*HEADER    OXIDOREDUCTASE                          11-MAR-12   2LQQ              
*TITLE     OXIDIZED MRX1                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PUTATIVE GLUTAREDOXIN RV3198.1/MT3292;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 EC: 1.-.-.-;                                                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS;                     
*SOURCE   3 ORGANISM_TAXID: 1773;                                                
*SOURCE   4 GENE: RV3198.1, MT3292, RV3198A;                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET28A                                     
*KEYWDS    TRX FOLD, OXIDOREDUCTASE                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.BUTS, K.VAN LAER, J.MESSENS                                         
*REVDAT   1   10-OCT-12 2LQQ    0                                                


?assi ( resid 2 and name HG# ) ( resid 4 and name H )    4.280    1.000    1.000
assi ( resid 3 and name HB ) ( resid 4 and name H )    3.250    1.000    1.000
assi ( resid 6 and name H ) ( resid 31 and name HB# )    4.410    1.000    1.000
assi ( resid 6 and name H ) ( resid 31 and name HA )    3.120    1.000    1.000
assi ( resid 5 and name H ) ( resid 6 and name H )    2.450    1.000    1.000
assi ( resid 7 and name H ) ( resid 8 and name H )    3.700    1.000    1.000
assi ( resid 6 and name H ) ( resid 7 and name H )    3.750    1.000    1.000
assi ( resid 7 and name H ) ( resid 59 and name HA )    3.870    1.000    1.000
assi ( resid 6 and name HA ) ( resid 7 and name H )    1.970    1.000    1.000
assi ( resid 7 and name H ) ( resid 7 and name HB )    2.380    1.000    1.000
assi ( resid 7 and name H ) ( resid 59 and name HB )    4.500    1.000    1.000
assi ( resid 6 and name HB2 ) ( resid 7 and name H )    3.080    1.000    1.000
assi ( resid 8 and name H ) ( resid 8 and name HB )    2.740    1.000    1.000
assi ( resid 8 and name H ) ( resid 8 and name HG13 )    3.680    1.000    1.000
assi ( resid 8 and name H ) ( resid 8 and name HD1# )    4.110    1.000    1.000
assi ( resid 7 and name HB ) ( resid 8 and name H )    4.290    1.000    1.000
assi ( resid 8 and name H ) ( resid 33 and name HB2 )    4.500    1.000    1.000
assi ( resid 8 and name H ) ( resid 33 and name HA )    2.660    1.000    1.000
assi ( resid 7 and name HA ) ( resid 8 and name H )    1.960    1.000    1.000
assi ( resid 8 and name H ) ( resid 9 and name HE# )    4.500    1.000    1.000
assi ( resid 8 and name H ) ( resid 31 and name HD# )    4.500    1.000    1.000
assi ( resid 9 and name H ) ( resid 9 and name HD# )    2.720    1.000    1.000
assi ( resid 9 and name H ) ( resid 9 and name HE# )    4.050    1.000    1.000
assi ( resid 9 and name H ) ( resid 59 and name HA )    2.980    1.000    1.000
assi ( resid 8 and name HA ) ( resid 9 and name H )    1.980    1.000    1.000
assi ( resid 9 and name H ) ( resid 9 and name HB# )    2.410    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 9 and name H )    2.930    1.000    1.000
assi ( resid 10 and name H ) ( resid 34 and name HB )    3.800    1.000    1.000
assi ( resid 10 and name H ) ( resid 36 and name HG13 )    3.070    1.000    1.000
assi ( resid 10 and name H ) ( resid 10 and name HG2# )    2.630    1.000    1.000
assi ( resid 10 and name H ) ( resid 33 and name HB2 )    4.230    1.000    1.000
assi ( resid 10 and name H ) ( resid 34 and name HG2# )    3.980    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 10 and name H )    2.910    1.000    1.000
assi ( resid 9 and name HA ) ( resid 10 and name H )    1.870    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 10 and name H )    3.810    1.000    1.000
assi ( resid 10 and name H ) ( resid 34 and name H )    2.910    1.000    1.000
assi ( resid 9 and name H ) ( resid 10 and name H )    3.490    1.000    1.000
assi ( resid 11 and name H ) ( resid 12 and name H )    3.910    1.000    1.000
assi ( resid 10 and name H ) ( resid 11 and name H )    3.800    1.000    1.000
assi ( resid 10 and name HA ) ( resid 11 and name H )    2.400    1.000    1.000
assi ( resid 10 and name HB ) ( resid 11 and name H )    2.770    1.000    1.000
assi ( resid 11 and name H ) ( resid 11 and name HB )    3.100    1.000    1.000
assi ( resid 11 and name H ) ( resid 14 and name HB3 )    3.530    1.000    1.000
assi ( resid 11 and name H ) ( resid 14 and name HB2 )    3.530    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 12 and name H )    3.410    1.000    1.000
assi ( resid 12 and name H ) ( resid 13 and name HA )    4.250    1.000    1.000
assi ( resid 11 and name HA ) ( resid 12 and name H )    2.290    1.000    1.000
assi ( resid 12 and name H ) ( resid 37 and name HA )    3.610    1.000    1.000
assi ( resid 12 and name H ) ( resid 12 and name HB# )    2.340    1.000    1.000
assi ( resid 11 and name HB ) ( resid 12 and name H )    2.330    1.000    1.000
assi ( resid 12 and name H ) ( resid 13 and name H )    3.010    1.000    1.000
assi ( resid 13 and name HB3 ) ( resid 14 and name H )    4.110    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 17 and name H )    4.500    1.000    1.000
assi ( resid 17 and name H ) ( resid 18 and name HB# )    3.640    1.000    1.000
assi ( resid 17 and name H ) ( resid 17 and name HB2 )    2.870    1.000    1.000
assi ( resid 17 and name H ) ( resid 19 and name H )    3.590    1.000    1.000
assi ( resid 17 and name H ) ( resid 18 and name H )    2.310    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 17 and name H )    4.250    1.000    1.000
assi ( resid 18 and name H ) ( resid 20 and name H )    3.590    1.000    1.000
assi ( resid 18 and name H ) ( resid 18 and name HB# )    2.050    1.000    1.000
assi ( resid 18 and name H ) ( resid 18 and name HD2# )    3.400    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 20 and name H )    4.500    1.000    1.000
assi ( resid 19 and name H ) ( resid 20 and name H )    2.300    1.000    1.000
assi ( resid 19 and name HB# ) ( resid 20 and name H )    2.260    1.000    1.000
assi ( resid 20 and name H ) ( resid 20 and name HB2 )    2.500    1.000    1.000
assi ( resid 21 and name H ) ( resid 24 and name H )    4.060    1.000    1.000
assi ( resid 20 and name H ) ( resid 21 and name H )    2.120    1.000    1.000
assi ( resid 18 and name H ) ( resid 21 and name H )    4.230    1.000    1.000
assi ( resid 21 and name H ) ( resid 31 and name HE# )    4.500    1.000    1.000
assi ( resid 18 and name HA ) ( resid 21 and name H )    2.740    1.000    1.000
assi ( resid 21 and name H ) ( resid 21 and name HB# )    2.080    1.000    1.000
assi ( resid 21 and name H ) ( resid 21 and name HG3 )    2.320    1.000    1.000
assi ( resid 21 and name H ) ( resid 21 and name HG2 )    2.740    1.000    1.000
assi ( resid 21 and name HB# ) ( resid 22 and name H )    2.220    1.000    1.000
assi ( resid 22 and name H ) ( resid 23 and name HB# )    3.430    1.000    1.000
assi ( resid 22 and name H ) ( resid 22 and name HG2# )    2.810    1.000    1.000
assi ( resid 22 and name H ) ( resid 22 and name HB )    1.940    1.000    1.000
assi ( resid 21 and name H ) ( resid 22 and name H )    2.200    1.000    1.000
assi ( resid 19 and name H ) ( resid 22 and name H )    4.140    1.000    1.000
assi ( resid 23 and name H ) ( resid 25 and name H )    3.470    1.000    1.000
assi ( resid 22 and name H ) ( resid 23 and name H )    2.150    1.000    1.000
assi ( resid 23 and name H ) ( resid 27 and name HD21 )    4.500    1.000    1.000
assi ( resid 22 and name HB ) ( resid 23 and name H )    2.110    1.000    1.000
assi ( resid 23 and name H ) ( resid 23 and name HB# )    1.930    1.000    1.000
assi ( resid 24 and name H ) ( resid 24 and name HD1# )    3.000    1.000    1.000
assi ( resid 24 and name H ) ( resid 24 and name HG )    2.060    1.000    1.000
assi ( resid 21 and name HA ) ( resid 24 and name H )    3.130    1.000    1.000
assi ( resid 24 and name H ) ( resid 31 and name HD# )    4.500    1.000    1.000
assi ( resid 24 and name H ) ( resid 26 and name H )    3.540    1.000    1.000
assi ( resid 22 and name H ) ( resid 24 and name H )    3.690    1.000    1.000
assi ( resid 23 and name H ) ( resid 24 and name H )    2.210    1.000    1.000
assi ( resid 24 and name H ) ( resid 25 and name H )    2.280    1.000    1.000
assi ( resid 22 and name H ) ( resid 25 and name H )    4.120    1.000    1.000
assi ( resid 25 and name H ) ( resid 31 and name HE# )    3.100    1.000    1.000
assi ( resid 25 and name H ) ( resid 25 and name HB )    1.930    1.000    1.000
assi ( resid 22 and name HA ) ( resid 25 and name H )    2.870    1.000    1.000
assi ( resid 21 and name HA ) ( resid 25 and name H )    4.120    1.000    1.000
assi ( resid 24 and name HB2 ) ( resid 25 and name H )    2.560    1.000    1.000
assi ( resid 24 and name HB3 ) ( resid 25 and name H )    2.860    1.000    1.000
assi ( resid 25 and name H ) ( resid 25 and name HG2# )    2.790    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 25 and name H )    3.920    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 25 and name H )    4.130    1.000    1.000
assi ( resid 25 and name HG2# ) ( resid 26 and name H )    2.820    1.000    1.000
assi ( resid 24 and name HB2 ) ( resid 26 and name H )    4.190    1.000    1.000
assi ( resid 25 and name HB ) ( resid 26 and name H )    2.020    1.000    1.000
assi ( resid 22 and name HA ) ( resid 26 and name H )    3.400    1.000    1.000
assi ( resid 26 and name H ) ( resid 27 and name HD21 )    3.760    1.000    1.000
assi ( resid 26 and name H ) ( resid 27 and name H )    2.160    1.000    1.000
assi ( resid 23 and name H ) ( resid 26 and name H )    3.940    1.000    1.000
assi ( resid 26 and name H ) ( resid 27 and name HD22 )    4.500    1.000    1.000
assi ( resid 25 and name H ) ( resid 26 and name H )    2.210    1.000    1.000
assi ( resid 25 and name H ) ( resid 27 and name H )    3.550    1.000    1.000
assi ( resid 27 and name H ) ( resid 27 and name HD21 )    2.600    1.000    1.000
assi ( resid 25 and name HA ) ( resid 27 and name H )    3.250    1.000    1.000
assi ( resid 24 and name HA ) ( resid 27 and name H )    2.800    1.000    1.000
assi ( resid 27 and name H ) ( resid 27 and name HB2 )    2.560    1.000    1.000
assi ( resid 27 and name H ) ( resid 27 and name HB3 )    2.630    1.000    1.000
assi ( resid 25 and name HG2# ) ( resid 27 and name H )    4.020    1.000    1.000
assi ( resid 26 and name HB# ) ( resid 27 and name H )    2.390    1.000    1.000
assi ( resid 27 and name H ) ( resid 29 and name HD1# )    3.570    1.000    1.000
assi ( resid 28 and name H ) ( resid 29 and name HD1# )    4.140    1.000    1.000
assi ( resid 28 and name H ) ( resid 28 and name HG# )    2.330    1.000    1.000
assi ( resid 25 and name HG2# ) ( resid 28 and name H )    3.790    1.000    1.000
assi ( resid 28 and name H ) ( resid 28 and name HB2 )    3.070    1.000    1.000
assi ( resid 27 and name HB3 ) ( resid 28 and name H )    3.630    1.000    1.000
assi ( resid 28 and name H ) ( resid 28 and name HD# )    3.640    1.000    1.000
assi ( resid 27 and name HB2 ) ( resid 28 and name H )    3.880    1.000    1.000
assi ( resid 26 and name HA ) ( resid 28 and name H )    2.760    1.000    1.000
assi ( resid 28 and name H ) ( resid 28 and name HA )    1.800    1.000    1.000
assi ( resid 27 and name HD21 ) ( resid 28 and name H )    4.320    1.000    1.000
assi ( resid 27 and name H ) ( resid 28 and name H )    2.110    1.000    1.000
assi ( resid 28 and name H ) ( resid 29 and name H )    2.190    1.000    1.000
assi ( resid 26 and name H ) ( resid 28 and name H )    3.310    1.000    1.000
assi ( resid 25 and name H ) ( resid 28 and name H )    4.500    1.000    1.000
assi ( resid 25 and name H ) ( resid 29 and name H )    4.190    1.000    1.000
assi ( resid 27 and name H ) ( resid 29 and name H )    3.020    1.000    1.000
assi ( resid 28 and name HA ) ( resid 29 and name H )    2.280    1.000    1.000
assi ( resid 28 and name HB2 ) ( resid 29 and name H )    3.560    1.000    1.000
assi ( resid 29 and name H ) ( resid 29 and name HB )    2.030    1.000    1.000
assi ( resid 30 and name H ) ( resid 30 and name HB# )    2.030    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 30 and name H )    2.480    1.000    1.000
assi ( resid 29 and name HA ) ( resid 30 and name H )    1.700    1.000    1.000
assi ( resid 29 and name H ) ( resid 30 and name H )    3.490    1.000    1.000
assi ( resid 31 and name H ) ( resid 32 and name H )    3.650    1.000    1.000
assi ( resid 30 and name H ) ( resid 31 and name H )    3.670    1.000    1.000
assi ( resid 31 and name H ) ( resid 31 and name HD# )    2.820    1.000    1.000
assi ( resid 30 and name HA ) ( resid 31 and name H )    1.730    1.000    1.000
assi ( resid 31 and name H ) ( resid 31 and name HB# )    3.030    1.000    1.000
assi ( resid 30 and name HB# ) ( resid 31 and name H )    2.270    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 31 and name H )    4.120    1.000    1.000
assi ( resid 32 and name H ) ( resid 34 and name HG2# )    4.500    1.000    1.000
assi ( resid 4 and name HB# ) ( resid 32 and name H )    3.890    1.000    1.000
assi ( resid 31 and name HA ) ( resid 32 and name H )    2.060    1.000    1.000
assi ( resid 7 and name HA ) ( resid 32 and name H )    2.670    1.000    1.000
assi ( resid 6 and name H ) ( resid 32 and name H )    3.890    1.000    1.000
assi ( resid 31 and name HD# ) ( resid 32 and name H )    3.480    1.000    1.000
assi ( resid 8 and name H ) ( resid 32 and name H )    3.240    1.000    1.000
assi ( resid 32 and name H ) ( resid 33 and name H )    3.730    1.000    1.000
assi ( resid 31 and name HD# ) ( resid 33 and name H )    3.260    1.000    1.000
assi ( resid 32 and name HA ) ( resid 33 and name H )    1.830    1.000    1.000
assi ( resid 32 and name HB# ) ( resid 33 and name H )    2.510    1.000    1.000
assi ( resid 33 and name H ) ( resid 33 and name HG# )    2.230    1.000    1.000
assi ( resid 33 and name H ) ( resid 33 and name HB3 )    2.630    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 33 and name H )    4.500    1.000    1.000
assi ( resid 33 and name HB2 ) ( resid 34 and name H )    2.490    1.000    1.000
assi ( resid 34 and name H ) ( resid 34 and name HB )    2.410    1.000    1.000
assi ( resid 8 and name HB ) ( resid 34 and name H )    4.500    1.000    1.000
assi ( resid 34 and name H ) ( resid 36 and name HG12 )    4.500    1.000    1.000
assi ( resid 34 and name H ) ( resid 34 and name HG1# )    3.080    1.000    1.000
assi ( resid 9 and name HA ) ( resid 34 and name H )    2.740    1.000    1.000
assi ( resid 33 and name HA ) ( resid 34 and name H )    1.890    1.000    1.000
assi ( resid 7 and name HA ) ( resid 34 and name H )    4.500    1.000    1.000
assi ( resid 34 and name H ) ( resid 35 and name HA )    4.500    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 34 and name H )    4.010    1.000    1.000
assi ( resid 8 and name H ) ( resid 34 and name H )    3.490    1.000    1.000
assi ( resid 35 and name H ) ( resid 36 and name H )    3.200    1.000    1.000
assi ( resid 34 and name H ) ( resid 35 and name H )    3.850    1.000    1.000
assi ( resid 34 and name HA ) ( resid 35 and name H )    1.750    1.000    1.000
assi ( resid 35 and name H ) ( resid 35 and name HB3 )    2.750    1.000    1.000
assi ( resid 35 and name H ) ( resid 35 and name HB2 )    2.750    1.000    1.000
assi ( resid 33 and name HG# ) ( resid 35 and name H )    4.480    1.000    1.000
assi ( resid 36 and name H ) ( resid 36 and name HG2# )    1.980    1.000    1.000
assi ( resid 36 and name H ) ( resid 36 and name HD1# )    2.900    1.000    1.000
assi ( resid 35 and name HB3 ) ( resid 36 and name H )    3.580    1.000    1.000
assi ( resid 35 and name HA ) ( resid 36 and name H )    2.330    1.000    1.000
assi ( resid 36 and name H ) ( resid 38 and name H )    3.990    1.000    1.000
assi ( resid 34 and name H ) ( resid 37 and name H )    4.430    1.000    1.000
assi ( resid 37 and name H ) ( resid 38 and name H )    2.130    1.000    1.000
assi ( resid 35 and name HA ) ( resid 37 and name H )    3.370    1.000    1.000
assi ( resid 11 and name HA ) ( resid 37 and name H )    4.160    1.000    1.000
assi ( resid 37 and name H ) ( resid 37 and name HG# )    3.170    1.000    1.000
assi ( resid 37 and name H ) ( resid 37 and name HB3 )    2.700    1.000    1.000
assi ( resid 36 and name HA ) ( resid 38 and name H )    4.160    1.000    1.000
assi ( resid 37 and name H ) ( resid 39 and name H )    3.050    1.000    1.000
assi ( resid 39 and name H ) ( resid 43 and name H )    4.300    1.000    1.000
assi ( resid 39 and name H ) ( resid 39 and name HD21 )    4.000    1.000    1.000
assi ( resid 38 and name H ) ( resid 39 and name H )    2.200    1.000    1.000
assi ( resid 38 and name HA ) ( resid 39 and name H )    2.350    1.000    1.000
assi ( resid 36 and name HA ) ( resid 39 and name H )    2.800    1.000    1.000
assi ( resid 37 and name HA ) ( resid 39 and name H )    3.490    1.000    1.000
assi ( resid 39 and name H ) ( resid 39 and name HB3 )    2.340    1.000    1.000
assi ( resid 39 and name H ) ( resid 39 and name HB2 )    2.540    1.000    1.000
assi ( resid 39 and name H ) ( resid 42 and name HB# )    4.110    1.000    1.000
assi ( resid 40 and name H ) ( resid 40 and name HB# )    2.850    1.000    1.000
assi ( resid 40 and name H ) ( resid 41 and name H )    3.070    1.000    1.000
assi ( resid 41 and name H ) ( resid 43 and name H )    3.290    1.000    1.000
assi ( resid 40 and name HB# ) ( resid 41 and name H )    2.720    1.000    1.000
assi ( resid 41 and name H ) ( resid 41 and name HB# )    2.040    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 42 and name H )    4.240    1.000    1.000
assi ( resid 40 and name HB# ) ( resid 42 and name H )    4.400    1.000    1.000
assi ( resid 42 and name H ) ( resid 42 and name HB# )    1.830    1.000    1.000
assi ( resid 39 and name HB3 ) ( resid 42 and name H )    3.190    1.000    1.000
assi ( resid 39 and name HD22 ) ( resid 42 and name H )    3.460    1.000    1.000
assi ( resid 40 and name H ) ( resid 42 and name H )    4.060    1.000    1.000
assi ( resid 41 and name H ) ( resid 42 and name H )    2.090    1.000    1.000
assi ( resid 42 and name H ) ( resid 43 and name H )    1.990    1.000    1.000
assi ( resid 40 and name HA ) ( resid 43 and name H )    2.350    1.000    1.000
assi ( resid 36 and name HA ) ( resid 43 and name H )    3.220    1.000    1.000
assi ( resid 39 and name HB3 ) ( resid 43 and name H )    3.970    1.000    1.000
assi ( resid 44 and name H ) ( resid 45 and name HB3 )    4.280    1.000    1.000
assi ( resid 44 and name H ) ( resid 45 and name HB2 )    4.280    1.000    1.000
assi ( resid 44 and name H ) ( resid 44 and name HG3 )    3.000    1.000    1.000
assi ( resid 44 and name H ) ( resid 44 and name HB3 )    2.660    1.000    1.000
assi ( resid 43 and name HB# ) ( resid 44 and name H )    2.220    1.000    1.000
assi ( resid 41 and name HA ) ( resid 44 and name H )    3.650    1.000    1.000
assi ( resid 42 and name HA ) ( resid 44 and name H )    3.860    1.000    1.000
assi ( resid 45 and name H ) ( resid 46 and name H )    2.280    1.000    1.000
assi ( resid 44 and name H ) ( resid 45 and name H )    2.060    1.000    1.000
