  34.833  21.392  29.218
  158    HG2  LYS  22           HG2      LYS  22  36.693  22.817  28.769
  159    HG3  LYS  22           HG3      LYS  22  37.238  21.159  28.954
  160    HD2  LYS  22           HD2      LYS  22  37.158  21.061  26.316
  161    HD3  LYS  22           HD3      LYS  22  37.048  22.841  26.416
  162    HE2  LYS  22           HE2      LYS  22  39.018  22.856  27.859
  163    HE3  LYS  22           HE3      LYS  22  39.096  21.086  27.819
  164    HZ1  LYS  22           HZ1      LYS  22  39.440  21.316  25.334
  165    HZ2  LYS  22           HZ2      LYS  22  39.612  22.965  25.602
  166    HZ3  LYS  22           HZ3      LYS  22  40.658  21.890  26.255
  167    H    ALA  23           H        ALA  23  34.193  18.452  29.603
  168    HA   ALA  23           HA       ALA  23  36.580  17.325  30.646
  169    HB1  ALA  23           HB1      ALA  23  35.095  15.716  31.706
  170    HB2  ALA  23           HB2      ALA  23  34.323  17.311  31.734
  171    HB3  ALA  23           HB3      ALA  23  33.798  16.086  30.556
  172    H    GLU  24           H        GLU  24  34.929  16.630  27.657
  173    HA   GLU  24           HA       GLU  24  36.885  14.460  27.036
  174    HB2  GLU  24           HB2      GLU  24  34.053  14.713  25.955
  175    HB3  GLU  24           HB3      GLU  24  35.229  13.435  25.620
  176    HG2  GLU  24           HG2      GLU  24  35.224  12.969  28.162
  177    HG3  GLU  24           HG3      GLU  24  33.805  14.019  28.255
  178    H    ASP  25           H        ASP  25  36.775  17.503  26.651
  179    HA   ASP  25           HA       ASP  25  37.419  19.113  25.259
  180    HB2  ASP  25           HB2      ASP  25  39.306  17.505  24.931
  181    HB3  ASP  25           HB3      ASP  25  38.553  17.007  23.419
  182    H    LYS  26           H        LYS  26  34.750  17.757  24.785
  183    HA   LYS  26           HA       LYS  26  34.044  18.448  22.010
  184    HB2  LYS  26           HB2      LYS  26  32.470  17.453  24.422
  185    HB3  LYS  26           HB3      LYS  26  31.766  17.723  22.844
  186    HG2  LYS  26           HG2      LYS  26  34.078  15.766  23.214
  187    HG3  LYS  26           HG3      LYS  26  32.420  15.335  23.647
  188    HD2  LYS  26           HD2      LYS  26  31.665  15.980  21.365
  189    HD3  LYS  26           HD3      LYS  26  33.358  16.278  20.914
  190    HE2  LYS  26           HE2      LYS  26  32.870  14.072  20.139
  191    HE3  LYS  26           HE3      LYS  26  33.828  13.843  21.612
  192    HZ1  LYS  26           HZ1      LYS  26  31.860  12.399  21.608
  193    HZ2  LYS  26           HZ2      LYS  26  31.695  13.486  22.814
  194    HZ3  LYS  26           HZ3      LYS  26  30.854  13.695  21.432
  195    H    GLU  27           H        GLU  27  32.605  20.076  21.433
  196    HA   GLU  27           HA       GLU  27  32.285  22.428  23.124
  197    HB2  GLU  27           HB2      GLU  27  32.508  22.371  20.578
  198    HB3  GLU  27           HB3      GLU  27  30.924  21.620  20.538
  199    HG2  GLU  27           HG2      GLU  27  30.450  23.809  20.123
  200    HG3  GLU  27           HG3      GLU  27  30.068  23.671  21.830
  201    H    GLY  28           H        GLY  28  30.530  22.918  24.343
  202    HA2  GLY  28           HA2      GLY  28  28.236  20.966  24.472
  203    HA3  GLY  28           HA3      GLY  28  28.780  21.922  25.844
  204    H    ILE  29           H        ILE  29  26.257  21.689  23.841
  205    HA   ILE  29           HA       ILE  29  25.699  24.598  23.878
  206    HB   ILE  29           HB       ILE  29  26.549  24.064  21.691
  207   HG12  ILE  29          HG12      ILE  29  24.558  25.672  22.128
  208   HG13  ILE  29          HG13      ILE  29  25.132  25.333  20.510
  209   HG21  ILE  29          HG21      ILE  29  26.111  21.728  21.434
  210   HG22  ILE  29          HG22      ILE  29  24.355  21.989  21.476
  211   HG23  ILE  29          HG23      ILE  29  25.319  22.590  20.114
  212   HD11  ILE  29          HD11      ILE  29  23.274  23.903  20.012
  213   HD12  ILE  29          HD12      ILE  29  22.723  23.920  21.696
  214   HD13  ILE  29          HD13      ILE  29  22.640  25.398  20.719
  215    H    CYS  30           H        CYS  30  23.606  25.190  24.234
  216    HA   CYS  30           HA       CYS  30  22.067  23.232  25.688
  217    HB2  CYS  30           HB2      CYS  30  21.522  26.144  25.027
  218    HB3  CYS  30           HB3      CYS  30  20.615  25.158  26.179
  219    H    HIS  31           H        HIS  31  20.755  21.818  24.815
  220    HA   HIS  31           HA       HIS  31  18.775  22.677  22.724
  221    HB2  HIS  31           HB2      HIS  31  20.065  19.985  23.237
  222    HB3  HIS  31           HB3      HIS  31  18.494  20.134  22.453
  223    HD2  HIS  31           HD2      HIS  31  22.116  21.477  21.894
  224    HE1  HIS  31           HE1      HIS  31  20.200  21.246  18.099
  225    HE2  HIS  31           HE2      HIS  31  22.416  21.664  19.262
  226    H    GLY  32           H        GLY  32  17.116  23.397  23.836
  227    HA2  GLY  32           HA2      GLY  32  15.329  23.503  25.293
  228    HA3  GLY  32           HA3      GLY  32  15.496  21.764  25.553
  229    H    THR  33           H        THR  33  15.762  21.313  27.577
  230    HA   THR  33           HA       THR  33  17.129  23.131  29.507
  231    HB   THR  33           HB       THR  33  15.912  22.049  31.262
  232    HG1  THR  33           HG1      THR  33  14.974  20.299  29.208
  233   HG21  THR  33          HG21      THR  33  13.662  22.725  30.760
  234   HG22  THR  33          HG22      THR  33  14.760  23.852  29.947
  235   HG23  THR  33          HG23      THR  33  13.940  22.591  29.007
  236    H    LYS  34           H        LYS  34  18.409  21.165  27.604
  237    HA   LYS  34           HA       LYS  34  20.246  19.931  29.566
  238    HB2  LYS  34           HB2      LYS  34  18.990  18.533  27.147
  239    HB3  LYS  34           HB3      LYS  34  20.304  17.856  28.100
  240    HG2  LYS  34           HG2      LYS  34  17.521  18.475  29.163
  241    HG3  LYS  34           HG3      LYS  34  18.098  16.887  28.671
  242    HD2  LYS  34           HD2      LYS  34  19.736  16.791  30.421
  243    HD3  LYS  34           HD3      LYS  34  19.507  18.475  30.876
  244    HE2  LYS  34           HE2      LYS  34  17.387  16.326  31.121
  245    HE3  LYS  34           HE3      LYS  34  18.450  16.899  32.425
  246    HZ1  LYS  34           HZ1      LYS  34  16.229  18.278  31.128
  247    HZ2  LYS  34           HZ2      LYS  34  16.606  18.168  32.722
  248    HZ3  LYS  34           HZ3      LYS  34  17.459  19.199  31.745
  249    H    CYS  35           H        CYS  35  22.244  19.190  28.621
  250    HA   CYS  35           HA       CYS  35  23.264  21.028  26.539
  251    HB2  CYS  35           HB2      CYS  35  24.467  20.473  28.760
  252    HB3  CYS  35           HB3      CYS  35  24.816  18.904  28.034
  253    H    LYS  36           H        LYS  36  24.299  20.204  24.647
  254    HA   LYS  36           HA       LYS  36  24.112  17.324  23.974
  255    HB2  LYS  36           HB2      LYS  36  22.315  18.467  22.843
  256    HB3  LYS  36           HB3      LYS  36  23.356  19.820  22.423
  257    HG2  LYS  36           HG2      LYS  36  23.974  17.057  21.364
  258    HG3  LYS  36           HG3      LYS  36  22.700  18.061  20.640
  259    HD2  LYS  36           HD2      LYS  36  24.302  19.920  20.322
  260    HD3  LYS  36           HD3      LYS  36  25.629  18.910  20.902
  261    HE2  LYS  36           HE2      LYS  36  23.866  18.300  18.543
  262    HE3  LYS  36           HE3      LYS  36  25.449  19.108  18.476
  263    HZ1  LYS  36           HZ1      LYS  36  25.854  16.796  18.043
  264    HZ2  LYS  36           HZ2      LYS  36  26.369  17.033  19.556
  265    HZ3  LYS  36           HZ3      LYS  36  24.948  16.295  19.324
  266    H    CYS  37           H        CYS  37  26.160  16.624  23.686
  267    HA   CYS  37           HA       CYS  37  28.325  18.600  23.385
  268    HB2  CYS  37           HB2      CYS  37  28.522  15.596  23.517
  269    HB3  CYS  37           HB3      CYS  37  29.863  16.721  23.475
  270    H    GLY  38           H        GLY  38  29.339  19.171  21.581
  271    HA2  GLY  38           HA2      GLY  38  28.183  18.291  19.010
  272    HA3  GLY  38           HA3      GLY  38  29.102  19.760  19.393
  273    H    VAL  39           H        VAL  39  30.730  19.774  18.021
  274    HA   VAL  39           HA       VAL  39  32.507  17.443  17.646
  275    HB   VAL  39           HB       VAL  39  33.625  18.941  15.980
  276   HG11  VAL  39          HG11      VAL  39  31.785  17.381  15.363
  277   HG12  VAL  39          HG12      VAL  39  30.636  18.726  15.490
  278   HG13  VAL  39          HG13      VAL  39  31.942  18.785  14.288
  279   HG21  VAL  39          HG21      VAL  39  32.771  21.036  15.329
  280   HG22  VAL  39          HG22      VAL  39  31.335  20.871  16.347
  281   HG23  VAL  39          HG23      VAL  39  32.925  21.095  17.101
  282    HA   PRO  40           HA       PRO  40  35.741  18.770  20.412
  283    HB2  PRO  40           HB2      PRO  40  37.382  19.257  17.916
  284    HB3  PRO  40           HB3      PRO  40  37.882  18.495  19.461
  285    HG2  PRO  40           HG2      PRO  40  37.230  16.951  17.332
  286    HG3  PRO  40           HG3      PRO  40  36.665  16.511  18.977
  287    HD2  PRO  40           HD2      PRO  40  35.095  17.801  16.749
  288    HD3  PRO  40           HD3      PRO  40  34.577  16.607  17.957
  289    H    ILE  41           H        ILE  41  36.476  20.700  21.356
  290    HA   ILE  41           HA       ILE  41  34.996  22.955  20.672
  291    HB   ILE  41           HB       ILE  41  36.410  24.243  22.307
  292   HG12  ILE  41          HG12      ILE  41  37.588  22.759  24.000
  293   HG13  ILE  41          HG13      ILE  41  37.728  21.531  22.752
  294   HG21  ILE  41          HG21      ILE  41  35.164  21.663  23.265
  295   HG22  ILE  41          HG22      ILE  41  35.348  23.163  24.189
  296   HG23  ILE  41          HG23      ILE  41  34.276  23.143  22.794
  297   HD11  ILE  41          HD11      ILE  41  39.692  23.123  23.214
  298   HD12  ILE  41          HD12      ILE  41  39.267  22.866  21.533
  299   HD13  ILE  41          HD13      ILE  41  38.751  24.358  22.361