assi ( resid 42 and name HA ) ( resid 45 and name H )    2.440    1.000    1.000
assi ( resid 45 and name H ) ( resid 45 and name HB3 )    2.200    1.000    1.000
assi ( resid 45 and name H ) ( resid 45 and name HB2 )    2.200    1.000    1.000
assi ( resid 44 and name HG3 ) ( resid 45 and name H )    4.220    1.000    1.000
assi ( resid 42 and name HB# ) ( resid 45 and name H )    3.470    1.000    1.000
assi ( resid 46 and name H ) ( resid 46 and name HB )    2.220    1.000    1.000
assi ( resid 46 and name H ) ( resid 46 and name HG1# )    3.040    1.000    1.000
assi ( resid 43 and name HA ) ( resid 46 and name H )    3.090    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 46 and name H )    4.500    1.000    1.000
assi ( resid 46 and name H ) ( resid 49 and name H )    4.500    1.000    1.000
assi ( resid 45 and name HD# ) ( resid 46 and name H )    3.110    1.000    1.000
assi ( resid 46 and name H ) ( resid 47 and name H )    2.260    1.000    1.000
assi ( resid 47 and name H ) ( resid 49 and name H )    3.450    1.000    1.000
assi ( resid 47 and name H ) ( resid 54 and name HA )    3.770    1.000    1.000
assi ( resid 46 and name HB ) ( resid 47 and name H )    2.570    1.000    1.000
assi ( resid 48 and name H ) ( resid 49 and name HG1# )    4.330    1.000    1.000
assi ( resid 48 and name H ) ( resid 49 and name HG2# )    4.330    1.000    1.000
assi ( resid 48 and name H ) ( resid 48 and name HB# )    1.900    1.000    1.000
assi ( resid 48 and name H ) ( resid 49 and name H )    2.280    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 79 and name H )    4.320    1.000    1.000
assi ( resid 46 and name H ) ( resid 48 and name H )    3.520    1.000    1.000
assi ( resid 49 and name H ) ( resid 50 and name H )    2.030    1.000    1.000
assi ( resid 48 and name HB# ) ( resid 49 and name H )    3.070    1.000    1.000
assi ( resid 46 and name HA ) ( resid 49 and name H )    3.380    1.000    1.000
assi ( resid 49 and name H ) ( resid 49 and name HB )    2.900    1.000    1.000
assi ( resid 49 and name HB ) ( resid 50 and name H )    3.580    1.000    1.000
assi ( resid 48 and name HA ) ( resid 50 and name H )    3.900    1.000    1.000
assi ( resid 50 and name H ) ( resid 50 and name HB3 )    2.820    1.000    1.000
assi ( resid 50 and name H ) ( resid 50 and name HB2 )    2.820    1.000    1.000
assi ( resid 50 and name H ) ( resid 52 and name H )    3.210    1.000    1.000
assi ( resid 50 and name H ) ( resid 51 and name H )    2.900    1.000    1.000
assi ( resid 48 and name H ) ( resid 50 and name H )    3.650    1.000    1.000
assi ( resid 52 and name H ) ( resid 53 and name HA )    4.070    1.000    1.000
assi ( resid 51 and name HA# ) ( resid 52 and name H )    2.330    1.000    1.000
assi ( resid 52 and name H ) ( resid 53 and name H )    2.390    1.000    1.000
assi ( resid 49 and name H ) ( resid 52 and name H )    4.500    1.000    1.000
assi ( resid 51 and name H ) ( resid 52 and name H )    2.760    1.000    1.000
assi ( resid 53 and name H ) ( resid 53 and name HB3 )    2.890    1.000    1.000
assi ( resid 54 and name H ) ( resid 55 and name H )    3.380    1.000    1.000
assi ( resid 55 and name H ) ( resid 56 and name H )    3.640    1.000    1.000
assi ( resid 50 and name HD21 ) ( resid 55 and name H )    3.510    1.000    1.000
assi ( resid 13 and name H ) ( resid 14 and name H )    3.130    1.000    1.000
assi ( resid 54 and name HA ) ( resid 55 and name H )    2.020    1.000    1.000
assi ( resid 55 and name H ) ( resid 55 and name HB )    2.040    1.000    1.000
assi ( resid 50 and name HB3 ) ( resid 55 and name H )    3.250    1.000    1.000
assi ( resid 50 and name HB2 ) ( resid 55 and name H )    3.250    1.000    1.000
assi ( resid 53 and name HB3 ) ( resid 55 and name H )    4.190    1.000    1.000
assi ( resid 53 and name HB2 ) ( resid 55 and name H )    4.190    1.000    1.000
assi ( resid 54 and name HB# ) ( resid 55 and name H )    3.350    1.000    1.000
assi ( resid 55 and name H ) ( resid 55 and name HG2# )    2.950    1.000    1.000
assi ( resid 55 and name HG2# ) ( resid 56 and name H )    2.270    1.000    1.000
assi ( resid 56 and name H ) ( resid 56 and name HG2# )    3.240    1.000    1.000
assi ( resid 55 and name HB ) ( resid 56 and name H )    3.570    1.000    1.000
assi ( resid 55 and name HA ) ( resid 56 and name H )    1.680    1.000    1.000
assi ( resid 56 and name H ) ( resid 57 and name HA )    4.230    1.000    1.000
assi ( resid 9 and name H ) ( resid 58 and name H )    2.780    1.000    1.000
assi ( resid 58 and name H ) ( resid 59 and name H )    3.720    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 58 and name H )    3.830    1.000    1.000
assi ( resid 57 and name HA ) ( resid 58 and name H )    2.050    1.000    1.000
assi ( resid 56 and name HA ) ( resid 58 and name H )    2.580    1.000    1.000
assi ( resid 58 and name H ) ( resid 58 and name HB )    2.550    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 58 and name H )    2.800    1.000    1.000
assi ( resid 56 and name HB ) ( resid 58 and name H )    2.680    1.000    1.000
assi ( resid 57 and name HB2 ) ( resid 58 and name H )    3.330    1.000    1.000
assi ( resid 58 and name H ) ( resid 58 and name HG2# )    3.280    1.000    1.000
assi ( resid 55 and name HG2# ) ( resid 58 and name H )    4.500    1.000    1.000
assi ( resid 56 and name HG1# ) ( resid 58 and name H )    4.000    1.000    1.000
assi ( resid 59 and name H ) ( resid 67 and name HB# )    3.480    1.000    1.000
assi ( resid 58 and name HG2# ) ( resid 59 and name H )    2.460    1.000    1.000
assi ( resid 59 and name H ) ( resid 59 and name HG2# )    3.380    1.000    1.000
assi ( resid 59 and name H ) ( resid 70 and name HD# )    4.120    1.000    1.000
assi ( resid 58 and name HA ) ( resid 59 and name H )    1.940    1.000    1.000
assi ( resid 59 and name H ) ( resid 68 and name HA )    3.710    1.000    1.000
assi ( resid 59 and name H ) ( resid 66 and name HB )    3.640    1.000    1.000
assi ( resid 59 and name H ) ( resid 66 and name HA )    4.020    1.000    1.000
assi ( resid 59 and name H ) ( resid 61 and name HE# )    4.500    1.000    1.000
assi ( resid 9 and name H ) ( resid 59 and name H )    4.330    1.000    1.000
assi ( resid 7 and name H ) ( resid 60 and name H )    2.700    1.000    1.000
assi ( resid 8 and name HA ) ( resid 60 and name H )    3.830    1.000    1.000
assi ( resid 59 and name HA ) ( resid 60 and name H )    2.000    1.000    1.000
assi ( resid 7 and name HB ) ( resid 60 and name H )    3.180    1.000    1.000
assi ( resid 59 and name HB ) ( resid 60 and name H )    3.210    1.000    1.000
assi ( resid 60 and name H ) ( resid 60 and name HG# )    3.180    1.000    1.000
assi ( resid 59 and name HG2# ) ( resid 60 and name H )    3.490    1.000    1.000
assi ( resid 60 and name HG# ) ( resid 61 and name H )    2.670    1.000    1.000
assi ( resid 61 and name H ) ( resid 61 and name HB3 )    3.060    1.000    1.000
assi ( resid 61 and name H ) ( resid 61 and name HB2 )    2.650    1.000    1.000
assi ( resid 60 and name HA ) ( resid 61 and name H )    2.080    1.000    1.000
assi ( resid 61 and name H ) ( resid 66 and name HA )    3.220    1.000    1.000
assi ( resid 61 and name H ) ( resid 61 and name HE# )    4.150    1.000    1.000
assi ( resid 61 and name H ) ( resid 67 and name H )    4.110    1.000    1.000
assi ( resid 61 and name H ) ( resid 62 and name H )    3.830    1.000    1.000
assi ( resid 63 and name H ) ( resid 82 and name HD1# )    3.460    1.000    1.000
assi ( resid 61 and name HB3 ) ( resid 63 and name H )    3.120    1.000    1.000
assi ( resid 61 and name HB2 ) ( resid 63 and name H )    3.010    1.000    1.000
assi ( resid 62 and name H ) ( resid 63 and name H )    2.720    1.000    1.000
assi ( resid 61 and name H ) ( resid 63 and name H )    4.000    1.000    1.000
assi ( resid 62 and name H ) ( resid 64 and name H )    3.870    1.000    1.000
assi ( resid 61 and name H ) ( resid 64 and name H )    3.890    1.000    1.000
assi ( resid 63 and name H ) ( resid 64 and name H )    2.140    1.000    1.000
assi ( resid 62 and name HA ) ( resid 64 and name H )    3.290    1.000    1.000
assi ( resid 61 and name HB2 ) ( resid 64 and name H )    4.190    1.000    1.000
assi ( resid 65 and name H ) ( resid 65 and name HB3 )    2.780    1.000    1.000
assi ( resid 65 and name H ) ( resid 65 and name HB2 )    2.780    1.000    1.000
assi ( resid 61 and name HB3 ) ( resid 65 and name H )    4.500    1.000    1.000
assi ( resid 63 and name H ) ( resid 65 and name H )    3.160    1.000    1.000
assi ( resid 61 and name H ) ( resid 65 and name H )    3.700    1.000    1.000
assi ( resid 66 and name H ) ( resid 67 and name H )    3.700    1.000    1.000
assi ( resid 65 and name HA ) ( resid 66 and name H )    1.900    1.000    1.000
assi ( resid 65 and name HB2 ) ( resid 66 and name H )    2.790    1.000    1.000
assi ( resid 66 and name H ) ( resid 66 and name HG2# )    2.840    1.000    1.000
assi ( resid 67 and name H ) ( resid 67 and name HB# )    2.580    1.000    1.000
assi ( resid 66 and name HG2# ) ( resid 67 and name H )    3.070    1.000    1.000
assi ( resid 60 and name HA ) ( resid 67 and name H )    3.500    1.000    1.000
assi ( resid 66 and name HB ) ( resid 67 and name H )    2.120    1.000    1.000
assi ( resid 66 and name HA ) ( resid 67 and name H )    1.980    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 67 and name H )    3.210    1.000    1.000
assi ( resid 59 and name H ) ( resid 67 and name H )    2.560    1.000    1.000
assi ( resid 67 and name H ) ( resid 68 and name H )    3.470    1.000    1.000
assi ( resid 67 and name HA ) ( resid 68 and name H )    1.990    1.000    1.000
assi ( resid 68 and name H ) ( resid 68 and name HB )    1.990    1.000    1.000
assi ( resid 68 and name H ) ( resid 70 and name HD# )    3.920    1.000    1.000
assi ( resid 67 and name HD2# ) ( resid 68 and name H )    4.020    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 69 and name H )    4.500    1.000    1.000
assi ( resid 69 and name H ) ( resid 70 and name HG3 )    3.860    1.000    1.000
assi ( resid 68 and name HG2# ) ( resid 69 and name H )    2.580    1.000    1.000
assi ( resid 57 and name HG2 ) ( resid 69 and name H )    3.410    1.000    1.000
assi ( resid 68 and name HB ) ( resid 69 and name H )    3.510    1.000    1.000
assi ( resid 69 and name H ) ( resid 70 and name HD# )    2.340    1.000    1.000
assi ( resid 58 and name HA ) ( resid 69 and name H )    3.010    1.000    1.000
assi ( resid 68 and name HA ) ( resid 69 and name H )    2.030    1.000    1.000
assi ( resid 59 and name H ) ( resid 69 and name H )    4.030    1.000    1.000
assi ( resid 71 and name H ) ( resid 72 and name H )    3.690    1.000    1.000
assi ( resid 71 and name H ) ( resid 73 and name H )    4.050    1.000    1.000
assi ( resid 71 and name H ) ( resid 74 and name H )    2.720    1.000    1.000
assi ( resid 70 and name HA ) ( resid 71 and name H )    2.030    1.000    1.000
assi ( resid 71 and name H ) ( resid 71 and name HB3 )    2.900    1.000    1.000
assi ( resid 71 and name H ) ( resid 71 and name HB2 )    2.900    1.000    1.000
assi ( resid 71 and name H ) ( resid 74 and name HG3 )    3.380    1.000    1.000
assi ( resid 71 and name H ) ( resid 74 and name HB3 )    2.680    1.000    1.000
assi ( resid 70 and name HG2 ) ( resid 71 and name H )    3.700    1.000    1.000
assi ( resid 71 and name H ) ( resid 75 and name HG2# )    4.280    1.000    1.000
assi ( resid 71 and name HA ) ( resid 72 and name H )    2.520    1.000    1.000
assi ( resid 71 and name HB3 ) ( resid 72 and name H )    3.120    1.000    1.000
assi ( resid 71 and name HB2 ) ( resid 72 and name H )    3.120    1.000    1.000
assi ( resid 72 and name H ) ( resid 75 and name H )    4.150    1.000    1.000
assi ( resid 72 and name H ) ( resid 73 and name H )    2.700    1.000    1.000
assi ( resid 71 and name HB2 ) ( resid 73 and name H )    3.540    1.000    1.000
assi ( resid 74 and name H ) ( resid 75 and name HG2# )    3.640    1.000    1.000
assi ( resid 74 and name H ) ( resid 74 and name HB3 )    2.660    1.000    1.000
assi ( resid 72 and name HA ) ( resid 74 and name H )    4.210    1.000    1.000
assi ( resid 73 and name H ) ( resid 74 and name H )    2.270    1.000    1.000
assi ( resid 72 and name H ) ( resid 74 and name H )    3.880    1.000    1.000
assi ( resid 71 and name H ) ( resid 75 and name H )    3.770    1.000    1.000
assi ( resid 75 and name H ) ( resid 78 and name H )    3.870    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 75 and name H )    4.220    1.000    1.000
assi ( resid 75 and name H ) ( resid 75 and name HB )    2.190    1.000    1.000
assi ( resid 75 and name H ) ( resid 78 and name HB# )    3.970    1.000    1.000
assi ( resid 29 and name HD1# ) ( resid 75 and name H )    4.500    1.000    1.000
assi ( resid 75 and name HG1# ) ( resid 76 and name H )    2.670    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 76 and name H )    3.600    1.000    1.000
assi ( resid 75 and name HB ) ( resid 76 and name H )    2.440    1.000    1.000
assi ( resid 74 and name HA ) ( resid 76 and name H )    4.220    1.000    1.000
assi ( resid 73 and name HA ) ( resid 76 and name H )    3.170    1.000    1.000
assi ( resid 76 and name H ) ( resid 78 and name H )    3.620    1.000    1.000
assi ( resid 75 and name H ) ( resid 76 and name H )    2.170    1.000    1.000
assi ( resid 75 and name HB ) ( resid 77 and name H )    4.120    1.000    1.000
assi ( resid 75 and name HG1# ) ( resid 77 and name H )    4.280    1.000    1.000
assi ( resid 78 and name H ) ( resid 78 and name HB# )    2.150    1.000    1.000
assi ( resid 18 and name HD1# ) ( resid 19 and name H )    4.000    1.000    1.000
assi ( resid 19 and name H ) ( resid 19 and name HB# )    2.410    1.000    1.000
assi ( resid 16 and name HA ) ( resid 19 and name H )    3.010    1.000    1.000
assi ( resid 18 and name H ) ( resid 19 and name H )    2.240    1.000    1.000
assi ( resid 78 and name HB# ) ( resid 79 and name H )    2.410    1.000    1.000
assi ( resid 75 and name HG1# ) ( resid 79 and name H )    3.200    1.000    1.000
assi ( resid 80 and name H ) ( resid 80 and name HB )    2.660    1.000    1.000
assi ( resid 79 and name HB2 ) ( resid 80 and name H )    3.490    1.000    1.000
assi ( resid 80 and name H ) ( resid 80 and name HG1# )    2.320    1.000    1.000
assi ( resid 77 and name HA ) ( resid 80 and name H )    3.170    1.000    1.000
assi ( resid 82 and name H ) ( resid 82 and name HG2# )    2.700    1.000    1.000
assi ( resid 82 and name H ) ( resid 82 and name HG13 )    2.770    1.000    1.000
assi ( resid 82 and name H ) ( resid 82 and name HG12 )    2.770    1.000    1.000
assi ( resid 81 and name H ) ( resid 82 and name H )    2.510    1.000    1.000
assi ( resid 82 and name H ) ( resid 83 and name H )    2.280    1.000    1.000
assi ( resid 81 and name H ) ( resid 83 and name H )    3.330    1.000    1.000
assi ( resid 82 and name HB ) ( resid 83 and name H )    3.090    1.000    1.000
assi ( resid 83 and name H ) ( resid 83 and name HB# )    2.100    1.000    1.000
assi ( resid 82 and name HG2# ) ( resid 83 and name H )    3.210    1.000    1.000
assi ( resid 82 and name HG2# ) ( resid 84 and name H )    4.500    1.000    1.000
assi ( resid 83 and name H ) ( resid 84 and name H )    2.720    1.000    1.000
assi ( resid 85 and name H ) ( resid 86 and name H )    2.790    1.000    1.000
assi ( resid 84 and name H ) ( resid 85 and name H )    2.650    1.000    1.000
assi ( resid 85 and name H ) ( resid 85 and name HD2# )    3.470    1.000    1.000
assi ( resid 85 and name HB3 ) ( resid 86 and name H )    3.500    1.000    1.000
assi ( resid 85 and name HB2 ) ( resid 86 and name H )    3.500    1.000    1.000
assi ( resid 85 and name HA ) ( resid 86 and name H )    2.490    1.000    1.000
assi ( resid 13 and name HA ) ( resid 13 and name HE1 )    4.060    1.000    1.000
assi ( resid 50 and name HD21 ) ( resid 58 and name HG2# )    3.180    1.000    1.000
assi ( resid 50 and name HD21 ) ( resid 55 and name HB )    3.660    1.000    1.000
assi ( resid 50 and name HD22 ) ( resid 55 and name H )    3.510    1.000    1.000
assi ( resid 50 and name HD22 ) ( resid 55 and name HB )    3.660    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 27 and name HD22 )    4.070    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 39 and name HD21 )    3.050    1.000    1.000
assi ( resid 39 and name HB2 ) ( resid 39 and name HD21 )    2.450    1.000    1.000
assi ( resid 39 and name HA ) ( resid 39 and name HD21 )    3.620    1.000    1.000
assi ( resid 39 and name HB2 ) ( resid 39 and name HD22 )    3.020    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 39 and name HD22 )    4.150    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 21 and name HA )    3.530    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 31 and name HB# )    3.190    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 57 and name HB2 )    4.140    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 8 and name HD1# )    2.120    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 31 and name HD# )    3.090    1.000    1.000
assi ( resid 24 and name HA ) ( resid 29 and name HD1# )    2.580    1.000    1.000
assi ( resid 29 and name HD1# ) ( resid 76 and name HA )    3.080    1.000    1.000
assi ( resid 27 and name HB2 ) ( resid 29 and name HD1# )    2.660    1.000    1.000
assi ( resid 27 and name HB3 ) ( resid 29 and name HD1# )    2.930    1.000    1.000
assi ( resid 29 and name HB ) ( resid 29 and name HD1# )    2.240    1.000    1.000
assi ( resid 82 and name HB ) ( resid 82 and name HD1# )    2.470    1.000    1.000
assi ( resid 61 and name HB3 ) ( resid 82 and name HD1# )    2.790    1.000    1.000
assi ( resid 79 and name HA ) ( resid 82 and name HD1# )    2.910    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 82 and name HD1# )    2.930    1.000    1.000
assi ( resid 36 and name HB ) ( resid 36 and name HD1# )    2.370    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 43 and name HB# )    3.050    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 36 and name HD1# )    2.020    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 37 and name HA )    3.430    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 43 and name HA )    2.600    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 57 and name HB2 )    2.900    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 10 and name HG2# )    2.100    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 31 and name HB# )    4.200    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 57 and name HB3 )    3.680    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 33 and name HB2 )    3.370    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 33 and name HA )    2.810    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 31 and name HD# )    3.210    1.000    1.000
assi ( resid 8 and name H ) ( resid 8 and name HG2# )    2.890    1.000    1.000
assi ( resid 81 and name HG3 ) ( resid 82 and name HG2# )    2.790    1.000    1.000
assi ( resid 78 and name HA ) ( resid 82 and name HG2# )    2.770    1.000    1.000
assi ( resid 56 and name HG2# ) ( resid 57 and name HA )    3.300    1.000    1.000
assi ( resid 23 and name HA ) ( resid 72 and name HB# )    3.640    1.000    1.000
assi ( resid 29 and name HA ) ( resid 29 and name HG2# )    2.260    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 31 and name HB# )    3.510    1.000    1.000
assi ( resid 24 and name HB2 ) ( resid 29 and name HG2# )    3.550    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 30 and name HB# )    2.990    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 31 and name HD# )    3.230    1.000    1.000
assi ( resid 40 and name HA ) ( resid 43 and name HB# )    2.320    1.000    1.000
assi ( resid 36 and name HB ) ( resid 43 and name HB# )    2.180    1.000    1.000
assi ( resid 49 and name HA ) ( resid 49 and name HG1# )    3.030    1.000    1.000
assi ( resid 20 and name HA ) ( resid 23 and name HB# )    2.440    1.000    1.000
assi ( resid 80 and name HA ) ( resid 83 and name HB# )    2.770    1.000    1.000
assi ( resid 83 and name HB# ) ( resid 86 and name HB# )    3.880    1.000    1.000
assi ( resid 30 and name HB# ) ( resid 31 and name HA )    3.850    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 36 and name HG2# )    2.140    1.000    1.000
assi ( resid 9 and name HA ) ( resid 36 and name HG2# )    3.180    1.000    1.000
assi ( resid 36 and name HA ) ( resid 36 and name HG2# )    2.380    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 43 and name HA )    2.650    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 36 and name HG2# )    2.630    1.000    1.000
assi ( resid 39 and name HB3 ) ( resid 42 and name HB# )    2.520    1.000    1.000
assi ( resid 39 and name HB2 ) ( resid 42 and name HB# )    3.830    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 42 and name HB# )    3.200    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 58 and name HG2# )    3.270    1.000    1.000
assi ( resid 58 and name HA ) ( resid 58 and name HG2# )    3.080    1.000    1.000
assi ( resid 58 and name HG2# ) ( resid 66 and name HB )    2.630    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 34 and name HG2# )    3.230    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 34 and name HG2# )    3.030    1.000    1.000
assi ( resid 34 and name HA ) ( resid 34 and name HG2# )    2.260    1.000    1.000
assi ( resid 32 and name HB# ) ( resid 34 and name HG2# )    4.000    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 34 and name HB )    3.420    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 32 and name HB# )    3.220    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 9 and name HE# )    2.930    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 9 and name HD# )    3.370    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 42 and name HB# )    2.120    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 39 and name HB3 )    3.390    1.000    1.000
assi ( resid 34 and name HA ) ( resid 34 and name HG1# )    2.380    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 34 and name HG1# )    2.640    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 34 and name HG1# )    2.710    1.000    1.000
assi ( resid 80 and name HA ) ( resid 80 and name HG2# )    2.370    1.000    1.000
assi ( resid 20 and name HA ) ( resid 20 and name HD1# )    3.740    1.000    1.000
assi ( resid 45 and name HD# ) ( resid 49 and name HG2# )    4.140    1.000    1.000
assi ( resid 49 and name HA ) ( resid 49 and name HG2# )    3.030    1.000    1.000
assi ( resid 49 and name HG2# ) ( resid 66 and name HG2# )    2.400    1.000    1.000
assi ( resid 3 and name HA ) ( resid 3 and name HG2# )    2.580    1.000    1.000
assi ( resid 66 and name HA ) ( resid 66 and name HG2# )    2.260    1.000    1.000
assi ( resid 60 and name HA ) ( resid 66 and name HG2# )    2.380    1.000    1.000
assi ( resid 60 and name HB2 ) ( resid 66 and name HG2# )    2.420    1.000    1.000
assi ( resid 24 and name HB3 ) ( resid 24 and name HD2# )    2.600    1.000    1.000
assi ( resid 59 and name HA ) ( resid 59 and name HG2# )    2.910    1.000    1.000
assi ( resid 59 and name HG2# ) ( resid 61 and name HE# )    3.310    1.000    1.000
assi ( resid 59 and name HG2# ) ( resid 61 and name HZ )    3.530    1.000    1.000
assi ( resid 24 and name H ) ( resid 24 and name HD2# )    3.590    1.000    1.000
assi ( resid 24 and name HA ) ( resid 24 and name HD2# )    2.180    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 75 and name HB )    2.980    1.000    1.000
assi ( resid 9 and name HA ) ( resid 10 and name HG2# )    3.470    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 17 and name HB3 )    3.230    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 17 and name HB2 )    3.230    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 33 and name HB2 )    2.910    1.000    1.000
assi ( resid 80 and name HA ) ( resid 80 and name HG1# )    2.170    1.000    1.000
assi ( resid 68 and name HA ) ( resid 68 and name HG2# )    3.250    1.000    1.000
assi ( resid 55 and name HB ) ( resid 68 and name HG2# )    2.920    1.000    1.000
assi ( resid 75 and name HA ) ( resid 75 and name HG1# )    2.410    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 75 and name HG1# )    2.440    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 75 and name HG1# )    2.630    1.000    1.000
assi ( resid 55 and name HA ) ( resid 55 and name HG2# )    2.180    1.000    1.000
assi ( resid 59 and name HA ) ( resid 59 and name HG1# )    2.910    1.000    1.000
assi ( resid 59 and name HG1# ) ( resid 61 and name HE# )    3.310    1.000    1.000
assi ( resid 59 and name HG1# ) ( resid 61 and name HZ )    3.530    1.000    1.000
assi ( resid 56 and name HG1# ) ( resid 57 and name HA )    3.300    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 67 and name HD1# )    2.170    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 13 and name HE3 )    3.530    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 13 and name HZ2 )    3.970    1.000    1.000
assi ( resid 11 and name HA ) ( resid 11 and name HG2# )    3.160    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 37 and name HA )    3.650    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 75 and name HG2# )    3.280    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 75 and name HG2# )    2.590    1.000    1.000
assi ( resid 75 and name HA ) ( resid 75 and name HG2# )    2.200    1.000    1.000
assi ( resid 70 and name HB2 ) ( resid 75 and name HG2# )    2.910    1.000    1.000
assi ( resid 70 and name HG3 ) ( resid 75 and name HG2# )    2.400    1.000    1.000
assi ( resid 70 and name HG2 ) ( resid 75 and name HG2# )    2.370    1.000    1.000
assi ( resid 79 and name HA ) ( resid 79 and name HD1# )    3.450    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 79 and name HD1# )    3.290    1.000    1.000
assi ( resid 18 and name HB# ) ( resid 18 and name HD2# )    2.310    1.000    1.000
assi ( resid 18 and name HB# ) ( resid 18 and name HD1# )    2.310    1.000    1.000
assi ( resid 18 and name HA ) ( resid 18 and name HD2# )    2.610    1.000    1.000
assi ( resid 18 and name HA ) ( resid 18 and name HD1# )    2.610    1.000    1.000
assi ( resid 24 and name HB3 ) ( resid 24 and name HD1# )    2.540    1.000    1.000
assi ( resid 20 and name HG ) ( resid 24 and name HD1# )    3.310    1.000    1.000
assi ( resid 24 and name HA ) ( resid 24 and name HD1# )    3.260    1.000    1.000
assi ( resid 21 and name HA ) ( resid 24 and name HD1# )    3.310    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 31 and name HD# )    3.080    1.000    1.000
assi ( resid 20 and name HD2# ) ( resid 70 and name HD# )    3.490    1.000    1.000
assi ( resid 6 and name HB2 ) ( resid 6 and name HD2# )    2.820    1.000    1.000
assi ( resid 6 and name HD2# ) ( resid 75 and name HG1# )    2.520    1.000    1.000
assi ( resid 6 and name HB3 ) ( resid 6 and name HD2# )    2.820    1.000    1.000
assi ( resid 6 and name HD2# ) ( resid 61 and name HE# )    3.410    1.000    1.000
assi ( resid 21 and name HA ) ( resid 21 and name HG2 )    3.040    1.000    1.000
assi ( resid 79 and name HA ) ( resid 79 and name HD2# )    3.450    1.000    1.000
assi ( resid 36 and name H ) ( resid 36 and name HG13 )    3.890    1.000    1.000
assi ( resid 18 and name HA ) ( resid 18 and name HG )    3.220    1.000    1.000
assi ( resid 27 and name HB2 ) ( resid 29 and name HG13 )    3.810    1.000    1.000
assi ( resid 29 and name H ) ( resid 29 and name HG13 )    3.370    1.000    1.000
assi ( resid 78 and name HA ) ( resid 78 and name HD3 )    3.120    1.000    1.000
assi ( resid 6 and name HD1# ) ( resid 61 and name HD# )    3.680    1.000    1.000
assi ( resid 6 and name HD1# ) ( resid 61 and name HE# )    3.410    1.000    1.000
assi ( resid 6 and name HB3 ) ( resid 6 and name HD1# )    2.820    1.000    1.000
assi ( resid 6 and name HB2 ) ( resid 6 and name HD1# )    2.820    1.000    1.000
assi ( resid 6 and name HD1# ) ( resid 75 and name HG1# )    2.520    1.000    1.000
assi ( resid 78 and name HA ) ( resid 78 and name HD2 )    3.120    1.000    1.000
assi ( resid 29 and name HA ) ( resid 29 and name HG12 )    2.930    1.000    1.000
assi ( resid 81 and name HA ) ( resid 81 and name HD# )    3.660    1.000    1.000
assi ( resid 21 and name HD2 ) ( resid 31 and name HE# )    3.590    1.000    1.000
assi ( resid 76 and name HD# ) ( resid 76 and name HE# )    2.010    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HD# )    3.510    1.000    1.000
assi ( resid 45 and name HZ ) ( resid 60 and name HD# )    4.210    1.000    1.000
assi ( resid 19 and name HB# ) ( resid 19 and name HD# )    3.100    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 78 and name HB# )    2.870    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 78 and name HB# )    3.570    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 78 and name HB# )    3.450    1.000    1.000
assi ( resid 75 and name HA ) ( resid 78 and name HB# )    3.590    1.000    1.000
assi ( resid 72 and name HA ) ( resid 75 and name HB )    2.830    1.000    1.000
assi ( resid 80 and name HB ) ( resid 81 and name HA )    3.480    1.000    1.000
assi ( resid 78 and name HA ) ( resid 81 and name HB# )    2.940    1.000    1.000
assi ( resid 76 and name HB3 ) ( resid 76 and name HE# )    3.450    1.000    1.000
assi ( resid 31 and name HD# ) ( resid 33 and name HB3 )    4.000    1.000    1.000
assi ( resid 59 and name HB ) ( resid 61 and name HE# )    3.650    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 34 and name HB )    3.470    1.000    1.000
assi ( resid 37 and name HA ) ( resid 37 and name HG# )    3.170    1.000    1.000
assi ( resid 36 and name HB ) ( resid 43 and name HA )    2.630    1.000    1.000
assi ( resid 7 and name HB ) ( resid 60 and name HB3 )    3.010    1.000    1.000
assi ( resid 7 and name HB ) ( resid 60 and name HB2 )    3.470    1.000    1.000
assi ( resid 24 and name HG ) ( resid 29 and name HB )    3.840    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 58 and name HB )    3.190    1.000    1.000
assi ( resid 24 and name HB3 ) ( resid 31 and name HD# )    3.230    1.000    1.000
assi ( resid 24 and name HA ) ( resid 27 and name HB3 )    3.000    1.000    1.000
assi ( resid 20 and name HB3 ) ( resid 21 and name H )    3.680    1.000    1.000
assi ( resid 76 and name HA ) ( resid 79 and name HB2 )    3.470    1.000    1.000
assi ( resid 34 and name HA ) ( resid 35 and name HB3 )    4.500    1.000    1.000
assi ( resid 34 and name HA ) ( resid 35 and name HB2 )    4.500    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 70 and name HD# )    3.460    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 70 and name HB3 )    3.650    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 70 and name HB2 )    3.650    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 57 and name HD3 )    3.070    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 57 and name HD2 )    3.070    1.000    1.000
assi ( resid 30 and name HA ) ( resid 31 and name HD# )    3.530    1.000    1.000
assi ( resid 39 and name HA ) ( resid 41 and name H )    3.500    1.000    1.000
assi ( resid 60 and name HA ) ( resid 66 and name HA )    2.750    1.000    1.000
assi ( resid 31 and name HA ) ( resid 31 and name HD# )    3.500    1.000    1.000
assi ( resid 9 and name HA ) ( resid 9 and name HD# )    2.830    1.000    1.000
assi ( resid 19 and name HA ) ( resid 22 and name H )    4.500    1.000    1.000
assi ( resid 16 and name HA ) ( resid 16 and name HD# )    2.760    1.000    1.000
assi ( resid 45 and name HA ) ( resid 48 and name H )    3.770    1.000    1.000
assi ( resid 58 and name HA ) ( resid 68 and name HA )    2.980    1.000    1.000
assi ( resid 22 and name HA ) ( resid 25 and name HB )    2.520    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 75 and name HA )    3.080    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 75 and name HA )    2.440    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 58 and name HB )    3.180    1.000    1.000
assi ( resid 60 and name HA ) ( resid 66 and name HB )    3.690    1.000    1.000
assi ( resid 61 and name HA ) ( resid 62 and name H )    2.430    1.000    1.000
assi ( resid 7 and name H ) ( resid 61 and name HA )    4.080    1.000    1.000
assi ( resid 61 and name HA ) ( resid 64 and name H )    4.500    1.000    1.000
assi ( resid 61 and name HA ) ( resid 61 and name HD# )    3.060    1.000    1.000
assi ( resid 60 and name H ) ( resid 61 and name HA )    3.780    1.000    1.000
assi ( resid 6 and name HA ) ( resid 61 and name HD# )    4.180    1.000    1.000
assi ( resid 71 and name HA ) ( resid 73 and name H )    3.450    1.000    1.000
assi ( resid 10 and name H ) ( resid 11 and name HA )    4.050    1.000    1.000
assi ( resid 8 and name HA ) ( resid 9 and name HD# )    3.710    1.000    1.000
assi ( resid 71 and name HB3 ) ( resid 73 and name H )    3.540    1.000    1.000
assi ( resid 73 and name HA ) ( resid 77 and name H )    3.610    1.000    1.000
assi ( resid 25 and name HB ) ( resid 31 and name HE# )    3.410    1.000    1.000
assi ( resid 23 and name HA ) ( resid 27 and name HD21 )    3.830    1.000    1.000
assi ( resid 3 and name HA ) ( resid 4 and name H )    2.280    1.000    1.000
assi ( resid 45 and name HA ) ( resid 45 and name HE# )    4.190    1.000    1.000
assi ( resid 45 and name HA ) ( resid 49 and name H )    4.500    1.000    1.000
assi ( resid 45 and name HA ) ( resid 45 and name HD# )    2.570    1.000    1.000
assi ( resid 9 and name H ) ( resid 10 and name HB )    3.920    1.000    1.000
assi ( resid 39 and name HD22 ) ( resid 42 and name HA )    4.210    1.000    1.000
assi ( resid 2 and name HA ) ( resid 3 and name H )    2.410    1.000    1.000
assi ( resid 25 and name HA ) ( resid 29 and name H )    3.030    1.000    1.000
assi ( resid 39 and name HD21 ) ( resid 41 and name HA )    4.500    1.000    1.000
assi ( resid 25 and name HA ) ( resid 31 and name HE# )    3.550    1.000    1.000
assi ( resid 4 and name HA ) ( resid 5 and name H )    2.080    1.000    1.000
assi ( resid 65 and name HB3 ) ( resid 66 and name H )    2.790    1.000    1.000
assi ( resid 39 and name H ) ( resid 40 and name HA )    4.350    1.000    1.000
assi ( resid 3 and name H ) ( resid 3 and name HB )    3.100    1.000    1.000
assi ( resid 20 and name HA ) ( resid 23 and name H )    3.480    1.000    1.000
assi ( resid 17 and name H ) ( resid 17 and name HB3 )    2.870    1.000    1.000
assi ( resid 24 and name HA ) ( resid 27 and name HD21 )    3.780    1.000    1.000
assi ( resid 78 and name HA ) ( resid 81 and name H )    2.950    1.000    1.000
assi ( resid 9 and name H ) ( resid 58 and name HB )    3.750    1.000    1.000
assi ( resid 44 and name HA ) ( resid 46 and name H )    3.690    1.000    1.000
assi ( resid 46 and name H ) ( resid 48 and name HB# )    4.330    1.000    1.000
assi ( resid 17 and name HA ) ( resid 19 and name H )    3.340    1.000    1.000
assi ( resid 58 and name HB ) ( resid 59 and name H )    3.800    1.000    1.000
assi ( resid 50 and name H ) ( resid 51 and name HA# )    3.950    1.000    1.000
assi ( resid 51 and name HA# ) ( resid 53 and name H )    4.430    1.000    1.000
assi ( resid 76 and name HA ) ( resid 79 and name H )    3.770    1.000    1.000
assi ( resid 76 and name HA ) ( resid 80 and name H )    3.590    1.000    1.000
assi ( resid 80 and name HA ) ( resid 83 and name H )    2.990    1.000    1.000
assi ( resid 80 and name HA ) ( resid 87 and name H )    4.040    1.000    1.000
assi ( resid 75 and name HA ) ( resid 78 and name H )    3.360    1.000    1.000
assi ( resid 7 and name HB ) ( resid 9 and name HE# )    3.360    1.000    1.000
assi ( resid 61 and name HB3 ) ( resid 62 and name H )    2.780    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 70 and name HD# )    4.500    1.000    1.000
assi ( resid 45 and name HB3 ) ( resid 46 and name H )    3.190    1.000    1.000
assi ( resid 16 and name HB3 ) ( resid 17 and name H )    4.070    1.000    1.000
assi ( resid 40 and name HD# ) ( resid 41 and name H )    4.500    1.000    1.000
assi ( resid 13 and name HB2 ) ( resid 14 and name H )    4.110    1.000    1.000
assi ( resid 61 and name HB2 ) ( resid 62 and name H )    3.210    1.000    1.000
assi ( resid 45 and name HB2 ) ( resid 46 and name H )    3.190    1.000    1.000
assi ( resid 16 and name HB2 ) ( resid 17 and name H )    4.070    1.000    1.000
assi ( resid 46 and name HA ) ( resid 48 and name H )    3.740    1.000    1.000
assi ( resid 45 and name HD# ) ( resid 46 and name HA )    3.590    1.000    1.000
assi ( resid 35 and name H ) ( resid 39 and name HB3 )    4.230    1.000    1.000
assi ( resid 39 and name HB3 ) ( resid 41 and name H )    4.500    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HE3 )    3.490    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HE2 )    3.490    1.000    1.000
assi ( resid 39 and name HB2 ) ( resid 41 and name H )    3.930    1.000    1.000
assi ( resid 31 and name HB# ) ( resid 32 and name H )    2.820    1.000    1.000
assi ( resid 73 and name HB# ) ( resid 74 and name H )    3.340    1.000    1.000
assi ( resid 53 and name H ) ( resid 53 and name HB2 )    2.890    1.000    1.000
assi ( resid 32 and name H ) ( resid 32 and name HB# )    2.840    1.000    1.000
assi ( resid 73 and name H ) ( resid 74 and name HB2 )    3.800    1.000    1.000
assi ( resid 74 and name H ) ( resid 74 and name HB2 )    2.570    1.000    1.000
assi ( resid 71 and name H ) ( resid 74 and name HB2 )    2.710    1.000    1.000
assi ( resid 74 and name HB2 ) ( resid 75 and name H )    3.560    1.000    1.000
assi ( resid 35 and name HB2 ) ( resid 36 and name H )    3.580    1.000    1.000
assi ( resid 73 and name H ) ( resid 75 and name HB )    4.500    1.000    1.000
assi ( resid 70 and name HB3 ) ( resid 71 and name H )    3.350    1.000    1.000
assi ( resid 71 and name H ) ( resid 74 and name HG2 )    3.380    1.000    1.000
assi ( resid 57 and name HB3 ) ( resid 58 and name H )    3.210    1.000    1.000
assi ( resid 44 and name H ) ( resid 44 and name HG2 )    3.000    1.000    1.000
assi ( resid 44 and name HG2 ) ( resid 45 and name H )    4.220    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 57 and name HG2 )    4.000    1.000    1.000
assi ( resid 16 and name HE# ) ( resid 57 and name HG2 )    3.780    1.000    1.000
assi ( resid 80 and name HB ) ( resid 87 and name H )    3.920    1.000    1.000