  300    H    SER  42           H        SER  42  38.395  22.435  19.743
  301    HA   SER  42           HA       SER  42  39.842  23.584  18.601
  302    HB2  SER  42           HB2      SER  42  39.250  24.019  16.431
  303    HB3  SER  42           HB3      SER  42  38.178  22.727  16.975
  304    HG   SER  42           HG       SER  42  36.642  24.459  17.470
  305    H    TYR  43           H        TYR  43  38.752  25.181  20.677
  306    HA   TYR  43           HA       TYR  43  40.345  27.545  20.049
  307    HB2  TYR  43           HB2      TYR  43  38.901  29.248  20.838
  308    HB3  TYR  43           HB3      TYR  43  38.197  28.391  19.474
  309    HD1  TYR  43           HD1      TYR  43  36.435  26.703  19.856
  310    HD2  TYR  43           HD2      TYR  43  37.627  29.465  22.903
  311    HE1  TYR  43           HE1      TYR  43  34.554  25.918  21.271
  312    HE2  TYR  43           HE2      TYR  43  35.681  28.792  24.281
  313    HH   TYR  43           HH       TYR  43  33.378  26.219  23.212
  314    H    LEU  44           H        LEU  44  38.271  26.885  22.907
  315    HA   LEU  44           HA       LEU  44  40.705  26.734  24.622
  316    HB2  LEU  44           HB2      LEU  44  39.756  29.023  24.552
  317    HB3  LEU  44           HB3      LEU  44  38.189  28.383  25.056
  318    HG   LEU  44           HG       LEU  44  39.131  27.714  27.237
  319   HD11  LEU  44          HD11      LEU  44  41.668  29.034  26.193
  320   HD12  LEU  44          HD12      LEU  44  41.377  28.589  27.889
  321   HD13  LEU  44          HD13      LEU  44  41.483  27.329  26.656
  322   HD21  LEU  44          HD21      LEU  44  39.689  30.607  26.463
  323   HD22  LEU  44          HD22      LEU  44  39.410  29.993  28.109
  324   HD23  LEU  44          HD23      LEU  44  38.104  29.937  26.914
  Start of MODEL   18
    1    H1   ALA   1           H1       ALA   1  27.836  23.913  37.413
    2    H2   ALA   1           H2       ALA   1  28.020  22.274  37.559
    3    H3   ALA   1           H3       ALA   1  27.386  23.142  38.793
    4    HA   ALA   1           HA       ALA   1  25.480  23.740  37.465
    5    HB1  ALA   1           HB1      ALA   1  26.780  21.886  35.420
    6    HB2  ALA   1           HB2      ALA   1  25.134  22.549  35.325
    7    HB3  ALA   1           HB3      ALA   1  26.525  23.636  35.254
    8    H    LYS   2           H        LYS   2  23.572  22.480  37.485
    9    HA   LYS   2           HA       LYS   2  23.744  19.775  38.760
   10    HB2  LYS   2           HB2      LYS   2  23.761  21.668  40.345
   11    HB3  LYS   2           HB3      LYS   2  22.231  22.256  39.698
   12    HG2  LYS   2           HG2      LYS   2  21.126  20.163  40.478
   13    HG3  LYS   2           HG3      LYS   2  22.682  19.596  41.106
   14    HD2  LYS   2           HD2      LYS   2  21.175  22.095  42.020
   15    HD3  LYS   2           HD3      LYS   2  21.294  20.558  42.896
   16    HE2  LYS   2           HE2      LYS   2  23.742  20.825  43.069
   17    HE3  LYS   2           HE3      LYS   2  23.651  22.368  42.199
   18    HZ1  LYS   2           HZ1      LYS   2  22.570  23.374  44.031
   19    HZ2  LYS   2           HZ2      LYS   2  22.140  21.945  44.718
   20    HZ3  LYS   2           HZ3      LYS   2  23.687  22.426  44.762
   21    H    ASN   3           H        ASN   3  22.709  18.521  37.350
   22    HA   ASN   3           HA       ASN   3  21.108  17.421  36.276
   23    HB2  ASN   3           HB2      ASN   3  19.224  19.178  37.884
   24    HB3  ASN   3           HB3      ASN   3  18.718  17.814  36.904
   25   HD21  ASN   3          HD21      ASN   3  18.938  16.240  40.112
   26   HD22  ASN   3          HD22      ASN   3  17.855  17.305  39.201
   27    H    GLN   4           H        GLN   4  21.123  20.830  35.609
   28    HA   GLN   4           HA       GLN   4  19.867  20.263  32.951
   29    HB2  GLN   4           HB2      GLN   4  18.838  22.378  32.966
   30    HB3  GLN   4           HB3      GLN   4  18.496  21.649  34.531
   31    HG2  GLN   4           HG2      GLN   4  20.381  23.030  35.508
   32    HG3  GLN   4           HG3      GLN   4  20.548  23.820  33.933
   33   HE21  GLN   4          HE21      GLN   4  18.402  24.832  33.034
   34   HE22  GLN   4          HE22      GLN   4  17.451  25.667  34.267
   35    H    PHE   5           H        PHE   5  22.873  20.642  34.169
   36    HA   PHE   5           HA       PHE   5  24.858  21.425  33.467
   37    HB2  PHE   5           HB2      PHE   5  23.641  21.666  30.726
   38    HB3  PHE   5           HB3      PHE   5  25.326  21.436  31.121
   39    HD1  PHE   5           HD1      PHE   5  26.016  19.230  32.261
   40    HD2  PHE   5           HD2      PHE   5  22.147  19.865  30.532
   41    HE1  PHE   5           HE1      PHE   5  25.630  16.760  32.220
   42    HE2  PHE   5           HE2      PHE   5  21.800  17.389  30.387
   43    HZ   PHE   5           HZ       PHE   5  23.514  15.851  31.251
   44    H    GLY   6           H        GLY   6  22.522  23.539  33.866
   45    HA2  GLY   6           HA2      GLY   6  22.621  25.881  34.101
   46    HA3  GLY   6           HA3      GLY   6  24.009  25.932  33.011
   47    H    CYS   7           H        CYS   7  21.882  23.977  31.406
   48    HA   CYS   7           HA       CYS   7  21.148  26.050  29.514
   49    HB2  CYS   7           HB2      CYS   7  20.502  23.083  29.656
   50    HB3  CYS   7           HB3      CYS   7  20.051  24.127  28.334
   51    H    PHE   8           H        PHE   8  19.297  27.074  29.247
   52    HA   PHE   8           HA       PHE   8  16.766  25.664  29.697
   53    HB2  PHE   8           HB2      PHE   8  17.173  26.818  31.883
   54    HB3  PHE   8           HB3      PHE   8  17.231  28.350  31.035
   55    HD1  PHE   8           HD1      PHE   8  15.224  29.426  30.192
   56    HD2  PHE   8           HD2      PHE   8  15.062  25.582  32.142
   57    HE1  PHE   8           HE1      PHE   8  12.733  29.582  30.319
   58    HE2  PHE   8           HE2      PHE   8  12.586  25.741  32.264
   59    HZ   PHE   8           HZ       PHE   8  11.425  27.723  31.327
   60    H    ALA   9           H        ALA   9  15.157  26.270  28.215
   61    HA   ALA   9           HA       ALA   9  14.336  27.070  26.290
   62    HB1  ALA   9           HB1      ALA   9  15.154  29.733  27.481
   63    HB2  ALA   9           HB2      ALA   9  13.913  29.466  26.239
   64    HB3  ALA   9           HB3      ALA   9  13.678  28.809  27.860
   65    H    ASN  10           H        ASN  10  16.751  25.992  25.758
   66    HA   ASN  10           HA       ASN  10  18.460  25.817  24.349
   67    HB2  ASN  10           HB2      ASN  10  17.034  27.900  22.654
   68    HB3  ASN  10           HB3      ASN  10  18.235  26.764  22.088
   69   HD21  ASN  10          HD21      ASN  10  15.044  25.594  21.128
   70   HD22  ASN  10          HD22      ASN  10  16.005  27.019  20.807
   71    H    VAL  11           H        VAL  11  18.708  27.989  26.499
   72    HA   VAL  11           HA       VAL  11  21.182  29.264  25.413
   73    HB   VAL  11           HB       VAL  11  19.090  30.611  27.169
   74   HG11  VAL  11          HG11      VAL  11  20.412  32.680  26.729
   75   HG12  VAL  11          HG12      VAL  11  21.360  31.513  27.639
   76   HG13  VAL  11          HG13      VAL  11  21.646  31.719  25.896
   77   HG21  VAL  11          HG21      VAL  11  18.297  30.443  24.851
   78   HG22  VAL  11          HG22      VAL  11  18.764  32.101  25.194
   79   HG23  VAL  11          HG23      VAL  11  19.841  31.060  24.239
   80    H    ASP  12           H        ASP  12  22.844  29.598  26.777
   81    HA   ASP  12           HA       ASP  12  23.141  27.988  29.203
   82    HB2  ASP  12           HB2      ASP  12  24.981  29.981  27.820
   83    HB3  ASP  12           HB3      ASP  12  25.450  28.917  29.129
   84    H    VAL  13           H        VAL  13  21.098  29.557  29.893
   85    HA   VAL  13           HA       VAL  13  21.878  32.165  30.983
   86    HB   VAL  13           HB       VAL  13  19.477  31.976  32.047
   87   HG11  VAL  13          HG11      VAL  13  18.499  32.892  30.070
   88   HG12  VAL  13          HG12      VAL  13  20.161  33.482  30.210
   89   HG13  VAL  13          HG13      VAL  13  19.771  32.186  29.057
   90   HG21  VAL  13          HG21      VAL  13  19.186  29.534  31.523
   91   HG22  VAL  13          HG22      VAL  13  17.911  30.601  30.917
   92   HG23  VAL  13          HG23      VAL  13  19.128  29.968  29.796
   93    H    LYS  14           H        LYS  14  21.281  28.989  32.390
   94    HA   LYS  14           HA       LYS  14  21.833  30.065  35.136
   95    HB2  LYS  14           HB2      LYS  14  20.854  27.285  34.424
   96    HB3  LYS  14           HB3      LYS  14  20.989  28.017  36.014
   97    HG2  LYS  14           HG2      LYS  14  18.995  28.718  33.850
   98    HG3  LYS  14           HG3      LYS  14  18.680  27.887  35.364
   99    HD2  LYS  14           HD2      LYS  14  19.540  30.769  35.036
  100    HD3  LYS  14           HD3      LYS  14  17.915  30.234  35.420
  101    HE2  LYS  14           HE2      LYS  14  20.307  29.687  37.236
  102    HE3  LYS  14           HE3      LYS  14  19.348  31.167  37.329
  103    HZ1  LYS  14           HZ1      LYS  14  18.254  28.433  37.734
  104    HZ2  LYS  14           HZ2      LYS  14  18.599  29.511  38.905
  105    HZ3  LYS  14           HZ3      LYS  14  17.396  29.847  37.836
  106    H    GLY  15           H        GLY  15  23.529  28.685  32.600
  107    HA2  GLY  15           HA2      GLY  15  26.032  29.039  33.692
  108    HA3  GLY  15           HA3      GLY  15  25.639  27.381  34.149
  109    H    ASP  16           H        ASP  16  27.817  27.709  32.591
  110    HA   ASP  16           HA       ASP  16  27.112  27.501  29.756
  111    HB2  ASP  16           HB2      ASP  16  29.578  27.396  29.405
  112    HB3  ASP  16           HB3      ASP  16  28.935  28.867  30.105
  113    H    CYS  17           H        CYS  17  26.328  25.711  28.998
  114    HA   CYS  17           HA       CYS  17  26.850  23.018  29.899
  115    HB2  CYS  17           HB2      CYS  17  24.944  23.012  28.827
  116    HB3  CYS  17           HB3      CYS  17  25.288  24.451  27.910
  117    H    LYS  18           H        LYS  18  28.571  25.080  27.543
  118    HA   LYS  18           HA       LYS  18  30.367  23.375  26.328
  119    HB2  LYS  18           HB2      LYS  18  30.525  25.737  25.961
  120    HB3  LYS  18           HB3      LYS  18  30.721  26.076  27.673
  121    HG2  LYS  18           HG2      LYS  18  32.804  26.490  26.564
  122    HG3  LYS  18           HG3      LYS  18  32.986  25.151  27.669
  123    HD2  LYS  18           HD2      LYS  18  34.231  24.583  25.731
  124    HD3  LYS  18           HD3      LYS  18  32.793  23.568  25.715
  125    HE2  LYS  18           HE2      LYS  18  33.158  24.319  23.473
  126    HE3  LYS  18           HE3      LYS  18  31.718  25.146  24.078
  127    HZ1  LYS  18           HZ1      LYS  18  34.437  26.362  23.944
  128    HZ2  LYS  18           HZ2      LYS  18  33.244  26.623  22.869
  129    HZ3  LYS  18           HZ3      LYS  18  33.040  27.132  24.404
  130    H    ARG  19           H        ARG  19  30.548  24.374  29.824
  131    HA   ARG  19           HA       ARG  19  32.955  23.029  30.429
  132    HB2  ARG  19           HB2      ARG  19  31.537  24.862  31.568
  133    HB3  ARG  19           HB3      ARG  19  30.653  23.550  32.329
  134    HG2  ARG  19           HG2      ARG  19  32.801  22.731  33.316
  135    HG3  ARG  19           HG3      ARG  19  33.664  24.050  32.502
  136    HD2  ARG  19           HD2      ARG  19  31.484  24.348  34.614
  137    HD3  ARG  19           HD3      ARG  19  33.225  24.572  34.817
  138    HE   ARG  19           HE       ARG  19  31.794  26.301  32.855
  139   HH11  ARG  19          HH11      ARG  19  31.745  28.365  33.126
  140   HH12  ARG  19          HH12      ARG  19  32.576  29.155  34.463
  141   HH21  ARG  19          HH21      ARG  19  33.477  26.226  35.997
  142   HH22  ARG  19          HH22      ARG  19  33.807  27.940  35.853
  143    H    HIS  20           H        HIS  20  29.706  21.649  30.164
  144    HA   HIS  20           HA       HIS  20  30.489  19.126  31.508
  145    HB2  HIS  20           HB2      HIS  20  28.211  19.722  31.712
  146    HB3  HIS  20           HB3      HIS  20  28.040  20.033  29.984
  147    HD2  HIS  20           HD2      HIS  20  27.134  18.158  28.538
  148    HE1  HIS  20           HE1      HIS  20  27.638  14.852  31.172
  149    HE2  HIS  20           HE2      HIS  20  26.679  15.592  28.938
  150    H    CYS  21           H        CYS  21  30.080  20.280  28.140
  151    HA   CYS  21           HA       CYS  21  30.952  17.752  26.996
  152    HB2  CYS  21           HB2      CYS  21  30.591  20.556  25.908
  153    HB3  CYS  21           HB3      CYS  21  31.065  19.226  24.885
  154    H    LYS  22           H        LYS  22  32.686  20.687  28.027
  155    HA   LYS  22           HA       LYS  22  35.192  20.109  26.930
  156    HB2  LYS  22           HB2      LYS  22  34.350  22.288  27.798
  157    HB3  LYS  22           HB3      LYS  22  34.391  21.642  29.450
  158    HG2  LYS  22           HG2      LYS  22  36.281  23.116  28.939
  159    HG3  LYS  22           HG3      LYS  22  36.819  21.475  29.340
  160    HD2  LYS  22           HD2      LYS  22  37.198  20.940  26.996
  161    HD3  LYS  22           HD3      LYS  22  36.460  22.487  26.476
  162    HE2  LYS  22           HE2      LYS  22  38.171  23.731  27.586
  163    HE3  LYS  22           HE3      LYS  22  38.831  22.259  28.347
  164    HZ1  LYS  22           HZ1      LYS  22  38.827  22.899  25.461
  165    HZ2  LYS  22           HZ2      LYS  22  40.138  22.824  26.410
  166    HZ3  LYS  22           HZ3      LYS  22  39.317  21.431  26.063
  167    H    ALA  23           H        ALA  23  33.729  18.874  29.907
  168    HA   ALA  23           HA       ALA  23  36.069  17.656  31.034
  169    HB1  ALA  23           HB1      ALA  23  34.411  16.322  32.266
  170    HB2  ALA  23           HB2      ALA  23  33.937  18.033  32.217
  171    HB3  ALA  23           HB3      ALA  23  33.132  16.854  31.159
  172    H    GLU  24           H        GLU  24  34.238  16.876  28.197
  173    HA   GLU  24           HA       GLU  24  35.749  14.349  27.757
  174    HB2  GLU  24           HB2      GLU  24  33.307  15.367  26.276
  175    HB3  GLU  24           HB3      GLU  24  33.997  13.759  26.203
  176    HG2  GLU  24           HG2      GLU  24  32.587  14.983  28.632
  177    HG3  GLU  24           HG3      GLU  24  31.873  13.896  27.472
  178    H    ASP  25           H        ASP  25  36.229  17.486  27.245
  179    HA   ASP  25           HA       ASP  25  37.085  18.921  25.840
  180    HB2  ASP  25           HB2      ASP  25  38.878  17.085  26.084
  181    HB3  ASP  25           HB3      ASP  25  38.601  16.782  24.379
  182    H    LYS  26           H        LYS  26  34.509  18.242  25.087
  183    HA   LYS  26           HA       LYS  26  34.483  18.650  22.126
  184    HB2  LYS  26           HB2      LYS  26  32.427  17.373  23.979
  185    HB3  LYS  26           HB3      LYS  26  32.150  17.759  22.290
  186    HG2  LYS  26           HG2      LYS  26  34.526  16.305  22.177
  187    HG3  LYS  26           HG3      LYS  26  33.630  15.500  23.488
  188    HD2  LYS  26           HD2      LYS  26  31.738  15.099  21.986
  189    HD3  LYS  26           HD3      LYS  26  32.458  16.158  20.769
  190    HE2  LYS  26           HE2      LYS  26  32.824  13.926  20.025
  191    HE3  LYS  26           HE3      LYS  26  34.372  14.644  20.491
  192    HZ1  LYS  26           HZ1      LYS  26  32.842  12.634  22.065
  193    HZ2  LYS  26           HZ2      LYS  26  34.220  12.411  21.239
  194    HZ3  LYS  26           HZ3      LYS  26  34.249  13.338  22.573
  195    H    GLU  27           H        GLU  27  32.803  19.809  21.184
  196    HA   GLU  27           HA       GLU  27  32.140  22.404  22.344
  197    HB2  GLU  27           HB2      GLU  27  31.160  20.874  19.919
  198    HB3  GLU  27           HB3      GLU  27  30.583  22.474  20.322
  199    HG2  GLU  27           HG2      GLU  27  33.529  21.853  19.855
  200    HG3  GLU  27           HG3      GLU  27  32.409  22.290  18.562
  201    H    GLY  28           H        GLY  28  30.145  22.992  23.196
  202    HA2  GLY  28           HA2      GLY  28  28.056  20.893  23.655
  203    HA3  GLY  28           HA3      GLY  28  28.606  21.920  24.968
  204    H    ILE  29           H        ILE  29  25.960  21.429  23.397
  205    HA   ILE  29           HA       ILE  29  25.182  24.271  23.320
  206    HB   ILE  29           HB       ILE  29  25.772  23.781  21.082
  207   HG12  ILE  29          HG12      ILE  29  23.705  25.169  21.699
  208   HG13  ILE  29          HG13      ILE  29  24.069  24.801  20.023
  209   HG21  ILE  29          HG21      ILE  29  23.859  21.446  21.117
  210   HG22  ILE  29          HG22      ILE  29  24.586  22.155  19.652
  211   HG23  ILE  29          HG23      ILE  29  25.618  21.425  20.893
  212   HD11  ILE  29          HD11      ILE  29  21.645  24.629  20.599
  213   HD12  ILE  29          HD12      ILE  29  22.326  23.165  19.877
  214   HD13  ILE  29          HD13      ILE  29  22.019  23.231  21.622
  215    H    CYS  30           H        CYS  30  23.248  24.765  24.079
  216    HA   CYS  30           HA       CYS  30  21.872  22.765  25.631
  217    HB2  CYS  30           HB2      CYS  30  21.266  25.685  25.079
  218    HB3  CYS  30           HB3      CYS  30  20.398  24.671  26.242
  219    H    HIS  31           H        HIS  31  20.674  21.250  24.621
  220    HA   HIS  31           HA       HIS  31  18.561  22.088  22.691
  221    HB2  HIS  31           HB2      HIS  31  19.741  19.409  23.444
  222    HB3  HIS  31           HB3      HIS  31  18.140  19.539  22.715
  223    HD2  HIS  31           HD2      HIS  31  21.768  20.690  21.865
  224    HE1  HIS  31           HE1      HIS  31  19.623  20.289  18.209
  225    HE2  HIS  31           HE2      HIS  31  21.885  20.811  19.228
  226    H    GLY  32           H        GLY  32  17.243  23.259  23.915
  227    HA2  GLY  32           HA2      GLY  32  15.502  23.705  25.349
  228    HA3  GLY  32           HA3      GLY  32  15.388  21.988  25.724
  229    H    THR  33           H        THR  33  15.771  21.515  27.736
  230    HA   THR  33           HA       THR  33  17.404  23.254  29.512
  231    HB   THR  33           HB       THR  33  16.300  22.199  31.389
  232    HG1  THR  33           HG1      THR  33  14.736  20.704  31.112
  233   HG21  THR  33          HG21      THR  33  14.204  23.005  29.337
  234   HG22  THR  33          HG22      THR  33  14.076  23.104  31.105
  235   HG23  THR  33          HG23      THR  33  15.202  24.155  30.233
  236    H    LYS  34           H        LYS  34  18.282  20.911  27.612
  237    HA   LYS  34           HA       LYS  34  20.223  19.772  29.571
  238    HB2  LYS  34           HB2      LYS  34  18.806  18.292  27.334
  239    HB3  LYS  34           HB3      LYS  34  20.114  17.617  28.289
  240    HG2  LYS  34           HG2      LYS  34  17.442  18.520  29.473
  241    HG3  LYS  34           HG3      LYS  34  17.820  16.874  28.957
  242    HD2  LYS  34           HD2      LYS  34  19.737  16.851  30.580
  243    HD3  LYS  34           HD3      LYS  34  19.143  18.400  31.232
  244    HE2  LYS  34           HE2      LYS  34  16.968  17.307  31.727
  245    HE3  LYS  34           HE3      LYS  34  17.575  15.792  31.028
  246    HZ1  LYS  34           HZ1      LYS  34  19.227  15.701  32.800
  247    HZ2  LYS  34           HZ2      LYS  34  18.675  17.095  33.456
  248    HZ3  LYS  34           HZ3      LYS  34  17.705  15.764  33.423
  249    H    CYS  35           H        CYS  35  22.204  18.937  28.546
  250    HA   CYS  35           HA       CYS  35  23.153  20.779  26.399
  251    HB2  CYS  35           HB2      CYS  35  24.237  20.740  28.673
  252    HB3  CYS  35           HB3      CYS  35  24.708  19.070  28.348
  253    H    LYS  36           H        LYS  36  24.232  19.947  24.560
  254    HA   LYS  36           HA       LYS  36  24.360  17.001  24.147
  255    HB2  LYS  36           HB2      LYS  36  22.143  17.954  23.406
  256    HB3  LYS  36           HB3      LYS  36  23.018  19.020  22.302
  257    HG2  LYS  36           HG2      LYS  36  23.733  17.268  20.948
  258    HG3  LYS  36           HG3      LYS  36  23.400  16.030  22.174
  259    HD2  LYS  36           HD2      LYS  36  21.222  17.633  20.757
  260    HD3  LYS  36           HD3      LYS  36  21.819  16.060  20.219