assi ( resid 80 and name HB ) ( resid 81 and name H )    2.850    1.000    1.000
assi ( resid 70 and name HB2 ) ( resid 71 and name H )    3.350    1.000    1.000
assi ( resid 44 and name H ) ( resid 44 and name HB2 )    2.660    1.000    1.000
assi ( resid 28 and name H ) ( resid 28 and name HB3 )    3.070    1.000    1.000
assi ( resid 79 and name H ) ( resid 79 and name HB3 )    2.530    1.000    1.000
assi ( resid 28 and name HB3 ) ( resid 29 and name H )    3.560    1.000    1.000
assi ( resid 79 and name HB3 ) ( resid 80 and name H )    3.490    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 79 and name HG )    4.500    1.000    1.000
assi ( resid 24 and name H ) ( resid 24 and name HB2 )    2.660    1.000    1.000
assi ( resid 2 and name HB ) ( resid 3 and name H )    3.700    1.000    1.000
assi ( resid 24 and name HB2 ) ( resid 31 and name HE# )    3.180    1.000    1.000
assi ( resid 23 and name H ) ( resid 24 and name HB2 )    4.070    1.000    1.000
assi ( resid 24 and name HB2 ) ( resid 31 and name HD# )    3.630    1.000    1.000
assi ( resid 36 and name HB ) ( resid 46 and name H )    4.500    1.000    1.000
assi ( resid 36 and name HB ) ( resid 44 and name H )    4.290    1.000    1.000
assi ( resid 36 and name HB ) ( resid 43 and name H )    3.380    1.000    1.000
assi ( resid 24 and name HG ) ( resid 25 and name H )    3.680    1.000    1.000
assi ( resid 81 and name HB# ) ( resid 82 and name H )    2.790    1.000    1.000
assi ( resid 82 and name H ) ( resid 82 and name HB )    3.120    1.000    1.000
assi ( resid 74 and name HB3 ) ( resid 75 and name H )    2.720    1.000    1.000
assi ( resid 81 and name H ) ( resid 81 and name HB# )    2.080    1.000    1.000
assi ( resid 76 and name H ) ( resid 76 and name HB3 )    2.640    1.000    1.000
assi ( resid 76 and name HB3 ) ( resid 77 and name H )    3.160    1.000    1.000
assi ( resid 86 and name HB# ) ( resid 87 and name H )    3.260    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 57 and name HG3 )    3.070    1.000    1.000
assi ( resid 16 and name HE# ) ( resid 57 and name HG3 )    3.360    1.000    1.000
assi ( resid 37 and name H ) ( resid 37 and name HB2 )    2.700    1.000    1.000
assi ( resid 86 and name H ) ( resid 86 and name HB# )    2.550    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 60 and name HB3 )    3.020    1.000    1.000
assi ( resid 18 and name HB# ) ( resid 19 and name H )    2.290    1.000    1.000
assi ( resid 21 and name HB# ) ( resid 31 and name HE# )    3.680    1.000    1.000
assi ( resid 59 and name HB ) ( resid 67 and name H )    3.420    1.000    1.000
assi ( resid 7 and name H ) ( resid 60 and name HB3 )    3.620    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 70 and name HG3 )    4.400    1.000    1.000
assi ( resid 59 and name H ) ( resid 59 and name HB )    2.700    1.000    1.000
assi ( resid 76 and name H ) ( resid 76 and name HB2 )    2.640    1.000    1.000
assi ( resid 76 and name HB2 ) ( resid 77 and name H )    3.160    1.000    1.000
assi ( resid 67 and name HG ) ( resid 68 and name H )    3.600    1.000    1.000
assi ( resid 67 and name H ) ( resid 67 and name HG )    3.600    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 67 and name HG )    3.460    1.000    1.000
assi ( resid 18 and name H ) ( resid 18 and name HG )    3.290    1.000    1.000
assi ( resid 60 and name H ) ( resid 60 and name HB2 )    3.070    1.000    1.000
assi ( resid 60 and name HB2 ) ( resid 61 and name H )    3.450    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HB2 )    3.420    1.000    1.000
assi ( resid 31 and name HE# ) ( resid 33 and name HB3 )    3.850    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 60 and name HB2 )    2.660    1.000    1.000
assi ( resid 33 and name HB3 ) ( resid 34 and name H )    3.520    1.000    1.000
assi ( resid 29 and name HB ) ( resid 30 and name H )    3.430    1.000    1.000
assi ( resid 39 and name H ) ( resid 43 and name HB# )    3.630    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 60 and name HB2 )    3.590    1.000    1.000
assi ( resid 43 and name H ) ( resid 43 and name HB# )    1.920    1.000    1.000
assi ( resid 43 and name HB# ) ( resid 45 and name H )    3.640    1.000    1.000
assi ( resid 39 and name HD21 ) ( resid 43 and name HB# )    3.900    1.000    1.000
assi ( resid 76 and name H ) ( resid 76 and name HD# )    4.090    1.000    1.000
assi ( resid 81 and name H ) ( resid 81 and name HD# )    3.690    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HG# )    3.840    1.000    1.000
assi ( resid 45 and name HZ ) ( resid 60 and name HG# )    4.430    1.000    1.000
assi ( resid 6 and name HB3 ) ( resid 7 and name H )    3.080    1.000    1.000
assi ( resid 9 and name H ) ( resid 57 and name HB2 )    4.300    1.000    1.000
assi ( resid 69 and name H ) ( resid 70 and name HG2 )    4.500    1.000    1.000
assi ( resid 34 and name HB ) ( resid 36 and name H )    3.150    1.000    1.000
assi ( resid 34 and name HB ) ( resid 35 and name H )    3.440    1.000    1.000
assi ( resid 35 and name H ) ( resid 42 and name HB# )    4.020    1.000    1.000
assi ( resid 42 and name HB# ) ( resid 44 and name H )    3.690    1.000    1.000
assi ( resid 42 and name HB# ) ( resid 43 and name H )    2.700    1.000    1.000
assi ( resid 39 and name HD22 ) ( resid 42 and name HB# )    3.070    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 34 and name HB )    2.420    1.000    1.000
assi ( resid 42 and name HB# ) ( resid 45 and name HD# )    3.780    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 42 and name HB# )    2.290    1.000    1.000
assi ( resid 79 and name H ) ( resid 79 and name HB2 )    2.530    1.000    1.000
assi ( resid 39 and name HD21 ) ( resid 42 and name HB# )    2.800    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 68 and name H )    2.880    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 67 and name HB# )    2.930    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 67 and name HB# )    3.780    1.000    1.000
assi ( resid 61 and name HZ ) ( resid 67 and name HB# )    3.540    1.000    1.000
assi ( resid 21 and name HD3 ) ( resid 31 and name HE# )    3.590    1.000    1.000
assi ( resid 24 and name HB3 ) ( resid 31 and name HE# )    3.790    1.000    1.000
assi ( resid 62 and name H ) ( resid 62 and name HB# )    2.150    1.000    1.000
assi ( resid 26 and name H ) ( resid 26 and name HB# )    1.870    1.000    1.000
assi ( resid 76 and name H ) ( resid 76 and name HG3 )    4.000    1.000    1.000
assi ( resid 62 and name HB# ) ( resid 63 and name H )    2.770    1.000    1.000
assi ( resid 26 and name HB# ) ( resid 27 and name HD21 )    3.160    1.000    1.000
assi ( resid 81 and name H ) ( resid 81 and name HG3 )    3.390    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 60 and name HD# )    3.420    1.000    1.000
assi ( resid 83 and name HB# ) ( resid 84 and name H )    2.980    1.000    1.000
assi ( resid 39 and name HD22 ) ( resid 41 and name HB# )    3.550    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 72 and name H )    3.790    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 24 and name H )    2.450    1.000    1.000
assi ( resid 83 and name HB# ) ( resid 86 and name H )    3.480    1.000    1.000
assi ( resid 41 and name HB# ) ( resid 42 and name H )    2.240    1.000    1.000
assi ( resid 83 and name HB# ) ( resid 85 and name H )    3.450    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 27 and name HD21 )    3.390    1.000    1.000
assi ( resid 20 and name H ) ( resid 20 and name HB3 )    2.500    1.000    1.000
assi ( resid 76 and name H ) ( resid 76 and name HG2 )    4.000    1.000    1.000
assi ( resid 76 and name H ) ( resid 77 and name HB# )    4.310    1.000    1.000
assi ( resid 77 and name HB# ) ( resid 79 and name H )    3.960    1.000    1.000
assi ( resid 74 and name H ) ( resid 77 and name HB# )    3.960    1.000    1.000
assi ( resid 77 and name H ) ( resid 77 and name HB# )    1.980    1.000    1.000
assi ( resid 81 and name H ) ( resid 81 and name HG2 )    3.390    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 6 and name H )    2.310    1.000    1.000
assi ( resid 77 and name HB# ) ( resid 78 and name H )    2.560    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 61 and name HD# )    4.500    1.000    1.000
assi ( resid 6 and name HG ) ( resid 61 and name HD# )    4.500    1.000    1.000
assi ( resid 5 and name H ) ( resid 5 and name HB# )    2.240    1.000    1.000
assi ( resid 19 and name H ) ( resid 21 and name HG3 )    4.250    1.000    1.000
assi ( resid 61 and name H ) ( resid 66 and name HG2# )    3.070    1.000    1.000
assi ( resid 24 and name H ) ( resid 72 and name HB# )    3.640    1.000    1.000
assi ( resid 20 and name H ) ( resid 21 and name HG3 )    3.850    1.000    1.000
assi ( resid 21 and name HG3 ) ( resid 22 and name H )    4.210    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 66 and name HG2# )    3.160    1.000    1.000
assi ( resid 45 and name HD# ) ( resid 66 and name HG2# )    4.500    1.000    1.000
assi ( resid 72 and name H ) ( resid 72 and name HB# )    2.520    1.000    1.000
assi ( resid 72 and name HB# ) ( resid 73 and name H )    2.590    1.000    1.000
assi ( resid 25 and name HG2# ) ( resid 31 and name HE# )    3.930    1.000    1.000
assi ( resid 8 and name HB ) ( resid 9 and name H )    3.420    1.000    1.000
assi ( resid 4 and name H ) ( resid 4 and name HB# )    2.120    1.000    1.000
assi ( resid 4 and name HB# ) ( resid 5 and name H )    2.570    1.000    1.000
assi ( resid 22 and name HG2# ) ( resid 23 and name H )    2.870    1.000    1.000
assi ( resid 4 and name HB# ) ( resid 6 and name H )    2.870    1.000    1.000
assi ( resid 20 and name HB2 ) ( resid 21 and name H )    3.680    1.000    1.000
assi ( resid 36 and name H ) ( resid 36 and name HG12 )    2.970    1.000    1.000
assi ( resid 36 and name HG12 ) ( resid 37 and name H )    3.130    1.000    1.000
assi ( resid 3 and name H ) ( resid 3 and name HG2# )    3.650    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 43 and name H )    2.960    1.000    1.000
assi ( resid 3 and name HG2# ) ( resid 4 and name H )    3.410    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 46 and name H )    3.770    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 39 and name HD21 )    3.270    1.000    1.000
assi ( resid 67 and name HD1# ) ( resid 68 and name H )    4.020    1.000    1.000
assi ( resid 68 and name H ) ( resid 68 and name HG2# )    3.560    1.000    1.000
assi ( resid 58 and name HG2# ) ( resid 67 and name H )    3.550    1.000    1.000
assi ( resid 67 and name H ) ( resid 67 and name HD1# )    3.910    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 36 and name HG2# )    3.230    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 42 and name H )    3.710    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 39 and name HD22 )    3.810    1.000    1.000
assi ( resid 55 and name H ) ( resid 58 and name HG2# )    4.450    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 45 and name HD# )    3.950    1.000    1.000
assi ( resid 50 and name HD22 ) ( resid 58 and name HG2# )    3.180    1.000    1.000
assi ( resid 58 and name HG2# ) ( resid 66 and name HA )    3.830    1.000    1.000
assi ( resid 79 and name H ) ( resid 79 and name HD1# )    3.440    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 67 and name HD1# )    3.510    1.000    1.000
assi ( resid 75 and name HG2# ) ( resid 76 and name H )    3.060    1.000    1.000
assi ( resid 79 and name H ) ( resid 80 and name HG1# )    4.100    1.000    1.000
assi ( resid 77 and name H ) ( resid 80 and name HG1# )    4.500    1.000    1.000
assi ( resid 75 and name H ) ( resid 75 and name HG2# )    2.190    1.000    1.000
assi ( resid 80 and name HG1# ) ( resid 87 and name H )    3.850    1.000    1.000
assi ( resid 80 and name HG1# ) ( resid 81 and name H )    4.050    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 37 and name H )    3.180    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 75 and name HG1# )    4.170    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 13 and name HD1 )    4.440    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 13 and name HH2 )    4.500    1.000    1.000
assi ( resid 11 and name H ) ( resid 11 and name HG2# )    3.280    1.000    1.000
assi ( resid 75 and name HG1# ) ( resid 78 and name H )    4.040    1.000    1.000
assi ( resid 79 and name H ) ( resid 79 and name HD2# )    3.440    1.000    1.000
assi ( resid 56 and name HG2# ) ( resid 58 and name H )    4.000    1.000    1.000
assi ( resid 18 and name H ) ( resid 18 and name HD1# )    3.400    1.000    1.000
assi ( resid 11 and name H ) ( resid 56 and name HG2# )    3.520    1.000    1.000
assi ( resid 29 and name H ) ( resid 29 and name HG12 )    3.370    1.000    1.000
assi ( resid 2 and name HG# ) ( resid 3 and name H )    3.770    1.000    1.000
assi ( resid 79 and name H ) ( resid 80 and name HG2# )    3.610    1.000    1.000
assi ( resid 80 and name H ) ( resid 80 and name HG2# )    2.430    1.000    1.000
assi ( resid 85 and name H ) ( resid 85 and name HD1# )    3.470    1.000    1.000
assi ( resid 63 and name H ) ( resid 82 and name HG2# )    3.530    1.000    1.000
assi ( resid 80 and name HG2# ) ( resid 81 and name H )    2.910    1.000    1.000
assi ( resid 18 and name HD2# ) ( resid 19 and name H )    4.000    1.000    1.000
assi ( resid 78 and name H ) ( resid 80 and name HG2# )    4.270    1.000    1.000
assi ( resid 9 and name H ) ( resid 10 and name HG2# )    3.740    1.000    1.000
assi ( resid 67 and name H ) ( resid 67 and name HD2# )    3.910    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 82 and name HG2# )    3.960    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 67 and name HD2# )    3.510    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 34 and name H )    3.760    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 11 and name H )    2.940    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 36 and name H )    3.470    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 35 and name H )    2.620    1.000    1.000
assi ( resid 62 and name H ) ( resid 82 and name HD1# )    3.190    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 43 and name H )    4.190    1.000    1.000
assi ( resid 82 and name H ) ( resid 82 and name HD1# )    2.940    1.000    1.000
assi ( resid 29 and name H ) ( resid 29 and name HG2# )    3.090    1.000    1.000
assi ( resid 82 and name HD1# ) ( resid 83 and name H )    3.210    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 61 and name HE# )    4.500    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 82 and name HD1# )    4.500    1.000    1.000
assi ( resid 21 and name HG2 ) ( resid 31 and name HE# )    3.930    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 31 and name HE# )    4.500    1.000    1.000
assi ( resid 24 and name H ) ( resid 29 and name HD1# )    4.270    1.000    1.000
assi ( resid 29 and name HD1# ) ( resid 76 and name H )    3.480    1.000    1.000
assi ( resid 29 and name H ) ( resid 29 and name HD1# )    3.030    1.000    1.000
assi ( resid 20 and name HD1# ) ( resid 21 and name H )    4.400    1.000    1.000
assi ( resid 46 and name H ) ( resid 46 and name HG2# )    3.040    1.000    1.000
assi ( resid 46 and name HG2# ) ( resid 47 and name H )    3.390    1.000    1.000
assi ( resid 56 and name H ) ( resid 56 and name HG1# )    3.240    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 36 and name HD1# )    3.600    1.000    1.000
assi ( resid 11 and name H ) ( resid 56 and name HG1# )    3.520    1.000    1.000
assi ( resid 10 and name H ) ( resid 36 and name HD1# )    3.040    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 46 and name H )    4.180    1.000    1.000
assi ( resid 34 and name H ) ( resid 36 and name HD1# )    4.500    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 29 and name H )    4.260    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 75 and name H )    3.480    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 31 and name HE# )    4.360    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 72 and name H )    4.000    1.000    1.000
assi ( resid 8 and name H ) ( resid 8 and name HG12 )    3.680    1.000    1.000
assi ( resid 6 and name H ) ( resid 6 and name HD1# )    3.540    1.000    1.000
assi ( resid 46 and name HG1# ) ( resid 47 and name H )    3.390    1.000    1.000
assi ( resid 20 and name HD2# ) ( resid 21 and name H )    4.400    1.000    1.000
assi ( resid 34 and name H ) ( resid 34 and name HG2# )    2.820    1.000    1.000
assi ( resid 34 and name HG2# ) ( resid 35 and name H )    3.010    1.000    1.000
assi ( resid 8 and name HG2# ) ( resid 34 and name H )    3.510    1.000    1.000
assi ( resid 45 and name HD# ) ( resid 49 and name HG1# )    4.140    1.000    1.000
assi ( resid 6 and name H ) ( resid 6 and name HD2# )    3.540    1.000    1.000
assi ( resid 6 and name HD2# ) ( resid 61 and name HD# )    3.680    1.000    1.000
assi ( resid 49 and name H ) ( resid 49 and name HG1# )    2.610    1.000    1.000
assi ( resid 49 and name H ) ( resid 49 and name HG2# )    2.610    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 9 and name H )    4.150    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 8 and name H )    2.550    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 34 and name H )    3.380    1.000    1.000
assi ( resid 7 and name HG2# ) ( resid 32 and name H )    3.710    1.000    1.000
assi ( resid 7 and name H ) ( resid 7 and name HG2# )    3.400    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 61 and name HZ )    4.500    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 31 and name HE# )    3.440    1.000    1.000
assi ( resid 59 and name H ) ( resid 59 and name HG1# )    3.380    1.000    1.000
assi ( resid 59 and name HG1# ) ( resid 60 and name H )    3.490    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 21 and name H )    4.500    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 31 and name HE# )    3.770    1.000    1.000
assi ( resid 56 and name HB ) ( resid 57 and name HA )    2.600    1.000    1.000
assi ( resid 9 and name HA ) ( resid 34 and name HB )    3.720    1.000    1.000
assi ( resid 60 and name HA ) ( resid 67 and name HB# )    4.500    1.000    1.000
assi ( resid 4 and name HB# ) ( resid 31 and name HA )    3.430    1.000    1.000
assi ( resid 60 and name HA ) ( resid 61 and name HD# )    3.510    1.000    1.000
assi ( resid 10 and name H ) ( resid 57 and name HA )    4.440    1.000    1.000
assi ( resid 32 and name H ) ( resid 33 and name HA )    3.850    1.000    1.000
assi ( resid 8 and name H ) ( resid 59 and name HA )    4.210    1.000    1.000
assi ( resid 58 and name HA ) ( resid 67 and name H )    4.080    1.000    1.000
assi ( resid 31 and name HD# ) ( resid 32 and name HA )    3.790    1.000    1.000
assi ( resid 38 and name HA ) ( resid 38 and name HD2 )    3.610    1.000    1.000
assi ( resid 29 and name H ) ( resid 31 and name HE# )    4.150    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 60 and name H )    3.550    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 66 and name HA )    3.170    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 67 and name H )    3.690    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 62 and name H )    3.380    1.000    1.000