  261    HE2  LYS  36           HE2      LYS  36  21.222  15.093  22.452
  262    HE3  LYS  36           HE3      LYS  36  20.461  16.626  22.892
  263    HZ1  LYS  36           HZ1      LYS  36  18.914  14.943  21.987
  264    HZ2  LYS  36           HZ2      LYS  36  18.875  16.318  21.088
  265    HZ3  LYS  36           HZ3      LYS  36  19.689  14.989  20.538
  266    H    CYS  37           H        CYS  37  26.296  16.497  23.366
  267    HA   CYS  37           HA       CYS  37  28.094  18.698  22.716
  268    HB2  CYS  37           HB2      CYS  37  28.953  15.843  23.053
  269    HB3  CYS  37           HB3      CYS  37  29.920  17.293  23.073
  270    H    GLY  38           H        GLY  38  29.404  18.971  21.031
  271    HA2  GLY  38           HA2      GLY  38  28.444  17.920  18.394
  272    HA3  GLY  38           HA3      GLY  38  29.181  19.489  18.712
  273    H    VAL  39           H        VAL  39  30.972  19.496  17.477
  274    HA   VAL  39           HA       VAL  39  32.800  17.249  17.283
  275    HB   VAL  39           HB       VAL  39  34.287  18.926  16.123
  276   HG11  VAL  39          HG11      VAL  39  31.474  18.612  15.034
  277   HG12  VAL  39          HG12      VAL  39  32.941  18.970  14.097
  278   HG13  VAL  39          HG13      VAL  39  32.788  17.419  14.937
  279   HG21  VAL  39          HG21      VAL  39  31.942  20.825  16.406
  280   HG22  VAL  39          HG22      VAL  39  33.565  20.992  17.129
  281   HG23  VAL  39          HG23      VAL  39  33.369  21.044  15.377
  282    HA   PRO  40           HA       PRO  40  35.605  17.976  20.618
  283    HB2  PRO  40           HB2      PRO  40  38.048  17.454  19.531
  284    HB3  PRO  40           HB3      PRO  40  36.839  16.192  19.928
  285    HG2  PRO  40           HG2      PRO  40  37.336  17.508  17.241
  286    HG3  PRO  40           HG3      PRO  40  37.210  15.764  17.601
  287    HD2  PRO  40           HD2      PRO  40  35.102  17.134  16.657
  288    HD3  PRO  40           HD3      PRO  40  34.812  15.949  17.940
  289    H    ILE  41           H        ILE  41  36.988  19.613  21.460
  290    HA   ILE  41           HA       ILE  41  36.706  22.117  20.005
  291    HB   ILE  41           HB       ILE  41  37.480  23.214  21.952
  292   HG12  ILE  41          HG12      ILE  41  37.856  21.561  24.052
  293   HG13  ILE  41          HG13      ILE  41  38.548  20.546  22.792
  294   HG21  ILE  41          HG21      ILE  41  35.706  20.939  22.860
  295   HG22  ILE  41          HG22      ILE  41  35.767  22.582  23.510
  296   HG23  ILE  41          HG23      ILE  41  35.143  22.314  21.870
  297   HD11  ILE  41          HD11      ILE  41  40.264  21.996  23.856
  298   HD12  ILE  41          HD12      ILE  41  40.062  22.444  22.161
  299   HD13  ILE  41          HD13      ILE  41  39.333  23.437  23.398
  300    H    SER  42           H        SER  42  39.323  19.886  20.420
  301    HA   SER  42           HA       SER  42  41.489  19.842  19.908
  302    HB2  SER  42           HB2      SER  42  40.287  20.847  17.348
  303    HB3  SER  42           HB3      SER  42  41.641  19.708  17.559
  304    HG   SER  42           HG       SER  42  39.327  19.013  17.084
  305    H    TYR  43           H        TYR  43  41.385  22.303  21.184
  306    HA   TYR  43           HA       TYR  43  43.805  23.435  20.104
  307    HB2  TYR  43           HB2      TYR  43  43.359  25.461  19.402
  308    HB3  TYR  43           HB3      TYR  43  41.891  24.675  18.884
  309    HD1  TYR  43           HD1      TYR  43  39.757  25.036  20.230
  310    HD2  TYR  43           HD2      TYR  43  43.393  27.213  21.006
  311    HE1  TYR  43           HE1      TYR  43  38.473  26.726  21.494
  312    HE2  TYR  43           HE2      TYR  43  42.115  28.908  22.265
  313    HH   TYR  43           HH       TYR  43  38.535  28.772  22.553
  314    H    LEU  44           H        LEU  44  41.421  24.628  22.596
  315    HA   LEU  44           HA       LEU  44  43.428  24.058  24.679
  316    HB2  LEU  44           HB2      LEU  44  43.726  26.435  23.530
  317    HB3  LEU  44           HB3      LEU  44  42.351  26.879  24.512
  318    HG   LEU  44           HG       LEU  44  44.415  27.550  25.547
  319   HD11  LEU  44          HD11      LEU  44  42.619  26.687  27.087
  320   HD12  LEU  44          HD12      LEU  44  43.503  25.147  27.163
  321   HD13  LEU  44          HD13      LEU  44  44.261  26.636  27.746
  322   HD21  LEU  44          HD21      LEU  44  45.884  25.860  24.472
  323   HD22  LEU  44          HD22      LEU  44  46.179  26.038  26.213
  324   HD23  LEU  44          HD23      LEU  44  45.288  24.635  25.606
  Start of MODEL   19
    1    H1   ALA   1           H1       ALA   1  28.291  24.910  34.871
    2    H2   ALA   1           H2       ALA   1  28.811  24.391  33.413
    3    H3   ALA   1           H3       ALA   1  29.302  23.609  34.799
    4    HA   ALA   1           HA       ALA   1  26.570  23.751  33.739
    5    HB1  ALA   1           HB1      ALA   1  26.803  21.286  33.378
    6    HB2  ALA   1           HB2      ALA   1  27.937  22.219  32.395
    7    HB3  ALA   1           HB3      ALA   1  28.505  21.395  33.855
    8    H    LYS   2           H        LYS   2  24.858  22.808  35.089
    9    HA   LYS   2           HA       LYS   2  25.633  21.833  37.763
   10    HB2  LYS   2           HB2      LYS   2  24.089  23.456  38.824
   11    HB3  LYS   2           HB3      LYS   2  25.508  24.158  38.109
   12    HG2  LYS   2           HG2      LYS   2  24.206  24.989  36.171
   13    HG3  LYS   2           HG3      LYS   2  22.768  24.178  36.776
   14    HD2  LYS   2           HD2      LYS   2  22.647  26.533  37.353
   15    HD3  LYS   2           HD3      LYS   2  22.849  25.591  38.825
   16    HE2  LYS   2           HE2      LYS   2  25.370  26.112  38.665
   17    HE3  LYS   2           HE3      LYS   2  24.955  27.237  37.360
   18    HZ1  LYS   2           HZ1      LYS   2  24.020  27.353  40.172
   19    HZ2  LYS   2           HZ2      LYS   2  25.079  28.382  39.448
   20    HZ3  LYS   2           HZ3      LYS   2  23.489  28.373  38.986
   21    H    ASN   3           H        ASN   3  22.774  22.205  38.498
   22    HA   ASN   3           HA       ASN   3  21.760  19.607  38.219
   23    HB2  ASN   3           HB2      ASN   3  19.638  20.643  38.964
   24    HB3  ASN   3           HB3      ASN   3  21.006  21.237  39.901
   25   HD21  ASN   3          HD21      ASN   3  18.689  23.953  38.114
   26   HD22  ASN   3          HD22      ASN   3  18.133  22.348  38.539
   27    H    GLN   4           H        GLN   4  21.254  22.464  36.230
   28    HA   GLN   4           HA       GLN   4  19.628  20.926  34.254
   29    HB2  GLN   4           HB2      GLN   4  18.611  22.951  33.620
   30    HB3  GLN   4           HB3      GLN   4  18.425  22.616  35.339
   31    HG2  GLN   4           HG2      GLN   4  20.438  24.282  35.690
   32    HG3  GLN   4           HG3      GLN   4  20.061  24.785  34.013
   33   HE21  GLN   4          HE21      GLN   4  16.652  25.439  34.865
   34   HE22  GLN   4          HE22      GLN   4  17.740  25.094  33.541
   35    H    PHE   5           H        PHE   5  22.636  21.180  34.634
   36    HA   PHE   5           HA       PHE   5  24.527  21.371  33.408
   37    HB2  PHE   5           HB2      PHE   5  22.682  21.292  31.003
   38    HB3  PHE   5           HB3      PHE   5  24.433  21.196  30.960
   39    HD1  PHE   5           HD1      PHE   5  25.579  19.194  31.273
   40    HD2  PHE   5           HD2      PHE   5  21.402  19.422  32.325
   41    HE1  PHE   5           HE1      PHE   5  25.536  16.750  31.689
   42    HE2  PHE   5           HE2      PHE   5  21.392  16.985  32.805
   43    HZ   PHE   5           HZ       PHE   5  23.487  15.658  32.506
   44    H    GLY   6           H        GLY   6  22.397  23.883  33.543
   45    HA2  GLY   6           HA2      GLY   6  23.088  26.202  33.661
   46    HA3  GLY   6           HA3      GLY   6  24.288  25.858  32.402
   47    H    CYS   7           H        CYS   7  21.753  24.114  31.322
   48    HA   CYS   7           HA       CYS   7  21.077  26.195  29.374
   49    HB2  CYS   7           HB2      CYS   7  20.500  23.224  29.480
   50    HB3  CYS   7           HB3      CYS   7  20.057  24.280  28.163
   51    H    PHE   8           H        PHE   8  19.174  27.084  29.037
   52    HA   PHE   8           HA       PHE   8  16.706  25.683  29.754
   53    HB2  PHE   8           HB2      PHE   8  17.191  27.021  31.821
   54    HB3  PHE   8           HB3      PHE   8  17.148  28.484  30.853
   55    HD1  PHE   8           HD1      PHE   8  15.051  29.377  29.967
   56    HD2  PHE   8           HD2      PHE   8  15.158  25.745  32.291
   57    HE1  PHE   8           HE1      PHE   8  12.557  29.402  30.141
   58    HE2  PHE   8           HE2      PHE   8  12.686  25.745  32.416
   59    HZ   PHE   8           HZ       PHE   8  11.382  27.555  31.331
   60    H    ALA   9           H        ALA   9  15.047  26.136  28.271
   61    HA   ALA   9           HA       ALA   9  14.173  26.764  26.296
   62    HB1  ALA   9           HB1      ALA   9  13.474  28.583  27.739
   63    HB2  ALA   9           HB2      ALA   9  14.956  29.501  27.357
   64    HB3  ALA   9           HB3      ALA   9  13.756  29.188  26.097
   65    H    ASN  10           H        ASN  10  16.548  25.704  25.736
   66    HA   ASN  10           HA       ASN  10  18.247  25.478  24.279
   67    HB2  ASN  10           HB2      ASN  10  16.558  27.345  22.566
   68    HB3  ASN  10           HB3      ASN  10  17.908  26.407  21.959
   69   HD21  ASN  10          HD21      ASN  10  14.878  24.718  21.192
   70   HD22  ASN  10          HD22      ASN  10  15.593  26.264  20.785
   71    H    VAL  11           H        VAL  11  18.410  27.897  26.247
   72    HA   VAL  11           HA       VAL  11  20.816  29.131  24.971
   73    HB   VAL  11           HB       VAL  11  18.790  30.510  26.763
   74   HG11  VAL  11          HG11      VAL  11  21.237  31.617  25.284
   75   HG12  VAL  11          HG12      VAL  11  20.042  32.580  26.158
   76   HG13  VAL  11          HG13      VAL  11  21.085  31.481  27.050
   77   HG21  VAL  11          HG21      VAL  11  19.411  30.879  23.786
   78   HG22  VAL  11          HG22      VAL  11  17.925  30.189  24.454