assi ( resid 61 and name H ) ( resid 61 and name HD# )    2.490    1.000    1.000
assi ( resid 9 and name HD# ) ( resid 36 and name H )    4.400    1.000    1.000
assi ( resid 59 and name H ) ( resid 60 and name H )    3.670    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 79 and name H )    3.610    1.000    1.000
assi ( resid 39 and name HD22 ) ( resid 43 and name H )    3.940    1.000    1.000
assi ( resid 45 and name H ) ( resid 45 and name HD# )    3.240    1.000    1.000
assi ( resid 79 and name H ) ( resid 81 and name H )    3.420    1.000    1.000
assi ( resid 81 and name H ) ( resid 84 and name H )    4.500    1.000    1.000
assi ( resid 80 and name H ) ( resid 81 and name H )    2.410    1.000    1.000
assi ( resid 78 and name H ) ( resid 79 and name H )    2.430    1.000    1.000
assi ( resid 77 and name H ) ( resid 78 and name H )    2.420    1.000    1.000
assi ( resid 19 and name H ) ( resid 21 and name H )    3.710    1.000    1.000
assi ( resid 78 and name H ) ( resid 80 and name H )    3.940    1.000    1.000
assi ( resid 16 and name HD# ) ( resid 19 and name H )    4.420    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 78 and name H )    4.500    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 45 and name HE# )    3.720    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 45 and name HD# )    2.940    1.000    1.000
assi ( resid 61 and name HD# ) ( resid 61 and name HZ )    3.010    1.000    1.000
assi ( resid 76 and name H ) ( resid 77 and name H )    2.130    1.000    1.000
assi ( resid 84 and name H ) ( resid 86 and name H )    2.590    1.000    1.000
assi ( resid 20 and name H ) ( resid 23 and name H )    3.700    1.000    1.000
assi ( resid 79 and name H ) ( resid 80 and name H )    2.350    1.000    1.000
assi ( resid 60 and name H ) ( resid 61 and name H )    3.180    1.000    1.000
assi ( resid 27 and name HA ) ( resid 28 and name H )    2.410    1.000    1.000
assi ( resid 69 and name HA ) ( resid 70 and name HD# )    2.760    1.000    1.000
assi ( resid 23 and name HA ) ( resid 27 and name HB2 )    3.790    1.000    1.000
assi ( resid 26 and name HA ) ( resid 27 and name HB2 )    4.500    1.000    1.000
assi ( resid 36 and name HA ) ( resid 39 and name HB3 )    3.280    1.000    1.000
assi ( resid 24 and name HA ) ( resid 27 and name HB2 )    3.090    1.000    1.000
assi ( resid 46 and name HA ) ( resid 48 and name HB# )    4.500    1.000    1.000
assi ( resid 46 and name HA ) ( resid 58 and name HB )    4.500    1.000    1.000
assi ( resid 74 and name HB2 ) ( resid 75 and name HA )    3.310    1.000    1.000
assi ( resid 10 and name HB ) ( resid 57 and name HB3 )    4.040    1.000    1.000
assi ( resid 17 and name HA ) ( resid 57 and name HB3 )    3.610    1.000    1.000
assi ( resid 77 and name HA ) ( resid 80 and name HB )    3.810    1.000    1.000
assi ( resid 79 and name HA ) ( resid 79 and name HG )    3.020    1.000    1.000
assi ( resid 76 and name HA ) ( resid 79 and name HB3 )    3.470    1.000    1.000
assi ( resid 36 and name HB ) ( resid 37 and name HA )    3.890    1.000    1.000
assi ( resid 17 and name HA ) ( resid 57 and name HG3 )    2.720    1.000    1.000
assi ( resid 73 and name HA ) ( resid 76 and name HB3 )    3.190    1.000    1.000
assi ( resid 43 and name HA ) ( resid 46 and name HB )    3.130    1.000    1.000
assi ( resid 16 and name HA ) ( resid 19 and name HB# )    3.170    1.000    1.000
assi ( resid 16 and name HA ) ( resid 18 and name HB# )    3.810    1.000    1.000
assi ( resid 18 and name HA ) ( resid 21 and name HB# )    2.700    1.000    1.000
assi ( resid 73 and name HA ) ( resid 76 and name HB2 )    3.190    1.000    1.000
assi ( resid 36 and name HA ) ( resid 43 and name HB# )    3.180    1.000    1.000
assi ( resid 42 and name HA ) ( resid 43 and name HB# )    4.500    1.000    1.000
assi ( resid 24 and name HA ) ( resid 29 and name HB )    3.120    1.000    1.000
assi ( resid 78 and name HA ) ( resid 81 and name HD# )    3.020    1.000    1.000
assi ( resid 57 and name HB2 ) ( resid 69 and name HA )    4.450    1.000    1.000
assi ( resid 73 and name HA ) ( resid 76 and name HD# )    4.290    1.000    1.000
assi ( resid 36 and name HA ) ( resid 42 and name HB# )    2.880    1.000    1.000
assi ( resid 42 and name HB# ) ( resid 43 and name HA )    4.070    1.000    1.000
assi ( resid 79 and name HA ) ( resid 82 and name HG13 )    3.310    1.000    1.000
assi ( resid 28 and name HA ) ( resid 28 and name HG# )    2.420    1.000    1.000
assi ( resid 23 and name HA ) ( resid 26 and name HB# )    2.450    1.000    1.000
assi ( resid 76 and name HA ) ( resid 76 and name HG3 )    3.150    1.000    1.000
assi ( resid 29 and name HA ) ( resid 29 and name HG13 )    2.930    1.000    1.000
assi ( resid 78 and name HA ) ( resid 81 and name HG3 )    2.880    1.000    1.000
assi ( resid 22 and name HA ) ( resid 23 and name HB# )    4.140    1.000    1.000
assi ( resid 76 and name HA ) ( resid 76 and name HG2 )    3.150    1.000    1.000
assi ( resid 73 and name HA ) ( resid 77 and name HB# )    4.500    1.000    1.000
assi ( resid 4 and name HA ) ( resid 5 and name HB# )    3.100    1.000    1.000
assi ( resid 78 and name HA ) ( resid 81 and name HG2 )    2.880    1.000    1.000
assi ( resid 20 and name HA ) ( resid 72 and name HB# )    3.720    1.000    1.000
assi ( resid 18 and name HA ) ( resid 21 and name HG3 )    3.530    1.000    1.000
assi ( resid 25 and name HG2# ) ( resid 28 and name HA )    4.350    1.000    1.000
assi ( resid 22 and name HA ) ( resid 22 and name HG2# )    2.290    1.000    1.000
assi ( resid 79 and name HA ) ( resid 82 and name HG12 )    3.310    1.000    1.000
assi ( resid 20 and name HG ) ( resid 72 and name HA )    4.200    1.000    1.000
assi ( resid 36 and name HG13 ) ( resid 37 and name HA )    3.240    1.000    1.000
assi ( resid 68 and name HG2# ) ( resid 69 and name HA )    4.320    1.000    1.000
assi ( resid 77 and name HA ) ( resid 80 and name HG1# )    2.950    1.000    1.000
assi ( resid 24 and name HA ) ( resid 75 and name HG1# )    4.320    1.000    1.000
assi ( resid 74 and name HA ) ( resid 75 and name HG2# )    4.500    1.000    1.000
assi ( resid 80 and name HG2# ) ( resid 81 and name HA )    2.850    1.000    1.000
assi ( resid 2 and name HG# ) ( resid 3 and name HA )    3.530    1.000    1.000
assi ( resid 77 and name HA ) ( resid 80 and name HG2# )    3.200    1.000    1.000
assi ( resid 82 and name HA ) ( resid 82 and name HG2# )    2.300    1.000    1.000
assi ( resid 2 and name HG# ) ( resid 4 and name HA )    4.500    1.000    1.000
assi ( resid 2 and name HA ) ( resid 2 and name HG# )    2.730    1.000    1.000
assi ( resid 2 and name HG# ) ( resid 3 and name HB )    4.210    1.000    1.000
assi ( resid 81 and name HA ) ( resid 82 and name HG2# )    4.500    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 36 and name HA )    3.400    1.000    1.000
assi ( resid 82 and name HD1# ) ( resid 83 and name HA )    2.440    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 42 and name HA )    3.790    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 30 and name HA )    3.440    1.000    1.000
assi ( resid 82 and name HA ) ( resid 82 and name HD1# )    3.000    1.000    1.000
assi ( resid 46 and name HG2# ) ( resid 58 and name HB )    4.500    1.000    1.000
assi ( resid 36 and name HA ) ( resid 36 and name HD1# )    3.590    1.000    1.000
assi ( resid 20 and name HA ) ( resid 24 and name HD2# )    4.290    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 29 and name HA )    4.500    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 72 and name HA )    2.780    1.000    1.000
assi ( resid 20 and name HA ) ( resid 20 and name HD2# )    3.740    1.000    1.000
assi ( resid 46 and name HG1# ) ( resid 58 and name HB )    4.500    1.000    1.000
assi ( resid 57 and name HG2 ) ( resid 70 and name HD# )    3.810    1.000    1.000
assi ( resid 80 and name HB ) ( resid 87 and name HB# )    3.870    1.000    1.000
assi ( resid 28 and name HB3 ) ( resid 28 and name HD# )    3.230    1.000    1.000
assi ( resid 21 and name HA ) ( resid 24 and name HB2 )    3.450    1.000    1.000
assi ( resid 28 and name HB2 ) ( resid 28 and name HD# )    3.230    1.000    1.000
assi ( resid 40 and name HB# ) ( resid 40 and name HD# )    2.950    1.000    1.000
assi ( resid 76 and name HB2 ) ( resid 76 and name HE# )    3.450    1.000    1.000
assi ( resid 67 and name HG ) ( resid 70 and name HD# )    4.470    1.000    1.000
assi ( resid 60 and name HB2 ) ( resid 60 and name HE3 )    3.440    1.000    1.000
assi ( resid 60 and name HB2 ) ( resid 60 and name HE2 )    3.440    1.000    1.000
assi ( resid 57 and name HB2 ) ( resid 70 and name HD# )    3.310    1.000    1.000
assi ( resid 60 and name HG# ) ( resid 60 and name HE3 )    3.140    1.000    1.000
assi ( resid 60 and name HG# ) ( resid 60 and name HE2 )    3.140    1.000    1.000
assi ( resid 76 and name HG3 ) ( resid 76 and name HE# )    3.150    1.000    1.000
assi ( resid 40 and name HD# ) ( resid 41 and name HB# )    3.780    1.000    1.000
assi ( resid 76 and name HG2 ) ( resid 76 and name HE# )    3.150    1.000    1.000
assi ( resid 46 and name HA ) ( resid 58 and name HG2# )    3.580    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 39 and name HB3 )    3.360    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 39 and name HB2 )    4.500    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 58 and name HG2# )    3.440    1.000    1.000
assi ( resid 55 and name HB ) ( resid 58 and name HG2# )    3.270    1.000    1.000
assi ( resid 76 and name HE# ) ( resid 80 and name HG1# )    3.670    1.000    1.000
assi ( resid 27 and name HB2 ) ( resid 29 and name HG12 )    3.810    1.000    1.000
assi ( resid 81 and name HE# ) ( resid 82 and name HG2# )    3.550    1.000    1.000
assi ( resid 76 and name HE# ) ( resid 80 and name HG2# )    4.500    1.000    1.000
assi ( resid 61 and name HB2 ) ( resid 82 and name HD1# )    4.410    1.000    1.000
assi ( resid 27 and name HB2 ) ( resid 29 and name HG2# )    4.250    1.000    1.000
assi ( resid 20 and name HD1# ) ( resid 70 and name HD# )    3.490    1.000    1.000
assi ( resid 46 and name HA ) ( resid 46 and name HG2# )    3.110    1.000    1.000
assi ( resid 9 and name HB# ) ( resid 36 and name HD1# )    3.590    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 46 and name HA )    4.500    1.000    1.000
assi ( resid 46 and name HA ) ( resid 46 and name HG1# )    3.110    1.000    1.000
assi ( resid 81 and name HB# ) ( resid 81 and name HD# )    2.370    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 24 and name HB2 )    3.500    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 24 and name HG )    2.460    1.000    1.000
assi ( resid 60 and name HB3 ) ( resid 60 and name HD# )    2.540    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 79 and name HG )    3.570    1.000    1.000
assi ( resid 60 and name HG# ) ( resid 66 and name HG2# )    2.410    1.000    1.000
assi ( resid 78 and name HD3 ) ( resid 81 and name HD# )    3.770    1.000    1.000
assi ( resid 8 and name HB ) ( resid 33 and name HB3 )    3.100    1.000    1.000
assi ( resid 20 and name HG ) ( resid 24 and name HG )    2.910    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 43 and name HB# )    2.380    1.000    1.000
assi ( resid 34 and name HB ) ( resid 36 and name HG2# )    2.300    1.000    1.000
assi ( resid 36 and name HG2# ) ( resid 42 and name HB# )    2.490    1.000    1.000
assi ( resid 20 and name HG ) ( resid 23 and name HB# )    2.970    1.000    1.000
assi ( resid 76 and name HG3 ) ( resid 80 and name HG1# )    4.170    1.000    1.000
assi ( resid 76 and name HG2 ) ( resid 80 and name HG1# )    4.170    1.000    1.000
assi ( resid 70 and name HB3 ) ( resid 75 and name HG2# )    2.910    1.000    1.000
assi ( resid 10 and name HG2# ) ( resid 56 and name HB )    4.100    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 82 and name HD1# )    2.770    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 36 and name HG12 )    2.550    1.000    1.000
assi ( resid 34 and name HG1# ) ( resid 36 and name HG2# )    2.160    1.000    1.000
assi ( resid 29 and name HG2# ) ( resid 75 and name HG1# )    2.060    1.000    1.000
assi ( resid 20 and name HD1# ) ( resid 75 and name HG2# )    3.150    1.000    1.000
assi ( resid 29 and name HD1# ) ( resid 75 and name HG1# )    2.610    1.000    1.000
assi ( resid 20 and name HD1# ) ( resid 70 and name HG2 )    2.710    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 29 and name HB )    2.330    1.000    1.000
assi ( resid 20 and name HG ) ( resid 24 and name HD2# )    2.900    1.000    1.000
assi ( resid 36 and name HD1# ) ( resid 54 and name HB# )    3.990    1.000    1.000
assi ( resid 23 and name HB# ) ( resid 24 and name HD2# )    2.610    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 72 and name HB# )    2.770    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 75 and name HG1# )    2.440    1.000    1.000
assi ( resid 24 and name HD2# ) ( resid 75 and name HG2# )    2.710    1.000    1.000
assi ( resid 20 and name HD2# ) ( resid 70 and name HG2 )    2.710    1.000    1.000
assi ( resid 20 and name HD2# ) ( resid 75 and name HG2# )    3.150    1.000    1.000
assi ( resid 34 and name HG2# ) ( resid 36 and name HG2# )    3.000    1.000    1.000
assi ( resid 78 and name HD2 ) ( resid 81 and name HD# )    3.770    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 79 and name HD2# )    3.290    1.000    1.000
assi ( resid 18 and name HD1# ) ( resid 21 and name HG3 )    3.100    1.000    1.000
assi ( resid 81 and name HG2 ) ( resid 82 and name HG2# )    2.790    1.000    1.000
assi ( resid 18 and name HD2# ) ( resid 21 and name HG3 )    3.100    1.000    1.000
assi ( resid 67 and name HB# ) ( resid 67 and name HD2# )    2.170    1.000    1.000
assi ( resid 49 and name HG1# ) ( resid 66 and name HG2# )    2.400    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 75 and name HG1# )    2.820    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 75 and name HG2# )    3.760    1.000    1.000
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assi ( resid 8 and name HD1# ) ( resid 10 and name HG2# )    3.640    1.000    1.000
assi ( resid 8 and name HD1# ) ( resid 21 and name HG2 )    4.500    1.000    1.000
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assi ( resid 20 and name HD1# ) ( resid 24 and name HD1# )    3.630    1.000    1.000
assi ( resid 24 and name HD1# ) ( resid 29 and name HG2# )    2.960    1.000    1.000
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assi ( resid 20 and name HD2# ) ( resid 24 and name HD1# )    3.630    1.000    1.000
assi ( resid 11 and name HB ) ( resid 13 and name HE1 )    4.300    1.000    1.000
assi ( resid 11 and name HG2# ) ( resid 13 and name HE1 )    4.450    1.000    1.000
assi ( resid 5 and name HA ) ( resid 79 and name HD# )    4.440    1.000    1.000
assi ( resid 5 and name HB# ) ( resid 79 and name HD# )    2.560    1.000    1.000
assi ( resid 6 and name H ) ( resid 6 and name HD# )    2.980    1.000    1.000
assi ( resid 6 and name HB# ) ( resid 6 and name HD# )    1.640    1.000    1.000
assi ( resid 6 and name HB# ) ( resid 32 and name H )    4.340    1.000    1.000
assi ( resid 6 and name HB# ) ( resid 59 and name HG# )    2.560    1.000    1.000
assi ( resid 6 and name HB# ) ( resid 61 and name HD# )    3.990    1.000    1.000
assi ( resid 6 and name HD# ) ( resid 7 and name H )    3.190    1.000    1.000
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assi ( resid 6 and name HD# ) ( resid 31 and name HB# )    2.930    1.000    1.000
assi ( resid 6 and name HD# ) ( resid 31 and name HD# )    3.600    1.000    1.000
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assi ( resid 6 and name HD# ) ( resid 59 and name HG# )    2.070    1.000    1.000
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assi ( resid 6 and name HD# ) ( resid 61 and name HD# )    2.930    1.000    1.000
assi ( resid 6 and name HD# ) ( resid 61 and name HE# )    2.730    1.000    1.000
assi ( resid 6 and name HD# ) ( resid 61 and name HZ )    3.610    1.000    1.000
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assi ( resid 6 and name HD# ) ( resid 79 and name HD# )    2.200    1.000    1.000
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assi ( resid 8 and name HG1# ) ( resid 32 and name H )    4.090    1.000    1.000
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assi ( resid 8 and name HD1# ) ( resid 20 and name HD# )    2.630    1.000    1.000
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assi ( resid 9 and name HE# ) ( resid 46 and name HG# )    3.640    1.000    1.000
assi ( resid 9 and name HE# ) ( resid 60 and name HE# )    4.340    1.000    1.000
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assi ( resid 10 and name HG2# ) ( resid 17 and name HB# )    2.430    1.000    1.000
assi ( resid 11 and name H ) ( resid 14 and name HB# )    2.730    1.000    1.000
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assi ( resid 11 and name HB ) ( resid 13 and name HB# )    4.000    1.000    1.000
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assi ( resid 13 and name H ) ( resid 14 and name HB# )    4.170    1.000    1.000
assi ( resid 13 and name HB# ) ( resid 14 and name H )    3.450    1.000    1.000
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assi ( resid 16 and name HB# ) ( resid 17 and name H )    3.250    1.000    1.000
assi ( resid 16 and name HB# ) ( resid 18 and name H )    4.340    1.000    1.000
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assi ( resid 16 and name HD# ) ( resid 57 and name HD# )    2.560    1.000    1.000
assi ( resid 16 and name HE# ) ( resid 57 and name HD# )    3.500    1.000    1.000
assi ( resid 17 and name H ) ( resid 17 and name HB# )    2.100    1.000    1.000
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assi ( resid 17 and name HA ) ( resid 20 and name HD# )    4.170    1.000    1.000
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assi ( resid 17 and name HB# ) ( resid 18 and name HD# )    4.090    1.000    1.000
assi ( resid 17 and name HB# ) ( resid 21 and name H )    4.100    1.000    1.000
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assi ( resid 17 and name HB# ) ( resid 21 and name HD# )    3.050    1.000    1.000
assi ( resid 17 and name HB# ) ( resid 57 and name HD# )    3.890    1.000    1.000
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assi ( resid 18 and name HD# ) ( resid 19 and name H )    3.300    1.000    1.000
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assi ( resid 19 and name HG# ) ( resid 20 and name H )    3.340    1.000    1.000
assi ( resid 20 and name H ) ( resid 20 and name HB# )    1.960    1.000    1.000
assi ( resid 20 and name HA ) ( resid 20 and name HD# )    2.220    1.000    1.000
assi ( resid 20 and name HB# ) ( resid 20 and name HD# )    1.860    1.000    1.000
assi ( resid 20 and name HB# ) ( resid 21 and name H )    3.090    1.000    1.000
assi ( resid 20 and name HB# ) ( resid 21 and name HA )    3.810    1.000    1.000
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assi ( resid 21 and name H ) ( resid 21 and name HD# )    4.050    1.000    1.000