   79   HG23  VAL  11          HG23      VAL  11  18.300  31.881  24.749
   80    H    ASP  12           H        ASP  12  22.527  29.617  26.188
   81    HA   ASP  12           HA       ASP  12  23.176  27.969  28.480
   82    HB2  ASP  12           HB2      ASP  12  24.493  28.581  26.356
   83    HB3  ASP  12           HB3      ASP  12  24.698  30.179  27.031
   84    H    VAL  13           H        VAL  13  21.067  29.609  29.224
   85    HA   VAL  13           HA       VAL  13  21.835  32.176  30.341
   86    HB   VAL  13           HB       VAL  13  19.470  31.877  31.496
   87   HG11  VAL  13          HG11      VAL  13  19.578  32.247  28.499
   88   HG12  VAL  13          HG12      VAL  13  18.392  32.887  29.645
   89   HG13  VAL  13          HG13      VAL  13  20.055  33.479  29.670
   90   HG21  VAL  13          HG21      VAL  13  19.104  30.000  29.138
   91   HG22  VAL  13          HG22      VAL  13  19.240  29.445  30.813
   92   HG23  VAL  13          HG23      VAL  13  17.914  30.524  30.335
   93    H    LYS  14           H        LYS  14  20.907  29.099  31.887
   94    HA   LYS  14           HA       LYS  14  21.173  30.230  34.595
   95    HB2  LYS  14           HB2      LYS  14  20.422  27.454  33.591
   96    HB3  LYS  14           HB3      LYS  14  20.420  27.937  35.286
   97    HG2  LYS  14           HG2      LYS  14  18.691  29.244  33.130
   98    HG3  LYS  14           HG3      LYS  14  18.163  27.970  34.217
   99    HD2  LYS  14           HD2      LYS  14  18.639  29.418  36.174
  100    HD3  LYS  14           HD3      LYS  14  19.096  30.739  35.072
  101    HE2  LYS  14           HE2      LYS  14  16.872  30.819  34.126
  102    HE3  LYS  14           HE3      LYS  14  16.369  29.391  35.057
  103    HZ1  LYS  14           HZ1      LYS  14  15.693  31.524  36.108
  104    HZ2  LYS  14           HZ2      LYS  14  16.696  30.636  37.084
  105    HZ3  LYS  14           HZ3      LYS  14  17.264  31.946  36.277
  106    H    GLY  15           H        GLY  15  23.323  28.826  32.417
  107    HA2  GLY  15           HA2      GLY  15  25.630  29.325  33.885
  108    HA3  GLY  15           HA3      GLY  15  25.195  27.665  34.302
  109    H    ASP  16           H        ASP  16  27.420  27.457  33.204
  110    HA   ASP  16           HA       ASP  16  27.299  27.548  30.264
  111    HB2  ASP  16           HB2      ASP  16  29.636  27.305  30.304
  112    HB3  ASP  16           HB3      ASP  16  29.189  28.539  31.487
  113    H    CYS  17           H        CYS  17  26.730  25.919  29.062
  114    HA   CYS  17           HA       CYS  17  26.900  23.090  29.900
  115    HB2  CYS  17           HB2      CYS  17  25.035  23.682  28.664
  116    HB3  CYS  17           HB3      CYS  17  25.909  24.730  27.575
  117    H    LYS  18           H        LYS  18  29.037  25.315  28.267
  118    HA   LYS  18           HA       LYS  18  30.799  23.715  26.844
  119    HB2  LYS  18           HB2      LYS  18  31.217  26.089  27.025
  120    HB3  LYS  18           HB3      LYS  18  31.223  26.026  28.782
  121    HG2  LYS  18           HG2      LYS  18  33.442  26.433  28.168
  122    HG3  LYS  18           HG3      LYS  18  33.403  24.785  28.717
  123    HD2  LYS  18           HD2      LYS  18  34.663  24.446  26.869
  124    HD3  LYS  18           HD3      LYS  18  33.097  24.311  26.053
  125    HE2  LYS  18           HE2      LYS  18  33.222  26.674  25.377
  126    HE3  LYS  18           HE3      LYS  18  34.670  26.916  26.371
  127    HZ1  LYS  18           HZ1      LYS  18  34.519  25.167  23.982
  128    HZ2  LYS  18           HZ2      LYS  18  35.193  26.629  24.021
  129    HZ3  LYS  18           HZ3      LYS  18  35.904  25.442  24.905
  130    H    ARG  19           H        ARG  19  30.883  24.114  30.454
  131    HA   ARG  19           HA       ARG  19  33.118  22.400  30.752
  132    HB2  ARG  19           HB2      ARG  19  31.083  23.560  32.616
  133    HB3  ARG  19           HB3      ARG  19  32.106  22.241  33.204
  134    HG2  ARG  19           HG2      ARG  19  34.148  23.397  32.447
  135    HG3  ARG  19           HG3      ARG  19  33.203  24.781  31.911
  136    HD2  ARG  19           HD2      ARG  19  33.304  23.766  34.790
  137    HD3  ARG  19           HD3      ARG  19  34.365  25.017  34.122
  138    HE   ARG  19           HE       ARG  19  31.683  25.772  33.601
  139   HH11  ARG  19          HH11      ARG  19  33.993  25.636  36.272
  140   HH12  ARG  19          HH12      ARG  19  33.315  27.025  37.049
  141   HH21  ARG  19          HH21      ARG  19  30.805  27.392  34.658
  142   HH22  ARG  19          HH22      ARG  19  31.553  28.105  36.081
  143    H    HIS  20           H        HIS  20  29.798  21.350  30.388
  144    HA   HIS  20           HA       HIS  20  30.360  18.656  31.435
  145    HB2  HIS  20           HB2      HIS  20  28.095  19.313  31.613
  146    HB3  HIS  20           HB3      HIS  20  28.037  19.898  29.947
  147    HD2  HIS  20           HD2      HIS  20  27.148  18.295  28.179
  148    HE1  HIS  20           HE1      HIS  20  27.341  14.620  30.305
  149    HE2  HIS  20           HE2      HIS  20  26.575  15.722  28.149
  150    H    CYS  21           H        CYS  21  30.342  20.189  28.202
  151    HA   CYS  21           HA       CYS  21  31.145  17.680  26.903
  152    HB2  CYS  21           HB2      CYS  21  30.724  20.528  25.984
  153    HB3  CYS  21           HB3      CYS  21  31.132  19.215  24.897
  154    H    LYS  22           H        LYS  22  32.836  20.599  28.038
  155    HA   LYS  22           HA       LYS  22  35.419  20.133  27.005
  156    HB2  LYS  22           HB2      LYS  22  34.650  22.184  28.171
  157    HB3  LYS  22           HB3      LYS  22  34.499  21.262  29.662
  158    HG2  LYS  22           HG2      LYS  22  36.377  22.611  29.883
  159    HG3  LYS  22           HG3      LYS  22  36.971  20.968  29.736
  160    HD2  LYS  22           HD2      LYS  22  36.931  22.991  27.432
  161    HD3  LYS  22           HD3      LYS  22  38.260  22.783  28.562
  162    HE2  LYS  22           HE2      LYS  22  38.096  20.230  27.848
  163    HE3  LYS  22           HE3      LYS  22  37.321  20.916  26.402
  164    HZ1  LYS  22           HZ1      LYS  22  39.344  22.388  26.256
  165    HZ2  LYS  22           HZ2      LYS  22  40.003  21.506  27.476
  166    HZ3  LYS  22           HZ3      LYS  22  39.664  20.769  26.032
  167    H    ALA  23           H        ALA  23  33.786  18.516  29.707
  168    HA   ALA  23           HA       ALA  23  35.965  17.064  30.800
  169    HB1  ALA  23           HB1      ALA  23  33.070  16.168  30.464
  170    HB2  ALA  23           HB2      ALA  23  34.230  15.660  31.701
  171    HB3  ALA  23           HB3      ALA  23  33.613  17.315  31.709
  172    H    GLU  24           H        GLU  24  34.368  16.682  27.731
  173    HA   GLU  24           HA       GLU  24  35.791  14.129  27.131
  174    HB2  GLU  24           HB2      GLU  24  33.309  15.382  25.881
  175    HB3  GLU  24           HB3      GLU  24  34.035  13.843  25.411
  176    HG2  GLU  24           HG2      GLU  24  33.547  12.889  27.607
  177    HG3  GLU  24           HG3      GLU  24  32.908  14.430  28.190
  178    H    ASP  25           H        ASP  25  36.531  17.187  26.926
  179    HA   ASP  25           HA       ASP  25  37.452  18.696  25.586
  180    HB2  ASP  25           HB2      ASP  25  39.111  16.752  25.585
  181    HB3  ASP  25           HB3      ASP  25  38.609  16.454  23.919
  182    H    LYS  26           H        LYS  26  34.808  18.308  25.021
  183    HA   LYS  26           HA       LYS  26  34.452  18.761  22.080
  184    HB2  LYS  26           HB2      LYS  26  32.576  17.667  24.213
  185    HB3  LYS  26           HB3      LYS  26  32.089  18.021  22.572
  186    HG2  LYS  26           HG2      LYS  26  34.386  16.103  22.920
  187    HG3  LYS  26           HG3      LYS  26  32.799  15.581  23.472
  188    HD2  LYS  26           HD2      LYS  26  31.853  16.186  21.221
  189    HD3  LYS  26           HD3      LYS  26  33.506  16.544  20.683
  190    HE2  LYS  26           HE2      LYS  26  33.277  14.316  19.994
  191    HE3  LYS  26           HE3      LYS  26  34.059  14.139  21.569
  192    HZ1  LYS  26           HZ1      LYS  26  31.182  13.798  20.962
  193    HZ2  LYS  26           HZ2      LYS  26  32.227  12.613  21.446
  194    HZ3  LYS  26           HZ3      LYS  26  31.742  13.790  22.485
  195    H    GLU  27           H        GLU  27  32.841  20.293  21.444
  196    HA   GLU  27           HA       GLU  27  32.409  22.595  23.215
  197    HB2  GLU  27           HB2      GLU  27  31.551  21.893  20.385
  198    HB3  GLU  27           HB3      GLU  27  30.990  23.338  21.213
  199    HG2  GLU  27           HG2      GLU  27  33.950  22.758  20.826
  200    HG3  GLU  27           HG3      GLU  27  32.968  23.584  19.622
  201    H    GLY  28           H        GLY  28  30.443  23.225  24.010
  202    HA2  GLY  28           HA2      GLY  28  28.313  21.148  24.256
  203    HA3  GLY  28           HA3      GLY  28  28.553  22.443  25.377
  204    H    ILE  29           H        ILE  29  26.061  21.674  24.013
  205    HA   ILE  29           HA       ILE  29  25.254  24.313  23.096
  206    HB   ILE  29           HB       ILE  29  25.969  23.302  21.031
  207   HG12  ILE  29          HG12      ILE  29  23.879  24.756  21.251
  208   HG13  ILE  29          HG13      ILE  29  24.297  24.009  19.721
  209   HG21  ILE  29          HG21      ILE  29  24.863  21.367  19.993
  210   HG22  ILE  29          HG22      ILE  29  25.830  20.945  21.409
  211   HG23  ILE  29          HG23      ILE  29  24.059  21.011  21.537
  212   HD11  ILE  29          HD11      ILE  29  22.574  22.332  19.955
  213   HD12  ILE  29          HD12      ILE  29  22.196  22.874  21.601
  214   HD13  ILE  29          HD13      ILE  29  21.865  23.933  20.215
  215    H    CYS  30           H        CYS  30  23.181  24.782  23.738
  216    HA   CYS  30           HA       CYS  30  21.996  22.885  25.589
  217    HB2  CYS  30           HB2      CYS  30  21.314  25.734  24.856
  218    HB3  CYS  30           HB3      CYS  30  20.433  24.780  26.058
  219    H    HIS  31           H        HIS  31  20.606  21.429  25.159
  220    HA   HIS  31           HA       HIS  31  18.439  21.777  23.107
  221    HB2  HIS  31           HB2      HIS  31  19.750  19.331  24.337
  222    HB3  HIS  31           HB3      HIS  31  18.131  19.264  23.647
  223    HD2  HIS  31           HD2      HIS  31  21.547  20.678  22.241
  224    HE1  HIS  31           HE1      HIS  31  19.681  18.320  19.230
  225    HE2  HIS  31           HE2      HIS  31  21.682  19.786  19.769
  226    H    GLY  32           H        GLY  32  17.068  23.121  24.301
  227    HA2  GLY  32           HA2      GLY  32  15.446  23.690  25.825
  228    HA3  GLY  32           HA3      GLY  32  15.328  21.981  26.245
  229    H    THR  33           H        THR  33  15.640  21.621  28.310
  230    HA   THR  33           HA       THR  33  17.278  23.339  30.069
  231    HB   THR  33           HB       THR  33  16.346  22.043  31.892
  232    HG1  THR  33           HG1      THR  33  14.871  20.590  29.965
  233   HG21  THR  33          HG21      THR  33  14.021  22.624  31.731
  234   HG22  THR  33          HG22      THR  33  14.954  23.884  30.897
  235   HG23  THR  33          HG23      THR  33  14.082  22.666  29.958
  236    H    LYS  34           H        LYS  34  18.309  21.189  28.007
  237    HA   LYS  34           HA       LYS  34  20.235  19.765  29.808
  238    HB2  LYS  34           HB2      LYS  34  18.830  18.667  27.340
  239    HB3  LYS  34           HB3      LYS  34  19.975  17.815  28.356
  240    HG2  LYS  34           HG2      LYS  34  17.236  18.733  29.307
  241    HG3  LYS  34           HG3      LYS  34  17.635  17.127  28.706
  242    HD2  LYS  34           HD2      LYS  34  19.377  16.900  30.494
  243    HD3  LYS  34           HD3      LYS  34  18.846  18.435  31.185
  244    HE2  LYS  34           HE2      LYS  34  17.030  16.019  30.732
  245    HE3  LYS  34           HE3      LYS  34  17.892  16.342  32.241
  246    HZ1  LYS  34           HZ1      LYS  34  15.743  18.009  31.057
  247    HZ2  LYS  34           HZ2      LYS  34  15.747  17.214  32.489
  248    HZ3  LYS  34           HZ3      LYS  34  16.704  18.535  32.284
  249    H    CYS  35           H        CYS  35  22.078  18.793  28.542
  250    HA   CYS  35           HA       CYS  35  23.129  20.772  26.546
  251    HB2  CYS  35           HB2      CYS  35  23.998  21.142  28.787
  252    HB3  CYS  35           HB3      CYS  35  24.476  19.442  28.889
  253    H    LYS  36           H        LYS  36  24.086  19.972  24.774
  254    HA   LYS  36           HA       LYS  36  24.637  17.097  24.406
  255    HB2  LYS  36           HB2      LYS  36  22.678  18.831  23.144
  256    HB3  LYS  36           HB3      LYS  36  23.929  18.538  21.963
  257    HG2  LYS  36           HG2      LYS  36  22.148  16.923  21.752
  258    HG3  LYS  36           HG3      LYS  36  23.620  16.083  22.269
  259    HD2  LYS  36           HD2      LYS  36  22.776  15.956  24.584
  260    HD3  LYS  36           HD3      LYS  36  21.366  16.957  24.149
  261    HE2  LYS  36           HE2      LYS  36  20.621  15.267  22.566
  262    HE3  LYS  36           HE3      LYS  36  22.063  14.289  22.874
  263    HZ1  LYS  36           HZ1      LYS  36  20.045  14.953  24.947
  264    HZ2  LYS  36           HZ2      LYS  36  20.102  13.516  24.125
  265    HZ3  LYS  36           HZ3      LYS  36  21.302  13.913  25.134
  266    H    CYS  37           H        CYS  37  26.334  16.721  23.020
  267    HA   CYS  37           HA       CYS  37  28.346  18.923  23.045
  268    HB2  CYS  37           HB2      CYS  37  28.821  15.955  23.081
  269    HB3  CYS  37           HB3      CYS  37  30.039  17.213  23.187
  270    H    GLY  38           H        GLY  38  29.285  19.666  21.347
  271    HA2  GLY  38           HA2      GLY  38  28.518  18.780  18.655
  272    HA3  GLY  38           HA3      GLY  38  29.346  20.280  19.140
  273    H    VAL  39           H        VAL  39  31.161  20.369  17.988
  274    HA   VAL  39           HA       VAL  39  32.805  18.078  17.383
  275    HB   VAL  39           HB       VAL  39  34.245  19.795  16.240
  276   HG11  VAL  39          HG11      VAL  39  32.457  18.619  15.035
  277   HG12  VAL  39          HG12      VAL  39  31.287  19.882  15.488
  278   HG13  VAL  39          HG13      VAL  39  32.662  20.262  14.440
  279   HG21  VAL  39          HG21      VAL  39  32.064  21.804  16.968
  280   HG22  VAL  39          HG22      VAL  39  33.671  21.734  17.729
  281   HG23  VAL  39          HG23      VAL  39  33.528  22.070  16.008
  282    HA   PRO  40           HA       PRO  40  35.992  18.441  20.491
  283    HB2  PRO  40           HB2      PRO  40  37.886  18.693  18.155
  284    HB3  PRO  40           HB3      PRO  40  38.020  17.662  19.623
  285    HG2  PRO  40           HG2      PRO  40  37.208  16.599  17.253
  286    HG3  PRO  40           HG3      PRO  40  36.445  16.120  18.804
  287    HD2  PRO  40           HD2      PRO  40  35.344  18.007  16.706
  288    HD3  PRO  40           HD3      PRO  40  34.523  16.807  17.736
  289    H    ILE  41           H        ILE  41  37.206  20.120  21.541
  290    HA   ILE  41           HA       ILE  41  36.260  22.688  20.783
  291    HB   ILE  41           HB       ILE  41  37.558  23.610  22.667
  292   HG12  ILE  41          HG12      ILE  41  38.288  21.912  24.381
  293   HG13  ILE  41          HG13      ILE  41  38.389  20.712  23.114
  294   HG21  ILE  41          HG21      ILE  41  35.857  21.188  23.320
  295   HG22  ILE  41          HG22      ILE  41  36.102  22.626  24.326
  296   HG23  ILE  41          HG23      ILE  41  35.220  22.764  22.809
  297   HD11  ILE  41          HD11      ILE  41  39.906  23.308  22.826
  298   HD12  ILE  41          HD12      ILE  41  40.509  22.067  23.949
  299   HD13  ILE  41          HD13      ILE  41  40.337  21.670  22.246
  300    H    SER  42           H        SER  42  39.565  21.410  20.293
  301    HA   SER  42           HA       SER  42  41.437  22.429  19.667
  302    HB2  SER  42           HB2      SER  42  39.487  22.752  17.364
  303    HB3  SER  42           HB3      SER  42  41.267  22.795  17.233
  304    HG   SER  42           HG       SER  42  39.984  20.637  17.066
  305    H    TYR  43           H        TYR  43  40.082  24.421  21.178
  306    HA   TYR  43           HA       TYR  43  42.062  26.441  20.701
  307    HB2  TYR  43           HB2      TYR  43  40.782  28.407  20.532
  308    HB3  TYR  43           HB3      TYR  43  40.336  27.314  19.229
  309    HD1  TYR  43           HD1      TYR  43  39.206  28.918  22.365
  310    HD2  TYR  43           HD2      TYR  43  38.128  26.338  19.090
  311    HE1  TYR  43           HE1      TYR  43  36.889  28.808  23.217
  312    HE2  TYR  43           HE2      TYR  43  35.819  26.196  19.957
  313    HH   TYR  43           HH       TYR  43  34.356  26.820  21.612
  314    H    LEU  44           H        LEU  44  39.085  25.891  22.700
  315    HA   LEU  44           HA       LEU  44  40.774  26.010  25.110
  316    HB2  LEU  44           HB2      LEU  44  39.904  28.336  24.587
  317    HB3  LEU  44           HB3      LEU  44  38.279  27.701  24.867
  318    HG   LEU  44           HG       LEU  44  39.018  27.074  27.204
  319   HD11  LEU  44          HD11      LEU  44  40.996  28.230  28.124
  320   HD12  LEU  44          HD12      LEU  44  41.456  27.040  26.904
  321   HD13  LEU  44          HD13      LEU  44  41.443  28.768  26.490
  322   HD21  LEU  44          HD21      LEU  44  38.858  29.368  28.046
  323   HD22  LEU  44          HD22      LEU  44  39.265  30.006  26.431
  324   HD23  LEU  44          HD23      LEU  44  37.742  29.126  26.693
  Start of MODEL   20
    1    H1   ALA   1           H1       ALA   1  28.875  23.852  34.358
    2    H2   ALA   1           H2       ALA   1  29.640  22.985  35.531
    3    H3   ALA   1           H3       ALA   1  28.499  24.076  35.953
    4    HA   ALA   1           HA       ALA   1  26.803  22.755  34.820
    5    HB1  ALA   1           HB1      ALA   1  28.302  21.667  33.210
    6    HB2  ALA   1           HB2      ALA   1  29.051  20.737  34.528
    7    HB3  ALA   1           HB3      ALA   1  27.345  20.487  34.120
    8    H    LYS   2           H        LYS   2  25.454  22.146  36.409
    9    HA   LYS   2           HA       LYS   2  26.556  20.952  38.922
   10    HB2  LYS   2           HB2      LYS   2  26.576  23.353  39.179
   11    HB3  LYS   2           HB3      LYS   2  24.913  23.491  38.602
   12    HG2  LYS   2           HG2      LYS   2  24.044  22.429  40.595
   13    HG3  LYS   2           HG3      LYS   2  25.673  21.968  41.123
   14    HD2  LYS   2           HD2      LYS   2  24.906  23.888  42.404
   15    HD3  LYS   2           HD3      LYS   2  26.284  24.325  41.400
   16    HE2  LYS   2           HE2      LYS   2  24.626  25.276  39.699
   17    HE3  LYS   2           HE3      LYS   2  23.351  25.005  40.908
   18    HZ1  LYS   2           HZ1      LYS   2  25.760  26.716  41.242
   19    HZ2  LYS   2           HZ2      LYS   2  24.227  27.266  41.054
   20    HZ3  LYS   2           HZ3      LYS   2  24.646  26.457  42.422
   21    H    ASN   3           H        ASN   3  23.449  22.003  37.484
   22    HA   ASN   3           HA       ASN   3  22.141  19.496  38.500
   23    HB2  ASN   3           HB2      ASN   3  20.276  20.944  39.253
   24    HB3  ASN   3           HB3      ASN   3  21.776  21.268  40.123
   25   HD21  ASN   3          HD21      ASN   3  20.207  24.536  39.287
   26   HD22  ASN   3          HD22      ASN   3  19.767  23.133  40.300
   27    H    GLN   4           H        GLN   4  21.938  22.162  36.233
   28    HA   GLN   4           HA       GLN   4  20.257  20.519  34.369
   29    HB2  GLN   4           HB2      GLN   4  18.920  22.440  33.832
   30    HB3  GLN   4           HB3      GLN   4  18.900  22.228  35.580
   31    HG2  GLN   4           HG2      GLN   4  20.651  24.035  35.770
   32    HG3  GLN   4           HG3      GLN   4  20.567  24.260  34.018
   33   HE21  GLN   4          HE21      GLN   4  18.489  25.042  33.062
   34   HE22  GLN   4          HE22      GLN   4  17.491  26.030  34.139
   35    H    PHE   5           H        PHE   5  23.254  21.277  34.540
   36    HA   PHE   5           HA       PHE   5  24.948  22.061  33.317
   37    HB2  PHE   5           HB2      PHE   5  23.232  21.628  30.885
   38    HB3  PHE   5           HB3      PHE   5  24.983  21.598  31.006
   39    HD1  PHE   5           HD1      PHE   5  21.878  19.700  31.464