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assi ( resid 28 and name H ) ( resid 28 and name HB# )    2.440    1.000    1.000
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assi ( resid 35 and name H ) ( resid 35 and name HB# )    2.020    1.000    1.000
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assi ( resid 38 and name H ) ( resid 38 and name HB# )    2.640    1.000    1.000
assi ( resid 38 and name HB# ) ( resid 39 and name H )    3.420    1.000    1.000
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assi ( resid 42 and name HB# ) ( resid 45 and name HB# )    3.650    1.000    1.000
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assi ( resid 44 and name H ) ( resid 44 and name HB# )    1.880    1.000    1.000
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assi ( resid 44 and name HA ) ( resid 44 and name HG# )    2.660    1.000    1.000
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assi ( resid 45 and name HB# ) ( resid 46 and name H )    2.580    1.000    1.000
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assi ( resid 45 and name HE# ) ( resid 49 and name HG# )    2.700    1.000    1.000
assi ( resid 45 and name HE# ) ( resid 60 and name HE# )    2.780    1.000    1.000
assi ( resid 45 and name HZ ) ( resid 60 and name HE# )    3.730    1.000    1.000
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assi ( resid 46 and name HG# ) ( resid 54 and name HG# )    3.040    1.000    1.000
assi ( resid 46 and name HG# ) ( resid 55 and name H )    2.620    1.000    1.000
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assi ( resid 46 and name HG# ) ( resid 58 and name HB )    3.140    1.000    1.000
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assi ( resid 48 and name HA ) ( resid 49 and name HG# )    4.380    1.000    1.000
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assi ( resid 49 and name H ) ( resid 49 and name HG# )    2.010    1.000    1.000
assi ( resid 49 and name H ) ( resid 50 and name HD2# )    3.720    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 50 and name H )    2.670    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 50 and name HA )    4.440    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 50 and name HD2# )    2.540    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 58 and name HG2# )    2.160    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 66 and name HB )    3.310    1.000    1.000
assi ( resid 49 and name HG# ) ( resid 66 and name HG2# )    1.980    1.000    1.000
assi ( resid 50 and name H ) ( resid 50 and name HB# )    2.250    1.000    1.000
assi ( resid 50 and name H ) ( resid 50 and name HD2# )    3.590    1.000    1.000
assi ( resid 50 and name HB# ) ( resid 50 and name HD2# )    2.190    1.000    1.000
assi ( resid 50 and name HB# ) ( resid 52 and name H )    3.970    1.000    1.000
assi ( resid 50 and name HB# ) ( resid 53 and name H )    3.420    1.000    1.000
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assi ( resid 50 and name HD2# ) ( resid 55 and name HG2# )    4.160    1.000    1.000
assi ( resid 50 and name HD2# ) ( resid 58 and name HB )    4.340    1.000    1.000
assi ( resid 50 and name HD2# ) ( resid 58 and name HG2# )    2.560    1.000    1.000
assi ( resid 52 and name HA3 ) ( resid 53 and name HB# )    3.460    1.000    1.000
assi ( resid 53 and name H ) ( resid 53 and name HB# )    2.360    1.000    1.000
assi ( resid 53 and name H ) ( resid 53 and name HD2# )    4.060    1.000    1.000
assi ( resid 53 and name HB# ) ( resid 53 and name HD2# )    2.150    1.000    1.000
assi ( resid 53 and name HB# ) ( resid 55 and name H )    3.350    1.000    1.000
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assi ( resid 54 and name HA ) ( resid 54 and name HD# )    3.710    1.000    1.000
assi ( resid 54 and name HB# ) ( resid 54 and name HD# )    2.530    1.000    1.000
assi ( resid 55 and name HA ) ( resid 56 and name HG# )    3.170    1.000    1.000
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assi ( resid 55 and name HG2# ) ( resid 69 and name HD2# )    3.500    1.000    1.000
assi ( resid 56 and name H ) ( resid 56 and name HG# )    2.270    1.000    1.000
assi ( resid 56 and name HG# ) ( resid 57 and name HA )    2.550    1.000    1.000
assi ( resid 56 and name HG# ) ( resid 57 and name HD# )    4.170    1.000    1.000
assi ( resid 56 and name HG# ) ( resid 58 and name H )    2.600    1.000    1.000
assi ( resid 56 and name HG# ) ( resid 58 and name HB )    3.560    1.000    1.000
assi ( resid 59 and name H ) ( resid 59 and name HG# )    2.490    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 60 and name H )    2.580    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 61 and name H )    4.300    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 61 and name HE# )    2.700    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 61 and name HZ )    2.850    1.000    1.000
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assi ( resid 59 and name HG# ) ( resid 67 and name HB# )    2.710    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 67 and name HG )    3.720    1.000    1.000
assi ( resid 59 and name HG# ) ( resid 69 and name H )    4.430    1.000    1.000
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assi ( resid 59 and name HG# ) ( resid 70 and name HD# )    2.840    1.000    1.000
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assi ( resid 60 and name HB2 ) ( resid 60 and name HE# )    2.840    1.000    1.000
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assi ( resid 60 and name HG# ) ( resid 60 and name HE# )    2.470    1.000    1.000
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assi ( resid 61 and name HD# ) ( resid 79 and name HD# )    2.550    1.000    1.000
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assi ( resid 61 and name HE# ) ( resid 78 and name HG# )    3.920    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 79 and name HB# )    4.340    1.000    1.000
assi ( resid 61 and name HE# ) ( resid 79 and name HD# )    3.170    1.000    1.000
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assi ( resid 65 and name H ) ( resid 65 and name HB# )    2.250    1.000    1.000
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assi ( resid 67 and name HD# ) ( resid 70 and name HA )    3.810    1.000    1.000
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assign (resid    4 and name N    ) (resid    4 and name CA   )
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assign (resid    4 and name C    ) (resid    5 and name N    )
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assign (resid    5 and name N    ) (resid    5 and name CA   )
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assign (resid    6 and name C    ) (resid    7 and name N    )
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assign (resid    7 and name N    ) (resid    7 and name CA   )
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assign (resid    7 and name C    ) (resid    8 and name N    )
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assign (resid    8 and name N    ) (resid    8 and name CA   )
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assign (resid    8 and name C    ) (resid    9 and name N    )
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assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )  1.0  125.8   34.4 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )  1.0 -132.3   32.1 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )  1.0  166.6   23.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )  1.0 -114.0   43.5 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
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assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )  1.0  -64.1   21.9 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )  1.0  -28.6   27.7 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )  1.0 -127.4   35.4 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
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assign (resid   15 and name C    ) (resid   16 and name N    )
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assign (resid   16 and name N    ) (resid   16 and name CA   )
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assign (resid   16 and name C    ) (resid   17 and name N    )
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assign (resid   17 and name N    ) (resid   17 and name CA   )
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assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )  1.0  -65.5   20.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )  1.0  -40.7   20.0 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )  1.0  -65.4   20.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )  1.0  -40.7   20.0 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )  1.0  -64.2   20.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )  1.0  -44.7   20.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )  1.0  -61.0   20.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
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assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )  1.0  -68.3   20.0 2
assign (resid   22 and name N    ) (resid   22 and name CA   )
       (resid   22 and name C    ) (resid   23 and name N    )  1.0  -42.9   20.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )  1.0  -65.9   20.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name C    ) (resid   24 and name N    )  1.0  -40.4   20.0 2
assign (resid   23 and name C    ) (resid   24 and name N    )
       (resid   24 and name CA   ) (resid   24 and name C    )  1.0  -68.2   20.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name C    ) (resid   25 and name N    )  1.0  -35.0   21.6 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )  1.0  -66.0   20.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )  1.0  -41.1   20.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )  1.0  -64.0   20.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name C    ) (resid   27 and name N    )  1.0  -25.2   20.0 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )  1.0  -95.1   20.0 2
assign (resid   27 and name N    ) (resid   27 and name CA   )
       (resid   27 and name C    ) (resid   28 and name N    )  1.0    6.3   21.4 2
assign (resid   27 and name C    ) (resid   28 and name N    )
       (resid   28 and name CA   ) (resid   28 and name C    )  1.0   60.6   24.9 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name C    ) (resid   29 and name N    )  1.0   36.9   25.0 2
assign (resid   28 and name C    ) (resid   29 and name N    )
       (resid   29 and name CA   ) (resid   29 and name C    )  1.0  -95.4   33.3 2
assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )  1.0  130.9   20.0 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )  1.0 -133.2   51.9 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )  1.0  155.0   20.0 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )  1.0 -120.9   32.4 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )  1.0  122.3   20.0 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )  1.0 -109.0   40.7 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )  1.0  123.8   27.1 2
assign (resid   33 and name C    ) (resid   34 and name N    )
       (resid   34 and name CA   ) (resid   34 and name C    )  1.0 -109.0   48.5 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )  1.0  120.0   61.0 2
assign (resid   34 and name C    ) (resid   35 and name N    )
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assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )  1.0  -27.8   22.1 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )  1.0  -65.8   20.0 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
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assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )  1.0  -68.3   20.0 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )  1.0  -28.2   29.8 2
assign (resid   37 and name C    ) (resid   38 and name N    )
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assign (resid   38 and name N    ) (resid   38 and name CA   )
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assign (resid   39 and name C    ) (resid   40 and name N    )
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assign (resid   40 and name N    ) (resid   40 and name CA   )
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assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )  1.0  -60.2   20.0 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )  1.0  -41.9   20.1 2
assign (resid   41 and name C    ) (resid   42 and name N    )
       (resid   42 and name CA   ) (resid   42 and name C    )  1.0  -66.7   20.0 2
assign (resid   42 and name N    ) (resid   42 and name CA   )
       (resid   42 and name C    ) (resid   43 and name N    )  1.0  -41.1   20.0 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )  1.0  -59.8   20.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )  1.0  -40.0   20.0 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )  1.0  -63.1   20.0 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )  1.0  -41.5   20.0 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )  1.0  -67.1   20.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )  1.0  -40.7   20.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )  1.0  -62.0   20.0 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )  1.0  -42.0   20.0 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )  1.0  -62.4   20.0 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )  1.0  -39.0   20.0 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )  1.0  -61.8   20.0 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )  1.0  -33.6   23.0 2
assign (resid   48 and name C    ) (resid   49 and name N    )
       (resid   49 and name CA   ) (resid   49 and name C    )  1.0  -83.4   34.0 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name C    ) (resid   50 and name N    )  1.0  -12.0   29.1 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )  1.0  -90.1   35.5 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )  1.0  141.1   36.3 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )  1.0  -86.2   41.1 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )  1.0  114.0   55.0 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )  1.0 -115.1   34.3 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )  1.0  131.2   28.8 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )  1.0 -120.5   27.0 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )  1.0  131.3   29.2 2
assign (resid   59 and name C    ) (resid   60 and name N    )
       (resid   60 and name CA   ) (resid   60 and name C    )  1.0 -125.2   20.0 2
assign (resid   60 and name N    ) (resid   60 and name CA   )
       (resid   60 and name C    ) (resid   61 and name N    )  1.0  133.2   22.7 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )  1.0  -78.0   49.3 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )  1.0  153.4   42.6 2
assign (resid   61 and name C    ) (resid   62 and name N    )
       (resid   62 and name CA   ) (resid   62 and name C    )  1.0  -60.5   20.0 2
assign (resid   62 and name N    ) (resid   62 and name CA   )
       (resid   62 and name C    ) (resid   63 and name N    )  1.0  -30.8   20.0 2
assign (resid   62 and name C    ) (resid   63 and name N    )
       (resid   63 and name CA   ) (resid   63 and name C    )  1.0  -83.5   20.0 2
assign (resid   63 and name N    ) (resid   63 and name CA   )
       (resid   63 and name C    ) (resid   64 and name N    )  1.0    2.2   20.0 2
assign (resid   63 and name C    ) (resid   64 and name N    )
       (resid   64 and name CA   ) (resid   64 and name C    )  1.0   89.4   20.0 2
assign (resid   64 and name N    ) (resid   64 and name CA   )
       (resid   64 and name C    ) (resid   65 and name N    )  1.0   -1.8   20.0 2
assign (resid   65 and name C    ) (resid   66 and name N    )
       (resid   66 and name CA   ) (resid   66 and name C    )  1.0 -142.6   28.0 2
assign (resid   66 and name N    ) (resid   66 and name CA   )
       (resid   66 and name C    ) (resid   67 and name N    )  1.0  160.1   20.0 2
assign (resid   66 and name C    ) (resid   67 and name N    )
       (resid   67 and name CA   ) (resid   67 and name C    )  1.0 -143.3   45.1 2
assign (resid   67 and name N    ) (resid   67 and name CA   )
       (resid   67 and name C    ) (resid   68 and name N    )  1.0  131.1   21.1 2
assign (resid   67 and name C    ) (resid   68 and name N    )
       (resid   68 and name CA   ) (resid   68 and name C    )  1.0  -88.8   61.8 2
assign (resid   68 and name N    ) (resid   68 and name CA   )
       (resid   68 and name C    ) (resid   69 and name N    )  1.0  138.2   25.3 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )  1.0  -92.5   41.1 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )  1.0  156.4   40.2 2
assign (resid   71 and name C    ) (resid   72 and name N    )
       (resid   72 and name CA   ) (resid   72 and name C    )  1.0  -59.3   20.0 2
assign (resid   72 and name N    ) (resid   72 and name CA   )
       (resid   72 and name C    ) (resid   73 and name N    )  1.0  -39.7   20.0 2
assign (resid   72 and name C    ) (resid   73 and name N    )
       (resid   73 and name CA   ) (resid   73 and name C    )  1.0  -62.7   20.0 2
assign (resid   73 and name N    ) (resid   73 and name CA   )
       (resid   73 and name C    ) (resid   74 and name N    )  1.0  -39.3   20.0 2
assign (resid   73 and name C    ) (resid   74 and name N    )
       (resid   74 and name CA   ) (resid   74 and name C    )  1.0  -67.4   20.0 2
assign (resid   74 and name N    ) (resid   74 and name CA   )
       (resid   74 and name C    ) (resid   75 and name N    )  1.0  -40.0   20.0 2
assign (resid   74 and name C    ) (resid   75 and name N    )
       (resid   75 and name CA   ) (resid   75 and name C    )  1.0  -64.4   20.0 2
assign (resid   75 and name N    ) (resid   75 and name CA   )
       (resid   75 and name C    ) (resid   76 and name N    )  1.0  -41.4   20.0 2
assign (resid   75 and name C    ) (resid   76 and name N    )
       (resid   76 and name CA   ) (resid   76 and name C    )  1.0  -61.2   20.0 2
assign (resid   76 and name N    ) (resid   76 and name CA   )
       (resid   76 and name C    ) (resid   77 and name N    )  1.0  -42.8   20.0 2
assign (resid   76 and name C    ) (resid   77 and name N    )
       (resid   77 and name CA   ) (resid   77 and name C    )  1.0  -63.3   20.0 2
assign (resid   77 and name N    ) (resid   77 and name CA   )
       (resid   77 and name C    ) (resid   78 and name N    )  1.0  -41.0   20.0 2
assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )  1.0  -64.5   20.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name C    ) (resid   79 and name N    )  1.0  -42.5   20.0 2
assign (resid   78 and name C    ) (resid   79 and name N    )
       (resid   79 and name CA   ) (resid   79 and name C    )  1.0  -64.7   20.0 2
assign (resid   79 and name N    ) (resid   79 and name CA   )
       (resid   79 and name C    ) (resid   80 and name N    )  1.0  -39.4   20.0 2
assign (resid   79 and name C    ) (resid   80 and name N    )