   40    HD2  PHE   5           HD2      PHE   5  26.133  19.649  32.098
   41    HE1  PHE   5           HE1      PHE   5  21.811  17.220  31.720
   42    HE2  PHE   5           HE2      PHE   5  26.058  17.193  32.412
   43    HZ   PHE   5           HZ       PHE   5  23.892  15.968  32.197
   44    H    GLY   6           H        GLY   6  22.767  24.111  34.103
   45    HA2  GLY   6           HA2      GLY   6  22.564  26.395  33.938
   46    HA3  GLY   6           HA3      GLY   6  23.923  26.393  32.807
   47    H    CYS   7           H        CYS   7  21.729  24.302  31.472
   48    HA   CYS   7           HA       CYS   7  20.980  26.278  29.462
   49    HB2  CYS   7           HB2      CYS   7  20.577  23.282  29.652
   50    HB3  CYS   7           HB3      CYS   7  20.159  24.251  28.262
   51    H    PHE   8           H        PHE   8  19.046  27.145  29.102
   52    HA   PHE   8           HA       PHE   8  16.611  25.615  29.711
   53    HB2  PHE   8           HB2      PHE   8  16.918  26.965  31.762
   54    HB3  PHE   8           HB3      PHE   8  16.929  28.430  30.794
   55    HD1  PHE   8           HD1      PHE   8  14.895  29.322  29.797
   56    HD2  PHE   8           HD2      PHE   8  14.836  25.663  32.076
   57    HE1  PHE   8           HE1      PHE   8  12.407  29.393  29.858
   58    HE2  PHE   8           HE2      PHE   8  12.354  25.727  32.134
   59    HZ   PHE   8           HZ       PHE   8  11.136  27.580  31.010
   60    H    ALA   9           H        ALA   9  15.004  25.918  28.224
   61    HA   ALA   9           HA       ALA   9  14.157  26.344  26.178
   62    HB1  ALA   9           HB1      ALA   9  13.442  28.645  25.835
   63    HB2  ALA   9           HB2      ALA   9  13.249  28.165  27.529
   64    HB3  ALA   9           HB3      ALA   9  14.605  29.211  27.052
   65    H    ASN  10           H        ASN  10  16.582  25.454  25.743
   66    HA   ASN  10           HA       ASN  10  18.232  25.219  24.242
   67    HB2  ASN  10           HB2      ASN  10  16.690  27.198  22.510
   68    HB3  ASN  10           HB3      ASN  10  17.907  26.081  21.936
   69   HD21  ASN  10          HD21      ASN  10  14.665  24.794  21.210
   70   HD22  ASN  10          HD22      ASN  10  15.464  26.321  20.884
   71    H    VAL  11           H        VAL  11  18.325  27.720  26.205
   72    HA   VAL  11           HA       VAL  11  20.783  28.917  24.979
   73    HB   VAL  11           HB       VAL  11  18.667  30.377  26.607
   74   HG11  VAL  11          HG11      VAL  11  21.159  31.357  25.116
   75   HG12  VAL  11          HG12      VAL  11  19.917  32.403  25.824
   76   HG13  VAL  11          HG13      VAL  11  20.900  31.399  26.876
   77   HG21  VAL  11          HG21      VAL  11  18.160  31.606  24.526
   78   HG22  VAL  11          HG22      VAL  11  19.291  30.581  23.623
   79   HG23  VAL  11          HG23      VAL  11  17.812  29.895  24.321
   80    H    ASP  12           H        ASP  12  22.467  29.404  26.287
   81    HA   ASP  12           HA       ASP  12  22.781  28.123  28.858
   82    HB2  ASP  12           HB2      ASP  12  25.044  28.784  28.667
   83    HB3  ASP  12           HB3      ASP  12  24.528  28.272  27.077
   84    H    VAL  13           H        VAL  13  20.666  29.836  29.193
   85    HA   VAL  13           HA       VAL  13  21.390  32.476  30.104
   86    HB   VAL  13           HB       VAL  13  19.024  32.281  31.255
   87   HG11  VAL  13          HG11      VAL  13  17.973  32.941  29.175
   88   HG12  VAL  13          HG12      VAL  13  19.592  33.658  29.294
   89   HG13  VAL  13          HG13      VAL  13  19.318  32.250  28.250
   90   HG21  VAL  13          HG21      VAL  13  17.493  30.741  30.309
   91   HG22  VAL  13          HG22      VAL  13  18.693  30.086  29.188
   92   HG23  VAL  13          HG23      VAL  13  18.846  29.777  30.931
   93    H    LYS  14           H        LYS  14  20.936  29.435  31.862
   94    HA   LYS  14           HA       LYS  14  21.200  30.875  34.462
   95    HB2  LYS  14           HB2      LYS  14  20.543  27.956  33.969
   96    HB3  LYS  14           HB3      LYS  14  20.550  28.779  35.523
   97    HG2  LYS  14           HG2      LYS  14  18.665  29.317  33.199
   98    HG3  LYS  14           HG3      LYS  14  18.282  28.514  34.715
   99    HD2  LYS  14           HD2      LYS  14  18.643  30.617  35.967
  100    HD3  LYS  14           HD3      LYS  14  19.083  31.452  34.455
  101    HE2  LYS  14           HE2      LYS  14  16.886  30.884  33.491
  102    HE3  LYS  14           HE3      LYS  14  16.404  30.116  35.010
  103    HZ1  LYS  14           HZ1      LYS  14  17.121  32.988  34.710
  104    HZ2  LYS  14           HZ2      LYS  14  15.592  32.419  34.789
  105    HZ3  LYS  14           HZ3      LYS  14  16.553  32.287  36.096
  106    H    GLY  15           H        GLY  15  23.257  28.992  32.374
  107    HA2  GLY  15           HA2      GLY  15  25.574  29.685  33.915
  108    HA3  GLY  15           HA3      GLY  15  25.075  28.064  34.374
  109    H    ASP  16           H        ASP  16  26.991  27.170  33.641
  110    HA   ASP  16           HA       ASP  16  27.537  27.197  30.718
  111    HB2  ASP  16           HB2      ASP  16  29.791  26.434  31.217
  112    HB3  ASP  16           HB3      ASP  16  29.417  27.968  31.997
  113    H    CYS  17           H        CYS  17  27.427  25.586  29.509
  114    HA   CYS  17           HA       CYS  17  27.116  22.750  30.421
  115    HB2  CYS  17           HB2      CYS  17  25.188  23.147  29.270
  116    HB3  CYS  17           HB3      CYS  17  25.840  24.490  28.382
  117    H    LYS  18           H        LYS  18  29.036  25.022  28.533
  118    HA   LYS  18           HA       LYS  18  30.829  23.535  27.080
  119    HB2  LYS  18           HB2      LYS  18  31.058  25.931  27.324
  120    HB3  LYS  18           HB3      LYS  18  31.293  25.799  29.061
  121    HG2  LYS  18           HG2      LYS  18  33.420  26.301  28.248
  122    HG3  LYS  18           HG3      LYS  18  33.496  24.608  28.616
  123    HD2  LYS  18           HD2      LYS  18  34.589  24.665  26.615
  124    HD3  LYS  18           HD3      LYS  18  32.947  24.284  26.053
  125    HE2  LYS  18           HE2      LYS  18  32.564  26.626  25.440
  126    HE3  LYS  18           HE3      LYS  18  34.043  27.123  26.260
  127    HZ1  LYS  18           HZ1      LYS  18  34.489  27.099  23.956
  128    HZ2  LYS  18           HZ2      LYS  18  35.295  25.807  24.553
  129    HZ3  LYS  18           HZ3      LYS  18  33.907  25.601  23.698
  130    H    ARG  19           H        ARG  19  31.098  23.859  30.695
  131    HA   ARG  19           HA       ARG  19  33.451  22.261  30.868
  132    HB2  ARG  19           HB2      ARG  19  31.341  22.997  32.919
  133    HB3  ARG  19           HB3      ARG  19  32.711  21.953  33.314
  134    HG2  ARG  19           HG2      ARG  19  34.276  23.715  32.409
  135    HG3  ARG  19           HG3      ARG  19  32.901  24.823  32.302
  136    HD2  ARG  19           HD2      ARG  19  33.729  23.390  34.870
  137    HD3  ARG  19           HD3      ARG  19  34.387  24.957  34.382
  138    HE   ARG  19           HE       ARG  19  31.534  25.101  34.308
  139   HH11  ARG  19          HH11      ARG  19  34.032  24.802  36.783
  140   HH12  ARG  19          HH12      ARG  19  33.127  25.832  37.891
  141   HH21  ARG  19          HH21      ARG  19  30.522  26.378  35.738
  142   HH22  ARG  19          HH22      ARG  19  31.104  26.519  37.386
  143    H    HIS  20           H        HIS  20  30.117  21.109  30.696
  144    HA   HIS  20           HA       HIS  20  30.774  18.383  31.556
  145    HB2  HIS  20           HB2      HIS  20  28.516  19.142  31.787
  146    HB3  HIS  20           HB3      HIS  20  28.424  19.632  30.096
  147    HD2  HIS  20           HD2      HIS  20  27.235  18.009  28.566
  148    HE1  HIS  20           HE1      HIS  20  27.658  14.393  30.790
  149    HE2  HIS  20           HE2      HIS  20  26.569  15.443  28.757
  150    H    CYS  21           H        CYS  21  30.421  20.002  28.362
  151    HA   CYS  21           HA       CYS  21  31.157  17.577  26.936
  152    HB2  CYS  21           HB2      CYS  21  30.731  20.460  26.122
  153    HB3  CYS  21           HB3      CYS  21  31.132  19.201  24.966
  154    H    LYS  22           H        LYS  22  32.986  20.445  28.026
  155    HA   LYS  22           HA       LYS  22  35.384  19.980  26.656
  156    HB2  LYS  22           HB2      LYS  22  34.632  22.057  27.747
  157    HB3  LYS  22           HB3      LYS  22  34.761  21.294  29.335
  158    HG2  LYS  22           HG2      LYS  22  36.600  22.820  28.876
  159    HG3  LYS  22           HG3      LYS  22  37.166  21.167  29.137
  160    HD2  LYS  22           HD2      LYS  22  37.421  20.873  26.662
  161    HD3  LYS  22           HD3      LYS  22  36.863  22.556  26.421
  162    HE2  LYS  22           HE2      LYS  22  38.666  23.412  27.725
  163    HE3  LYS  22           HE3      LYS  22  39.105  21.784  28.293
  164    HZ1  LYS  22           HZ1      LYS  22  39.529  22.925  25.602
  165    HZ2  LYS  22           HZ2      LYS  22  40.651  22.307  26.591
  166    HZ3  LYS  22           HZ3      LYS  22  39.614  21.277  25.868
  167    H    ALA  23           H        ALA  23  34.089  18.303  29.420
  168    HA   ALA  23           HA       ALA  23  36.521  17.025  30.322
  169    HB1  ALA  23           HB1      ALA  23  34.974  15.521  31.445
  170    HB2  ALA  23           HB2      ALA  23  34.373  17.180  31.596
  171    HB3  ALA  23           HB3      ALA  23  33.629  16.069  30.427
  172    H    GLU  24           H        GLU  24  34.272  16.418  27.650
  173    HA   GLU  24           HA       GLU  24  35.759  14.028  26.699
  174    HB2  GLU  24           HB2      GLU  24  33.296  15.441  25.615
  175    HB3  GLU  24           HB3      GLU  24  34.013  13.993  24.942
  176    HG2  GLU  24           HG2      GLU  24  32.870  14.190  27.759
  177    HG3  GLU  24           HG3      GLU  24  31.992  13.594  26.354
  178    H    ASP  25           H        ASP  25  36.467  17.127  26.761
  179    HA   ASP  25           HA       ASP  25  37.286  18.779  25.573
  180    HB2  ASP  25           HB2      ASP  25  39.083  16.923  25.508
  181    HB3  ASP  25           HB3      ASP  25  38.724  16.837  23.780