       (resid   80 and name CA   ) (resid   80 and name C    )  1.0  -68.9   20.0 2
assign (resid   80 and name N    ) (resid   80 and name CA   )
       (resid   80 and name C    ) (resid   81 and name N    )  1.0  -40.8   20.0 2
assign (resid   80 and name C    ) (resid   81 and name N    )
       (resid   81 and name CA   ) (resid   81 and name C    )  1.0  -60.4   20.0 2
assign (resid   81 and name N    ) (resid   81 and name CA   )
       (resid   81 and name C    ) (resid   82 and name N    )  1.0  -39.9   20.0 2
assign (resid   81 and name C    ) (resid   82 and name N    )
       (resid   82 and name CA   ) (resid   82 and name C    )  1.0  -65.1   20.0 2
assign (resid   82 and name N    ) (resid   82 and name CA   )
       (resid   82 and name C    ) (resid   83 and name N    )  1.0  -34.2   21.4 2
assign (resid   82 and name C    ) (resid   83 and name N    )
       (resid   83 and name CA   ) (resid   83 and name C    )  1.0  -72.6   27.9 2
assign (resid   83 and name N    ) (resid   83 and name CA   )
       (resid   83 and name C    ) (resid   84 and name N    )  1.0  -28.8   32.8 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1   7.302   3.753  16.420
    2    H2   MET   1           HT2      MET   1   8.240   4.322  17.692
    3    H3   MET   1           HT3      MET   1   8.586   2.832  17.011
    4    HA   MET   1           HA       MET   1   8.777   5.404  15.634
    5    HB2  MET   1           HB2      MET   1  10.927   3.613  16.770
    6    HB3  MET   1           HB1      MET   1  11.238   4.935  15.653
    7    HG2  MET   1           HG2      MET   1  10.017   5.184  18.393
    8    HG3  MET   1           HG1      MET   1  11.673   5.590  17.954
    9    HE1  MET   1           HE1      MET   1  10.079   9.103  18.601
   10    HE2  MET   1           HE2      MET   1  11.358   7.974  19.046
   11    HE3  MET   1           HE3      MET   1   9.678   7.615  19.454
   12    H    VAL   2           HN       VAL   2   7.711   2.403  15.044
   13    HA   VAL   2           HA       VAL   2   9.334   1.915  12.753
   14    HB   VAL   2           HB       VAL   2   8.361  -0.020  13.942
   15   HG11  VAL   2          HG11      VAL   2   6.270   0.883  14.719
   16   HG12  VAL   2          HG12      VAL   2   5.989  -0.601  13.808
   17   HG13  VAL   2          HG13      VAL   2   5.660   0.966  13.067
   18   HG21  VAL   2          HG21      VAL   2   7.475  -1.267  12.010
   19   HG22  VAL   2          HG22      VAL   2   8.913  -0.330  11.616
   20   HG23  VAL   2          HG23      VAL   2   7.321   0.252  11.127
   21    H    THR   3           HN       THR   3   9.281   3.349  11.254
   22    HA   THR   3           HA       THR   3   7.041   4.973  10.718
   23    HB   THR   3           HB       THR   3   9.605   4.714   9.139
   24    HG1  THR   3           HG1      THR   3  10.504   5.982  10.642
   25   HG21  THR   3          HG21      THR   3   7.640   7.011   9.470
   26   HG22  THR   3          HG22      THR   3   7.808   6.015   8.023
   27   HG23  THR   3          HG23      THR   3   9.131   7.065   8.531
   28    H    ALA   4           HN       ALA   4   5.346   4.133   9.796
   29    HA   ALA   4           HA       ALA   4   5.518   2.201   7.665
   30    HB1  ALA   4           HB1      ALA   4   3.759   1.995   9.349
   31    HB2  ALA   4           HB2      ALA   4   3.060   2.281   7.757
   32    HB3  ALA   4           HB3      ALA   4   3.152   3.595   8.927
   33    H    ALA   5           HN       ALA   5   6.303   3.122   5.885
   34    HA   ALA   5           HA       ALA   5   5.563   5.820   5.126
   35    HB1  ALA   5           HB1      ALA   5   7.222   5.588   3.367
   36    HB2  ALA   5           HB2      ALA   5   7.389   3.869   3.730
   37    HB3  ALA   5           HB3      ALA   5   7.887   5.076   4.919
   38    H    LEU   6           HN       LEU   6   4.083   2.955   4.738
   39    HA   LEU   6           HA       LEU   6   3.094   3.590   2.039
   40    HB2  LEU   6           HB2      LEU   6   2.817   1.001   3.531
   41    HB3  LEU   6           HB1      LEU   6   2.355   1.336   1.881
   42    HG   LEU   6           HG       LEU   6   5.142   1.118   2.961
   43   HD11  LEU   6          HD11      LEU   6   5.227  -0.791   1.453
   44   HD12  LEU   6          HD12      LEU   6   3.535  -0.526   1.024
   45   HD13  LEU   6          HD13      LEU   6   3.970  -0.978   2.673
   46   HD21  LEU   6          HD21      LEU   6   5.042   2.855   1.272
   47   HD22  LEU   6          HD22      LEU   6   4.176   1.764   0.189
   48   HD23  LEU   6          HD23      LEU   6   5.845   1.418   0.641
   49    H    THR   7           HN       THR   7   1.078   4.302   1.944
   50    HA   THR   7           HA       THR   7  -0.670   3.807   4.219
   51    HB   THR   7           HB       THR   7  -1.025   5.653   1.837
   52    HG1  THR   7           HG1      THR   7   0.523   5.849   4.064
   53   HG21  THR   7          HG21      THR   7  -2.684   6.757   3.284
   54   HG22  THR   7          HG22      THR   7  -2.367   5.562   4.543
   55   HG23  THR   7          HG23      THR   7  -3.103   5.063   3.022
   56    H    ILE   8           HN       ILE   8  -1.764   1.941   3.896
   57    HA   ILE   8           HA       ILE   8  -2.419   1.187   1.140
   58    HB   ILE   8           HB       ILE   8  -2.060  -0.605   3.564
   59   HG12  ILE   8          HG12      ILE   8  -0.478  -0.346   1.002
   60   HG13  ILE   8          HG11      ILE   8   0.048   0.154   2.604
   61   HG21  ILE   8          HG21      ILE   8  -3.875  -1.438   2.172
   62   HG22  ILE   8          HG22      ILE   8  -2.479  -2.510   2.079
   63   HG23  ILE   8          HG23      ILE   8  -2.834  -1.417   0.744
   64   HD11  ILE   8          HD11      ILE   8   0.031  -2.171   3.330
   65   HD12  ILE   8          HD12      ILE   8   1.076  -1.942   1.926
   66   HD13  ILE   8          HD13      ILE   8  -0.517  -2.670   1.731
   67    H    TYR   9           HN       TYR   9  -4.429   0.903   0.598
   68    HA   TYR   9           HA       TYR   9  -6.414   1.667   2.524
   69    HB2  TYR   9           HB2      TYR   9  -6.520   1.226  -0.468
   70    HB3  TYR   9           HB1      TYR   9  -7.893   1.784   0.476
   71    HD1  TYR   9           HD1      TYR   9  -4.550   2.672  -0.784
   72    HD2  TYR   9           HD2      TYR   9  -7.971   4.082   1.300
   73    HE1  TYR   9           HE1      TYR   9  -3.692   4.955  -0.959
   74    HE2  TYR   9           HE2      TYR   9  -7.119   6.390   1.127
   75    HH   TYR   9           HH       TYR   9  -5.169   7.563   0.773
   76    H    THR  10           HN       THR  10  -7.783   0.233   3.531
   77    HA   THR  10           HA       THR  10  -8.051  -2.414   2.388
   78    HB   THR  10           HB       THR  10  -7.845  -3.312   4.737
   79    HG1  THR  10           HG1      THR  10  -6.632  -2.065   6.202
   80   HG21  THR  10          HG21      THR  10  -6.099  -3.738   3.072
   81   HG22  THR  10          HG22      THR  10  -5.380  -3.494   4.666
   82   HG23  THR  10          HG23      THR  10  -5.335  -2.199   3.470
   83    H    THR  11           HN       THR  11  -9.813  -3.639   3.432
   84    HA   THR  11           HA       THR  11 -11.783  -2.168   4.963
   85    HB   THR  11           HB       THR  11 -13.445  -3.433   3.411
   86    HG1  THR  11           HG1      THR  11 -12.488  -3.275   1.142
   87   HG21  THR  11          HG21      THR  11 -13.654  -1.528   1.881
   88   HG22  THR  11          HG22      THR  11 -12.117  -0.873   2.483
   89   HG23  THR  11          HG23      THR  11 -13.516  -1.048   3.563
   90    H    SER  12           HN       SER  12 -13.376  -3.814   5.865
   91    HA   SER  12           HA       SER  12 -12.108  -6.271   6.546
   92    HB2  SER  12           HB2      SER  12 -13.750  -5.043   8.027
   93    HB3  SER  12           HB1      SER  12 -15.023  -5.463   6.888
   94    HG   SER  12           HG       SER  12 -13.632  -7.675   7.616
   95    H    TRP  13           HN       TRP  13 -14.072  -5.094   4.028
   96    HA   TRP  13           HA       TRP  13 -15.038  -7.635   3.083
   97    HB2  TRP  13           HB2      TRP  13 -14.904  -5.139   1.375
   98    HB3  TRP  13           HB1      TRP  13 -16.110  -6.414   1.362
   99    HD1  TRP  13           HD1      TRP  13 -16.995  -6.375   4.361
  100    HE1  TRP  13           HE1      TRP  13 -18.291  -4.410   5.327
  101    HE3  TRP  13           HE3      TRP  13 -15.682  -2.848   0.930
  102    HZ2  TRP  13           HZ2      TRP  13 -18.727  -1.662   4.700
  103    HZ3  TRP  13           HZ3      TRP  13 -16.576  -0.569   1.179
  104    HH2  TRP  13           HH2      TRP  13 -18.068   0.009   3.020
  105    H    CYS  14           HN       CYS  14 -12.964  -8.731   2.884
  106    HA   CYS  14           HA       CYS  14 -11.208  -7.596   0.853
  107    HB2  CYS  14           HB2      CYS  14 -10.407  -6.881   3.039
  108    HB3  CYS  14           HB1      CYS  14 -10.339  -8.554   3.593
  109    H    GLY  15           HN       GLY  15  -9.586  -9.069   0.166
  110    HA2  GLY  15           HA2      GLY  15  -9.698 -11.874   0.585
  111    HA3  GLY  15           HA1      GLY  15 -10.426 -11.415  -0.962
  112    H    TYR  16           HN       TYR  16  -9.201 -10.266  -2.464
  113    HA   TYR  16           HA       TYR  16  -6.593 -11.091  -2.867
  114    HB2  TYR  16           HB2      TYR  16  -6.510  -9.479  -4.721
  115    HB3  TYR  16           HB1      TYR  16  -8.017 -10.371  -4.700
  116    HD1  TYR  16           HD1      TYR  16  -9.451  -8.560  -2.575
  117    HD2  TYR  16           HD2      TYR  16  -7.159  -7.660  -6.054
  118    HE1  TYR  16           HE1      TYR  16 -10.667  -6.456  -2.834
  119    HE2  TYR  16           HE2      TYR  16  -8.375  -5.549  -6.301
  120    HH   TYR  16           HH       TYR  16 -10.684  -4.687  -5.590
  121    H    CYS  17           HN       CYS  17  -7.717  -8.257  -1.198
  122    HA   CYS  17           HA       CYS  17  -5.339  -6.820  -1.115
  123    HB2  CYS  17           HB2      CYS  17  -6.585  -6.138   1.217
  124    HB3  CYS  17           HB1      CYS  17  -6.991  -5.429  -0.349
  125    H    LEU  18           HN       LEU  18  -6.607  -9.426   0.879
  126    HA   LEU  18           HA       LEU  18  -4.826  -9.140   3.036
  127    HB2  LEU  18           HB2      LEU  18  -7.002 -10.267   3.136
  128    HB3  LEU  18           HB1      LEU  18  -6.350 -11.563   2.157
  129    HG   LEU  18           HG       LEU  18  -4.775 -12.152   3.928
  130   HD11  LEU  18          HD11      LEU  18  -4.933 -11.065   6.128
  131   HD12  LEU  18          HD12      LEU  18  -6.052  -9.877   5.457
  132   HD13  LEU  18          HD13      LEU  18  -4.384  -9.943   4.889
  133   HD21  LEU  18          HD21      LEU  18  -6.385 -12.936   5.553
  134   HD22  LEU  18          HD22      LEU  18  -7.014 -13.100   3.896
  135   HD23  LEU  18          HD23      LEU  18  -7.547 -11.761   4.926
  136    H    ARG  19           HN       ARG  19  -4.710 -10.833   0.008
  137    HA   ARG  19           HA       ARG  19  -2.586 -12.608   0.451
  138    HB2  ARG  19           HB2      ARG  19  -3.153 -11.067  -2.089
  139    HB3  ARG  19           HB1      ARG  19  -2.198 -12.524  -1.961
  140    HG2  ARG  19           HG2      ARG  19  -5.169 -12.292  -1.496
  141    HG3  ARG  19           HG1      ARG  19  -4.395 -12.932  -2.936
  142    HD2  ARG  19           HD2      ARG  19  -5.050 -14.835  -1.725
  143    HD3  ARG  19           HD1      ARG  19  -3.339 -14.664  -1.365
  144    HE   ARG  19           HE       ARG  19  -3.853 -14.081   0.824
  145   HH11  ARG  19          HH11      ARG  19  -6.839 -14.388  -1.061
  146   HH12  ARG  19          HH12      ARG  19  -7.823 -14.615   0.309
  147   HH21  ARG  19          HH21      ARG  19  -5.251 -14.395   2.670
  148   HH22  ARG  19          HH22      ARG  19  -6.940 -14.617   2.427
  149    H    LEU  20           HN       LEU  20  -2.540  -9.365  -0.957
  150    HA   LEU  20           HA       LEU  20   0.239  -9.141  -1.091
  151    HB2  LEU  20           HB2      LEU  20  -1.181  -7.757  -2.465
  152    HB3  LEU  20           HB1      LEU  20  -1.934  -7.048  -1.059
  153    HG   LEU  20           HG       LEU  20   0.416  -6.091  -0.559
  154   HD11  LEU  20          HD11      LEU  20   1.848  -7.201  -2.161
  155   HD12  LEU  20          HD12      LEU  20   1.692  -5.521  -2.618
  156   HD13  LEU  20          HD13      LEU  20   0.768  -6.731  -3.477
  157   HD21  LEU  20          HD21      LEU  20  -0.070  -4.142  -2.003
  158   HD22  LEU  20          HD22      LEU  20  -1.443  -4.726  -1.060
  159   HD23  LEU  20          HD23      LEU  20  -1.338  -5.113  -2.775
  160    H    LYS  21           HN       LYS  21  -2.124  -8.171   1.303
  161    HA   LYS  21           HA       LYS  21  -0.498  -6.666   3.002
  162    HB2  LYS  21           HB2      LYS  21  -2.969  -6.677   3.081
  163    HB3  LYS  21           HB1      LYS  21  -2.938  -8.330   3.665
  164    HG2  LYS  21           HG2      LYS  21  -1.895  -7.626   5.718
  165    HG3  LYS  21           HG1      LYS  21  -1.770  -5.979   5.116
  166    HD2  LYS  21           HD2      LYS  21  -4.202  -5.785   5.054
  167    HD3  LYS  21           HD1      LYS  21  -4.365  -7.457   5.572
  168    HE2  LYS  21           HE2      LYS  21  -3.246  -6.977   7.672
  169    HE3  LYS  21           HE1      LYS  21  -2.961  -5.316   7.175
  170    HZ1  LYS  21           HZ1      LYS  21  -5.701  -6.441   7.499
  171    HZ2  LYS  21           HZ2      LYS  21  -5.231  -4.787   7.459
  172    HZ3  LYS  21           HZ3      LYS  21  -4.814  -5.752   8.732
  173    H    THR  22           HN       THR  22  -1.027 -10.134   2.791
  174    HA   THR  22           HA       THR  22   0.408 -10.811   5.158
  175    HB   THR  22           HB       THR  22  -0.127 -12.511   2.691
  176    HG1  THR  22           HG1      THR  22  -1.994 -11.566   3.821
  177   HG21  THR  22          HG21      THR  22   1.582 -13.482   4.167
  178   HG22  THR  22          HG22      THR  22   0.092 -14.424   4.242
  179   HG23  THR  22          HG23      THR  22   0.499 -13.311   5.548
  180    H    ALA  23           HN       ALA  23   1.196 -10.620   1.726
  181    HA   ALA  23           HA       ALA  23   3.841 -11.539   1.793
  182    HB1  ALA  23           HB1      ALA  23   2.643  -9.520  -0.091
  183    HB2  ALA  23           HB2      ALA  23   2.502 -11.268  -0.267
  184    HB3  ALA  23           HB3      ALA  23   4.084 -10.496  -0.377
  185    H    LEU  24           HN       LEU  24   2.597  -8.232   2.065
  186    HA   LEU  24           HA       LEU  24   5.185  -7.099   2.208
  187    HB2  LEU  24           HB2      LEU  24   2.570  -5.944   3.130
  188    HB3  LEU  24           HB1      LEU  24   4.057  -5.030   2.941
  189    HG   LEU  24           HG       LEU  24   2.430  -6.340   0.792
  190   HD11  LEU  24          HD11      LEU  24   2.123  -4.053  -0.037
  191   HD12  LEU  24          HD12      LEU  24   3.026  -3.447   1.349
  192   HD13  LEU  24          HD13      LEU  24   1.482  -4.269   1.590
  193   HD21  LEU  24          HD21      LEU  24   4.003  -5.371  -0.821
  194   HD22  LEU  24          HD22      LEU  24   4.780  -6.560   0.221
  195   HD23  LEU  24          HD23      LEU  24   5.021  -4.834   0.511
  196    H    THR  25           HN       THR  25   2.971  -8.215   4.695
  197    HA   THR  25           HA       THR  25   4.463  -7.169   6.859
  198    HB   THR  25           HB       THR  25   2.623  -9.593   6.893
  199    HG1  THR  25           HG1      THR  25   1.389  -7.916   6.161
  200   HG21  THR  25          HG21      THR  25   3.443  -7.663   9.073
  201   HG22  THR  25          HG22      THR  25   4.005  -9.323   8.909
  202   HG23  THR  25          HG23      THR  25   2.304  -8.997   9.255
  203    H    ALA  26           HN       ALA  26   4.518 -10.284   5.157
  204    HA   ALA  26           HA       ALA  26   6.486 -11.498   6.810
  205    HB1  ALA  26           HB1      ALA  26   5.743 -12.138   3.953
  206    HB2  ALA  26           HB2      ALA  26   4.956 -12.798   5.388
  207    HB3  ALA  26           HB3      ALA  26   6.643 -13.186   5.050
  208    H    ASN  27           HN       ASN  27   6.619  -9.326   4.179
  209    HA   ASN  27           HA       ASN  27   9.458  -9.689   3.734
  210    HB2  ASN  27           HB2      ASN  27   7.283  -8.222   2.418
  211    HB3  ASN  27           HB1      ASN  27   8.906  -7.531   2.221
  212   HD21  ASN  27          HD21      ASN  27   6.739 -10.099   1.457
  213   HD22  ASN  27          HD22      ASN  27   7.733 -10.885   0.290
  214    H    ARG  28           HN       ARG  28   7.873  -8.331   6.136
  215    HA   ARG  28           HA       ARG  28   8.394  -6.945   7.814
  216    HB2  ARG  28           HB2      ARG  28  11.093  -6.827   6.473
  217    HB3  ARG  28           HB1      ARG  28  10.756  -6.208   8.085
  218    HG2  ARG  28           HG2      ARG  28  10.185  -8.451   8.841
  219    HG3  ARG  28           HG1      ARG  28  10.465  -9.075   7.217
  220    HD2  ARG  28           HD2      ARG  28  12.521  -7.758   8.982
  221    HD3  ARG  28           HD1      ARG  28  12.376  -9.491   8.692
  222    HE   ARG  28           HE       ARG  28  12.648  -7.996   6.277
  223   HH11  ARG  28          HH11      ARG  28  14.572  -9.338   8.957
  224   HH12  ARG  28          HH12      ARG  28  15.956  -9.541   7.993
  225   HH21  ARG  28          HH21      ARG  28  14.556  -8.259   5.036
  226   HH22  ARG  28          HH22      ARG  28  15.967  -8.914   5.761
  227    H    ILE  29           HN       ILE  29   7.211  -5.945   5.436
  228    HA   ILE  29           HA       ILE  29   8.236  -3.252   5.205
  229    HB   ILE  29           HB       ILE  29   6.023  -4.710   3.701
  230   HG12  ILE  29          HG12      ILE  29   8.787  -3.822   2.846
  231   HG13  ILE  29          HG11      ILE  29   8.336  -5.470   3.261
  232   HG21  ILE  29          HG21      ILE  29   7.127  -1.936   3.305
  233   HG22  ILE  29          HG22      ILE  29   5.502  -2.355   3.837
  234   HG23  ILE  29          HG23      ILE  29   6.032  -2.774   2.207
  235   HD11  ILE  29          HD11      ILE  29   6.805  -5.524   1.379
  236   HD12  ILE  29          HD12      ILE  29   8.449  -5.141   0.877
  237   HD13  ILE  29          HD13      ILE  29   7.237  -3.859   0.974
  238    H    ALA  30           HN       ALA  30   7.440  -1.661   6.355
  239    HA   ALA  30           HA       ALA  30   5.174  -2.106   8.089
  240    HB1  ALA  30           HB1      ALA  30   7.048   0.251   7.865
  241    HB2  ALA  30           HB2      ALA  30   7.212  -1.092   8.995
  242    HB3  ALA  30           HB3      ALA  30   5.842   0.008   9.129
  243    H    TYR  31           HN       TYR  31   3.207  -1.345   7.718
  244    HA   TYR  31           HA       TYR  31   2.854   0.802   5.793
  245    HB2  TYR  31           HB2      TYR  31   0.967  -0.431   4.740
  246    HB3  TYR  31           HB1      TYR  31   2.534  -1.172   4.453
  247    HD1  TYR  31           HD1      TYR  31  -0.633  -1.481   6.349
  248    HD2  TYR  31           HD2      TYR  31   2.991  -3.382   5.195
  249    HE1  TYR  31           HE1      TYR  31  -1.496  -3.619   7.184
  250    HE2  TYR  31           HE2      TYR  31   2.142  -5.519   6.029
  251    HH   TYR  31           HH       TYR  31   0.561  -6.388   7.452