  182    H    LYS  26           H        LYS  26  34.714  18.189  24.833
  183    HA   LYS  26           HA       LYS  26  34.540  18.960  21.943
  184    HB2  LYS  26           HB2      LYS  26  32.567  17.558  23.789
  185    HB3  LYS  26           HB3      LYS  26  32.151  18.218  22.216
  186    HG2  LYS  26           HG2      LYS  26  34.436  16.616  21.704
  187    HG3  LYS  26           HG3      LYS  26  33.468  15.700  22.881
  188    HD2  LYS  26           HD2      LYS  26  31.449  16.073  21.415
  189    HD3  LYS  26           HD3      LYS  26  32.517  16.862  20.228
  190    HE2  LYS  26           HE2      LYS  26  33.851  14.770  20.075
  191    HE3  LYS  26           HE3      LYS  26  32.770  14.014  21.257
  192    HZ1  LYS  26           HZ1      LYS  26  32.093  14.844  18.496
  193    HZ2  LYS  26           HZ2      LYS  26  31.960  13.367  19.170
  194    HZ3  LYS  26           HZ3      LYS  26  30.917  14.547  19.634
  195    H    GLU  27           H        GLU  27  32.900  20.409  21.344
  196    HA   GLU  27           HA       GLU  27  32.390  22.716  23.045
  197    HB2  GLU  27           HB2      GLU  27  31.470  21.732  20.315
  198    HB3  GLU  27           HB3      GLU  27  30.686  23.101  21.083
  199    HG2  GLU  27           HG2      GLU  27  33.679  22.948  20.521
  200    HG3  GLU  27           HG3      GLU  27  32.493  23.742  19.482
  201    H    GLY  28           H        GLY  28  30.558  23.233  24.077
  202    HA2  GLY  28           HA2      GLY  28  28.399  21.174  24.385
  203    HA3  GLY  28           HA3      GLY  28  28.901  22.232  25.683
  204    H    ILE  29           H        ILE  29  26.321  21.690  24.034
  205    HA   ILE  29           HA       ILE  29  25.560  24.500  23.545
  206    HB   ILE  29           HB       ILE  29  26.499  23.643  21.531
  207   HG12  ILE  29          HG12      ILE  29  24.548  25.214  21.523
  208   HG13  ILE  29          HG13      ILE  29  25.020  24.437  20.025
  209   HG21  ILE  29          HG21      ILE  29  25.479  21.871  20.176
  210   HG22  ILE  29          HG22      ILE  29  26.275  21.296  21.623
  211   HG23  ILE  29          HG23      ILE  29  24.498  21.384  21.580
  212   HD11  ILE  29          HD11      ILE  29  23.140  22.840  20.229
  213   HD12  ILE  29          HD12      ILE  29  22.610  23.663  21.707
  214   HD13  ILE  29          HD13      ILE  29  22.625  24.524  20.154
  215    H    CYS  30           H        CYS  30  23.563  25.005  24.173
  216    HA   CYS  30           HA       CYS  30  22.197  23.052  25.792
  217    HB2  CYS  30           HB2      CYS  30  21.572  25.939  25.134
  218    HB3  CYS  30           HB3      CYS  30  20.644  24.946  26.267
  219    H    HIS  31           H        HIS  31  20.862  21.602  25.139
  220    HA   HIS  31           HA       HIS  31  18.821  22.135  23.011
  221    HB2  HIS  31           HB2      HIS  31  20.188  19.578  23.896
  222    HB3  HIS  31           HB3      HIS  31  18.605  19.561  23.135
  223    HD2  HIS  31           HD2      HIS  31  22.187  20.853  22.260
  224    HE1  HIS  31           HE1      HIS  31  20.242  19.795  18.624
  225    HE2  HIS  31           HE2      HIS  31  22.414  20.630  19.635
  226    H    GLY  32           H        GLY  32  17.174  22.989  24.087
  227    HA2  GLY  32           HA2      GLY  32  15.303  23.117  25.419
  228    HA3  GLY  32           HA3      GLY  32  15.598  21.458  25.931
  229    H    THR  33           H        THR  33  15.916  21.257  28.062
  230    HA   THR  33           HA       THR  33  17.174  23.459  29.646
  231    HB   THR  33           HB       THR  33  16.167  22.435  31.606
  232    HG1  THR  33           HG1      THR  33  14.557  20.682  30.936
  233   HG21  THR  33          HG21      THR  33  14.792  24.033  30.203
  234   HG22  THR  33          HG22      THR  33  14.024  22.626  29.443
  235   HG23  THR  33          HG23      THR  33  13.854  22.910  31.190
  236    H    LYS  34           H        LYS  34  18.433  21.192  27.947
  237    HA   LYS  34           HA       LYS  34  20.323  20.145  29.999
  238    HB2  LYS  34           HB2      LYS  34  19.135  18.655  27.617
  239    HB3  LYS  34           HB3      LYS  34  20.318  17.996  28.739
  240    HG2  LYS  34           HG2      LYS  34  17.466  18.800  29.464
  241    HG3  LYS  34           HG3      LYS  34  18.034  17.165  29.143
  242    HD2  LYS  34           HD2      LYS  34  19.637  17.354  31.043
  243    HD3  LYS  34           HD3      LYS  34  18.953  18.930  31.460
  244    HE2  LYS  34           HE2      LYS  34  17.428  16.299  31.331
  245    HE3  LYS  34           HE3      LYS  34  18.062  17.033  32.811
  246    HZ1  LYS  34           HZ1      LYS  34  15.934  18.144  31.065
  247    HZ2  LYS  34           HZ2      LYS  34  15.767  17.578  32.592
  248    HZ3  LYS  34           HZ3      LYS  34  16.608  18.960  32.337
  249    H    CYS  35           H        CYS  35  22.334  19.315  29.080
  250    HA   CYS  35           HA       CYS  35  23.410  21.011  26.899
  251    HB2  CYS  35           HB2      CYS  35  24.508  20.681  29.134
  252    HB3  CYS  35           HB3      CYS  35  24.815  19.011  28.683
  253    H    LYS  36           H        LYS  36  24.516  20.093  25.119
  254    HA   LYS  36           HA       LYS  36  24.488  17.216  24.584
  255    HB2  LYS  36           HB2      LYS  36  22.426  18.696  23.567
  256    HB3  LYS  36           HB3      LYS  36  23.633  19.043  22.338
  257    HG2  LYS  36           HG2      LYS  36  22.847  16.230  23.216
  258    HG3  LYS  36           HG3      LYS  36  21.971  17.111  21.972
  259    HD2  LYS  36           HD2      LYS  36  24.930  16.449  21.771
  260    HD3  LYS  36           HD3      LYS  36  23.626  15.455  21.129
  261    HE2  LYS  36           HE2      LYS  36  22.884  17.270  19.674
  262    HE3  LYS  36           HE3      LYS  36  24.144  18.346  20.304
  263    HZ1  LYS  36           HZ1      LYS  36  25.816  16.975  19.334
  264    HZ2  LYS  36           HZ2      LYS  36  24.775  15.751  19.026
  265    HZ3  LYS  36           HZ3      LYS  36  24.673  17.135  18.156
  266    H    CYS  37           H        CYS  37  26.347  16.735  23.379
  267    HA   CYS  37           HA       CYS  37  28.268  18.969  23.115
  268    HB2  CYS  37           HB2      CYS  37  28.859  16.013  23.025
  269    HB3  CYS  37           HB3      CYS  37  30.008  17.343  23.136
  270    H    GLY  38           H        GLY  38  29.429  19.494  21.395
  271    HA2  GLY  38           HA2      GLY  38  28.294  18.905  18.721
  272    HA3  GLY  38           HA3      GLY  38  29.264  20.282  19.201
  273    H    VAL  39           H        VAL  39  31.178  20.326  18.348
  274    HA   VAL  39           HA       VAL  39  32.625  17.897  17.504
  275    HB   VAL  39           HB       VAL  39  33.929  19.481  16.060
  276   HG11  VAL  39          HG11      VAL  39  32.223  19.772  14.374
  277   HG12  VAL  39          HG12      VAL  39  32.005  18.212  15.190
  278   HG13  VAL  39          HG13      VAL  39  30.933  19.577  15.576
  279   HG21  VAL  39          HG21      VAL  39  33.136  21.726  15.632
  280   HG22  VAL  39          HG22      VAL  39  31.878  21.567  16.868
  281   HG23  VAL  39          HG23      VAL  39  33.592  21.569  17.334
  282    HA   PRO  40           HA       PRO  40  36.095  18.432  20.297
  283    HB2  PRO  40           HB2      PRO  40  37.675  18.798  17.731
  284    HB3  PRO  40           HB3      PRO  40  38.116  17.853  19.187
  285    HG2  PRO  40           HG2      PRO  40  37.092  16.606  17.013
  286    HG3  PRO  40           HG3      PRO  40  36.531  16.148  18.654
  287    HD2  PRO  40           HD2      PRO  40  35.119  17.864  16.609
  288    HD3  PRO  40           HD3      PRO  40  34.456  16.699  17.785
  289    H    ILE  41           H        ILE  41  37.136  20.186  21.323
  290    HA   ILE  41           HA       ILE  41  36.364  22.816  20.434
  291    HB   ILE  41           HB       ILE  41  37.627  23.661  22.356
  292   HG12  ILE  41          HG12      ILE  41  38.274  21.993  24.124
  293   HG13  ILE  41          HG13      ILE  41  38.292  20.745  22.883
  294   HG21  ILE  41          HG21      ILE  41  35.243  22.893  22.432
  295   HG22  ILE  41          HG22      ILE  41  35.827  21.325  23.027
  296   HG23  ILE  41          HG23      ILE  41  36.074  22.791  23.990
  297   HD11  ILE  41          HD11      ILE  41  40.514  21.955  23.657
  298   HD12  ILE  41          HD12      ILE  41  40.309  21.547  21.970
  299   HD13  ILE  41          HD13      ILE  41  39.993  23.204  22.513
  300    H    SER  42           H        SER  42  39.273  20.976  20.069
  301    HA   SER  42           HA       SER  42  41.143  21.174  18.994
  302    HB2  SER  42           HB2      SER  42  39.026  21.140  17.382
  303    HB3  SER  42           HB3      SER  42  39.699  22.662  16.833
  304    HG   SER  42           HG       SER  42  40.893  20.070  16.884
  305    H    TYR  43           H        TYR  43  40.841  23.520  20.686
  306    HA   TYR  43           HA       TYR  43  43.353  24.658  19.983
  307    HB2  TYR  43           HB2      TYR  43  43.064  26.678  19.156
  308    HB3  TYR  43           HB3      TYR  43  41.669  25.929  18.441
  309    HD1  TYR  43           HD1      TYR  43  39.417  26.152  19.900
  310    HD2  TYR  43           HD2      TYR  43  42.864  28.716  20.196
  311    HE1  TYR  43           HE1      TYR  43  38.026  27.897  20.947
  312    HE2  TYR  43           HE2      TYR  43  41.475  30.477  21.227
  313    HH   TYR  43           HH       TYR  43  37.933  30.079  21.677
  314    H    LEU  44           H        LEU  44  40.590  25.034  22.184
  315    HA   LEU  44           HA       LEU  44  42.398  26.083  24.312
  316    HB2  LEU  44           HB2      LEU  44  41.118  27.847  23.138
  317    HB3  LEU  44           HB3      LEU  44  39.611  27.059  23.553
  318    HG   LEU  44           HG       LEU  44  40.209  29.106  24.834
  319   HD11  LEU  44          HD11      LEU  44  38.585  27.476  25.729
  320   HD12  LEU  44          HD12      LEU  44  39.893  26.691  26.643
  321   HD13  LEU  44          HD13      LEU  44  39.454  28.370  26.990
  322   HD21  LEU  44          HD21      LEU  44  42.255  27.369  26.251
  323   HD22  LEU  44          HD22      LEU  44  42.637  28.661  25.087
  324   HD23  LEU  44          HD23      LEU  44  41.836  29.053  26.617