  252    H    ASP  32           HN       ASP  32   0.833   1.831   5.945
  253    HA   ASP  32           HA       ASP  32  -0.525   1.466   8.515
  254    HB2  ASP  32           HB2      ASP  32   0.728   3.555   8.465
  255    HB3  ASP  32           HB1      ASP  32   0.033   3.966   6.904
  256    H    GLU  33           HN       GLU  33  -2.491   0.651   8.174
  257    HA   GLU  33           HA       GLU  33  -3.612   0.959   5.530
  258    HB2  GLU  33           HB2      GLU  33  -5.150  -0.839   6.111
  259    HB3  GLU  33           HB1      GLU  33  -3.488  -1.309   6.395
  260    HG2  GLU  33           HG2      GLU  33  -3.841  -0.859   8.808
  261    HG3  GLU  33           HG1      GLU  33  -5.545  -0.562   8.446
  262    H    VAL  34           HN       VAL  34  -5.658   1.670   5.140
  263    HA   VAL  34           HA       VAL  34  -6.292   3.894   6.889
  264    HB   VAL  34           HB       VAL  34  -7.524   3.432   4.166
  265   HG11  VAL  34          HG11      VAL  34  -7.059   5.962   5.715
  266   HG12  VAL  34          HG12      VAL  34  -8.598   5.134   5.490
  267   HG13  VAL  34          HG13      VAL  34  -7.766   5.838   4.102
  268   HG21  VAL  34          HG21      VAL  34  -5.741   4.824   3.219
  269   HG22  VAL  34          HG22      VAL  34  -5.111   3.323   3.900
  270   HG23  VAL  34          HG23      VAL  34  -4.929   4.838   4.786
  271    H    ASP  35           HN       ASP  35  -8.310   4.491   7.426
  272    HA   ASP  35           HA       ASP  35 -10.022   2.432   8.424
  273    HB2  ASP  35           HB2      ASP  35  -9.981   5.394   8.929
  274    HB3  ASP  35           HB1      ASP  35 -11.133   4.288   9.670
  275    H    ILE  36           HN       ILE  36 -10.084   3.598   5.532
  276    HA   ILE  36           HA       ILE  36 -12.163   5.250   4.858
  277    HB   ILE  36           HB       ILE  36 -12.375   4.107   2.680
  278   HG12  ILE  36          HG12      ILE  36 -10.304   2.181   3.710
  279   HG13  ILE  36          HG11      ILE  36 -12.022   1.791   3.614
  280   HG21  ILE  36          HG21      ILE  36  -9.544   4.516   3.600
  281   HG22  ILE  36          HG22      ILE  36 -10.662   5.760   3.020
  282   HG23  ILE  36          HG23      ILE  36 -10.119   4.490   1.928
  283   HD11  ILE  36          HD11      ILE  36 -10.721   0.920   1.719
  284   HD12  ILE  36          HD12      ILE  36 -10.319   2.602   1.279
  285   HD13  ILE  36          HD13      ILE  36 -11.985   2.050   1.232
  286    H    GLU  37           HN       GLU  37 -12.635   1.880   5.764
  287    HA   GLU  37           HA       GLU  37 -15.185   1.439   4.669
  288    HB2  GLU  37           HB2      GLU  37 -13.625  -0.232   5.720
  289    HB3  GLU  37           HB1      GLU  37 -14.071   0.441   7.270
  290    HG2  GLU  37           HG2      GLU  37 -16.394  -0.227   6.876
  291    HG3  GLU  37           HG1      GLU  37 -15.895  -0.965   5.348
  292    H    HIS  38           HN       HIS  38 -14.054   2.828   7.641
  293    HA   HIS  38           HA       HIS  38 -16.770   3.463   8.556
  294    HB2  HIS  38           HB2      HIS  38 -15.137   2.229  10.032
  295    HB3  HIS  38           HB1      HIS  38 -14.128   3.662  10.024
  296    HD1  HIS  38           HD1      HIS  38 -17.077   2.147  11.668
  297    HD2  HIS  38           HD2      HIS  38 -15.187   5.849  11.495
  298    HE1  HIS  38           HE1      HIS  38 -17.944   3.461  13.620
  299    H    ASN  39           HN       ASN  39 -13.667   4.821   7.698
  300    HA   ASN  39           HA       ASN  39 -14.524   7.554   8.240
  301    HB2  ASN  39           HB2      ASN  39 -12.267   6.859   8.937
  302    HB3  ASN  39           HB1      ASN  39 -11.868   6.467   7.273
  303   HD21  ASN  39          HD21      ASN  39 -11.354   8.083   5.890
  304   HD22  ASN  39          HD22      ASN  39 -11.065   9.718   6.389
  305    H    ARG  40           HN       ARG  40 -15.819   8.292   6.761
  306    HA   ARG  40           HA       ARG  40 -16.022   7.289   4.129
  307    HB2  ARG  40           HB2      ARG  40 -17.793   8.893   3.784
  308    HB3  ARG  40           HB1      ARG  40 -17.948   8.152   5.367
  309    HG2  ARG  40           HG2      ARG  40 -16.927  10.181   6.365
  310    HG3  ARG  40           HG1      ARG  40 -16.899  10.909   4.761
  311    HD2  ARG  40           HD2      ARG  40 -18.834  11.703   5.920
  312    HD3  ARG  40           HD1      ARG  40 -19.360  10.597   4.648
  313    HE   ARG  40           HE       ARG  40 -19.039   9.667   7.399
  314   HH11  ARG  40          HH11      ARG  40 -21.187  10.301   4.650
  315   HH12  ARG  40          HH12      ARG  40 -22.491   9.417   5.291
  316   HH21  ARG  40          HH21      ARG  40 -20.857   8.497   8.296
  317   HH22  ARG  40          HH22      ARG  40 -22.297   8.382   7.411
  318    H    ALA  41           HN       ALA  41 -14.462  10.240   5.306
  319    HA   ALA  41           HA       ALA  41 -14.346  11.549   2.817
  320    HB1  ALA  41           HB1      ALA  41 -14.062  12.701   4.965
  321    HB2  ALA  41           HB2      ALA  41 -12.753  13.051   3.836
  322    HB3  ALA  41           HB3      ALA  41 -12.496  11.915   5.161
  323    H    ALA  42           HN       ALA  42 -12.319   9.146   4.199
  324    HA   ALA  42           HA       ALA  42 -10.269   9.565   2.182
  325    HB1  ALA  42           HB1      ALA  42  -9.569   8.909   4.443
  326    HB2  ALA  42           HB2      ALA  42  -9.068   7.716   3.247
  327    HB3  ALA  42           HB3      ALA  42 -10.464   7.403   4.278
  328    H    ALA  43           HN       ALA  43 -13.094   7.680   2.647
  329    HA   ALA  43           HA       ALA  43 -12.442   5.503   0.938
  330    HB1  ALA  43           HB1      ALA  43 -14.236   5.364   2.622
  331    HB2  ALA  43           HB2      ALA  43 -14.833   4.987   1.008
  332    HB3  ALA  43           HB3      ALA  43 -15.161   6.564   1.721
  333    H    GLU  44           HN       GLU  44 -14.038   8.573   0.527
  334    HA   GLU  44           HA       GLU  44 -14.816   8.214  -2.154
  335    HB2  GLU  44           HB2      GLU  44 -14.194  10.823  -0.762
  336    HB3  GLU  44           HB1      GLU  44 -15.200  10.611  -2.189
  337    HG2  GLU  44           HG2      GLU  44 -15.793   9.732   0.628
  338    HG3  GLU  44           HG1      GLU  44 -16.648  10.937  -0.330
  339    H    PHE  45           HN       PHE  45 -11.897   9.261  -0.624
  340    HA   PHE  45           HA       PHE  45 -10.582  10.352  -2.867
  341    HB2  PHE  45           HB2      PHE  45  -9.939  10.865  -0.549
  342    HB3  PHE  45           HB1      PHE  45  -9.452   9.198  -0.303
  343    HD1  PHE  45           HD1      PHE  45  -8.717  12.179  -2.396
  344    HD2  PHE  45           HD2      PHE  45  -7.244   8.582  -0.664
  345    HE1  PHE  45           HE1      PHE  45  -6.441  12.766  -3.118
  346    HE2  PHE  45           HE2      PHE  45  -4.967   9.161  -1.387
  347    HZ   PHE  45           HZ       PHE  45  -4.565  11.256  -2.613
  348    H    VAL  46           HN       VAL  46 -10.916   7.096  -1.636
  349    HA   VAL  46           HA       VAL  46  -8.884   5.830  -3.139
  350    HB   VAL  46           HB       VAL  46 -11.579   4.643  -2.388
  351   HG11  VAL  46          HG11      VAL  46 -10.392   3.297  -4.023
  352   HG12  VAL  46          HG12      VAL  46 -10.363   2.481  -2.458
  353   HG13  VAL  46          HG13      VAL  46  -8.938   3.343  -3.041
  354   HG21  VAL  46          HG21      VAL  46 -10.483   3.788  -0.390
  355   HG22  VAL  46          HG22      VAL  46 -10.431   5.553  -0.428
  356   HG23  VAL  46          HG23      VAL  46  -8.995   4.618  -0.837
  357    H    GLY  47           HN       GLY  47 -12.237   6.587  -3.809
  358    HA2  GLY  47           HA2      GLY  47 -12.470   5.405  -6.345
  359    HA3  GLY  47           HA1      GLY  47 -13.440   6.755  -5.760
  360    H    SER  48           HN       SER  48 -11.232   8.502  -5.306
  361    HA   SER  48           HA       SER  48 -10.975   9.667  -7.841
  362    HB2  SER  48           HB2      SER  48  -9.476  10.223  -5.282
  363    HB3  SER  48           HB1      SER  48  -9.573  11.301  -6.673
  364    HG   SER  48           HG       SER  48 -11.946  11.069  -6.322
  365    H    VAL  49           HN       VAL  49  -8.646   7.898  -5.782
  366    HA   VAL  49           HA       VAL  49  -6.568   8.308  -7.686
  367    HB   VAL  49           HB       VAL  49  -5.139   6.844  -6.301
  368   HG11  VAL  49          HG11      VAL  49  -5.258   9.212  -5.816
  369   HG12  VAL  49          HG12      VAL  49  -5.099   8.302  -4.315
  370   HG13  VAL  49          HG13      VAL  49  -6.666   8.955  -4.788
  371   HG21  VAL  49          HG21      VAL  49  -5.968   6.014  -4.133
  372   HG22  VAL  49          HG22      VAL  49  -6.839   5.276  -5.482
  373   HG23  VAL  49          HG23      VAL  49  -7.586   6.577  -4.558
  374    H    ASN  50           HN       ASN  50  -8.854   5.751  -7.217
  375    HA   ASN  50           HA       ASN  50  -7.395   4.043  -9.070
  376    HB2  ASN  50           HB2      ASN  50 -10.147   3.680  -7.860
  377    HB3  ASN  50           HB1      ASN  50  -9.339   2.511  -8.885
  378   HD21  ASN  50          HD21      ASN  50  -6.675   2.837  -7.605
  379   HD22  ASN  50          HD22      ASN  50  -6.881   2.114  -6.053
  380    H    GLY  51           HN       GLY  51 -10.031   6.312  -9.111
  381    HA2  GLY  51           HA2      GLY  51 -10.655   7.495 -11.031
  382    HA3  GLY  51           HA1      GLY  51  -9.981   6.215 -12.025
  383    H    GLY  52           HN       GLY  52 -12.542   6.647  -9.604
  384    HA2  GLY  52           HA2      GLY  52 -14.851   6.350  -9.988
  385    HA3  GLY  52           HA1      GLY  52 -14.474   5.549 -11.506
  386    H    ASN  53           HN       ASN  53 -12.438   4.079  -9.669
  387    HA   ASN  53           HA       ASN  53 -14.333   1.989  -8.807
  388    HB2  ASN  53           HB2      ASN  53 -11.464   1.762  -9.741
  389    HB3  ASN  53           HB1      ASN  53 -12.322   0.458  -8.939
  390   HD21  ASN  53          HD21      ASN  53 -11.144   0.601 -11.584
  391   HD22  ASN  53          HD22      ASN  53 -12.427   0.242 -12.682
  392    H    ARG  54           HN       ARG  54 -13.697   0.826  -6.897
  393    HA   ARG  54           HA       ARG  54 -11.724   2.202  -5.293
  394    HB2  ARG  54           HB2      ARG  54 -14.380   1.143  -4.268
  395    HB3  ARG  54           HB1      ARG  54 -13.097   1.777  -3.244
  396    HG2  ARG  54           HG2      ARG  54 -13.285   3.942  -4.415
  397    HG3  ARG  54           HG1      ARG  54 -14.628   3.297  -5.342
  398    HD2  ARG  54           HD2      ARG  54 -15.823   2.923  -3.162
  399    HD3  ARG  54           HD1      ARG  54 -14.490   3.783  -2.377
  400    HE   ARG  54           HE       ARG  54 -15.648   5.177  -4.597
  401   HH11  ARG  54          HH11      ARG  54 -16.039   4.681  -1.087
  402   HH12  ARG  54          HH12      ARG  54 -16.691   6.260  -0.864
  403   HH21  ARG  54          HH21      ARG  54 -16.583   7.279  -4.192
  404   HH22  ARG  54          HH22      ARG  54 -17.043   7.689  -2.611
  405    H    THR  55           HN       THR  55 -10.270   0.807  -5.939
  406    HA   THR  55           HA       THR  55 -10.583  -2.045  -5.621
  407    HB   THR  55           HB       THR  55  -8.202  -0.341  -6.419
  408    HG1  THR  55           HG1      THR  55 -10.149  -1.653  -8.046
  409   HG21  THR  55          HG21      THR  55  -7.618  -2.612  -5.743
  410   HG22  THR  55          HG22      THR  55  -7.397  -2.401  -7.480
  411   HG23  THR  55          HG23      THR  55  -8.812  -3.269  -6.864
  412    H    VAL  56           HN       VAL  56  -9.733  -3.128  -3.829
  413    HA   VAL  56           HA       VAL  56  -9.278  -1.464  -1.623
  414    HB   VAL  56           HB       VAL  56  -8.665  -4.396  -1.577
  415   HG11  VAL  56          HG11      VAL  56  -7.689  -2.970   0.207
  416   HG12  VAL  56          HG12      VAL  56  -8.899  -4.100   0.850
  417   HG13  VAL  56          HG13      VAL  56  -9.304  -2.400   0.587
  418   HG21  VAL  56          HG21      VAL  56 -11.025  -2.841  -0.807
  419   HG22  VAL  56          HG22      VAL  56 -10.798  -4.604  -0.602
  420   HG23  VAL  56          HG23      VAL  56 -10.942  -3.879  -2.247
  421    HA   PRO  57           HA       PRO  57  -5.399  -2.847  -0.987
  422    HB2  PRO  57           HB2      PRO  57  -3.564  -4.397  -2.317
  423    HB3  PRO  57           HB1      PRO  57  -4.837  -4.975  -1.241
  424    HG2  PRO  57           HG2      PRO  57  -4.802  -4.896  -4.217
  425    HG3  PRO  57           HG1      PRO  57  -5.610  -6.046  -3.142
  426    HD2  PRO  57           HD2      PRO  57  -6.760  -3.838  -4.437
  427    HD3  PRO  57           HD1      PRO  57  -7.480  -4.872  -3.183
  428    H    THR  58           HN       THR  58  -5.561  -0.712  -2.199
  429    HA   THR  58           HA       THR  58  -3.694   0.027  -4.239
  430    HB   THR  58           HB       THR  58  -5.909   1.331  -2.685
  431    HG1  THR  58           HG1      THR  58  -7.062   0.427  -4.179
  432   HG21  THR  58          HG21      THR  58  -4.291   2.500  -4.977
  433   HG22  THR  58          HG22      THR  58  -4.270   3.076  -3.307
  434   HG23  THR  58          HG23      THR  58  -5.733   3.237  -4.285
  435    H    VAL  59           HN       VAL  59  -1.783   0.878  -3.640
  436    HA   VAL  59           HA       VAL  59  -1.457   1.681  -0.845
  437    HB   VAL  59           HB       VAL  59  -0.133  -0.324  -1.307
  438   HG11  VAL  59          HG11      VAL  59   1.681  -0.282  -2.977
  439   HG12  VAL  59          HG12      VAL  59   0.952   1.233  -3.591
  440   HG13  VAL  59          HG13      VAL  59   0.040  -0.256  -3.637
  441   HG21  VAL  59          HG21      VAL  59   0.887   1.326   0.198
  442   HG22  VAL  59          HG22      VAL  59   1.653   2.112  -1.181
  443   HG23  VAL  59          HG23      VAL  59   2.117   0.471  -0.735
  444    H    LYS  60           HN       LYS  60  -0.809   3.661  -0.462
  445    HA   LYS  60           HA       LYS  60   0.279   5.198  -2.698
  446    HB2  LYS  60           HB2      LYS  60  -1.959   6.009  -1.787
  447    HB3  LYS  60           HB1      LYS  60  -1.134   6.338  -0.272
  448    HG2  LYS  60           HG2      LYS  60   0.237   8.008  -1.271
  449    HG3  LYS  60           HG1      LYS  60  -0.268   7.543  -2.885
  450    HD2  LYS  60           HD2      LYS  60  -1.472   9.484  -2.493
  451    HD3  LYS  60           HD1      LYS  60  -2.632   8.217  -2.134
  452    HE2  LYS  60           HE2      LYS  60  -1.037   9.806  -0.113
  453    HE3  LYS  60           HE1      LYS  60  -2.720  10.073  -0.526
  454    HZ1  LYS  60           HZ1      LYS  60  -1.544   7.739   0.840
  455    HZ2  LYS  60           HZ2      LYS  60  -3.183   7.816   0.332
  456    HZ3  LYS  60           HZ3      LYS  60  -2.583   8.903   1.481
  457    H    PHE  61           HN       PHE  61   2.236   5.887  -2.442
  458    HA   PHE  61           HA       PHE  61   3.658   5.117  -0.013
  459    HB2  PHE  61           HB2      PHE  61   4.616   6.122  -2.696
  460    HB3  PHE  61           HB1      PHE  61   5.689   5.812  -1.341
  461    HD1  PHE  61           HD2      PHE  61   3.030   4.100  -3.319
  462    HD2  PHE  61           HD1      PHE  61   6.725   3.762  -1.243
  463    HE1  PHE  61           HE2      PHE  61   3.201   1.761  -3.997
  464    HE2  PHE  61           HE1      PHE  61   6.897   1.433  -1.930
  465    HZ   PHE  61           HZ       PHE  61   5.132   0.412  -3.314
  466    H    ALA  62           HN       ALA  62   5.405   6.652   0.702
  467    HA   ALA  62           HA       ALA  62   4.393   9.176   1.461
  468    HB1  ALA  62           HB1      ALA  62   6.107   7.982   2.759
  469    HB2  ALA  62           HB2      ALA  62   6.665   9.599   2.321
  470    HB3  ALA  62           HB3      ALA  62   7.257   8.190   1.440
  471    H    ASP  63           HN       ASP  63   5.624   8.063  -1.359
  472    HA   ASP  63           HA       ASP  63   6.837  10.419  -2.478
  473    HB2  ASP  63           HB2      ASP  63   7.546   8.253  -3.260
  474    HB3  ASP  63           HB1      ASP  63   5.897   7.784  -3.627
  475    H    GLY  64           HN       GLY  64   3.612   9.266  -2.008
  476    HA2  GLY  64           HA2      GLY  64   1.702  10.561  -2.371
  477    HA3  GLY  64           HA1      GLY  64   2.571  11.477  -3.591
  478    H    SER  65           HN       SER  65   3.501   8.819  -4.752
  479    HA   SER  65           HA       SER  65   1.377   8.595  -6.631
  480    HB2  SER  65           HB2      SER  65   3.749   8.401  -7.277
  481    HB3  SER  65           HB1      SER  65   3.882   6.928  -6.322
  482    HG   SER  65           HG       SER  65   2.345   7.380  -8.657
  483    H    THR  66           HN       THR  66   0.131   6.741  -7.097
  484    HA   THR  66           HA       THR  66  -0.311   4.961  -4.827
  485    HB   THR  66           HB       THR  66  -2.614   4.779  -5.927
  486    HG1  THR  66           HG1      THR  66  -2.666   7.212  -6.986
  487   HG21  THR  66          HG21      THR  66  -1.781   7.449  -4.786
  488   HG22  THR  66          HG22      THR  66  -2.250   6.027  -3.852
  489   HG23  THR  66          HG23      THR  66  -3.435   6.842  -4.870
  490    H    LEU  67           HN       LEU  67  -0.298   2.804  -5.274
  491    HA   LEU  67           HA       LEU  67  -0.209   2.013  -8.105
  492    HB2  LEU  67           HB2      LEU  67   1.097   0.529  -5.806
  493    HB3  LEU  67           HB1      LEU  67   1.085   0.026  -7.475
  494    HG   LEU  67           HG       LEU  67   2.595   2.355  -6.288
  495   HD11  LEU  67          HD11      LEU  67   3.572   0.110  -5.918
  496   HD12  LEU  67          HD12      LEU  67   4.562   1.117  -6.975
  497   HD13  LEU  67          HD13      LEU  67   3.553  -0.150  -7.660
  498   HD21  LEU  67          HD21      LEU  67   3.540   2.660  -8.547
  499   HD22  LEU  67          HD22      LEU  67   1.834   3.053  -8.464
  500   HD23  LEU  67          HD23      LEU  67   2.351   1.522  -9.182
  501    H    THR  68           HN       THR  68  -2.012   1.161  -8.661
  502    HA   THR  68           HA       THR  68  -3.780  -0.034  -6.724
  503    HB   THR  68           HB       THR  68  -4.093   0.319  -9.722
  504    HG1  THR  68           HG1      THR  68  -3.903   2.349  -8.936
  505   HG21  THR  68          HG21      THR  68  -6.507   0.180  -9.236
  506   HG22  THR  68          HG22      THR  68  -6.142  -0.067  -7.528
  507   HG23  THR  68          HG23      THR  68  -5.666  -1.284  -8.715
  508    H    ASN  69           HN       ASN  69  -3.453  -2.110  -6.225
  509    HA   ASN  69           HA       ASN  69  -2.886  -4.290  -6.251
  510    HB2  ASN  69           HB2      ASN  69  -3.751  -4.115  -9.146
  511    HB3  ASN  69           HB1      ASN  69  -3.290  -5.620  -8.378
  512   HD21  ASN  69          HD21      ASN  69  -5.756  -4.852  -9.596
  513   HD22  ASN  69          HD22      ASN  69  -6.985  -5.016  -8.412
  514    HA   PRO  70           HA       PRO  70   1.283  -3.706  -8.207
  515    HB2  PRO  70           HB2      PRO  70   2.754  -3.141  -6.098
  516    HB3  PRO  70           HB1      PRO  70   1.724  -1.883  -6.794
  517    HG2  PRO  70           HG2      PRO  70   1.175  -3.675  -4.448
  518    HG3  PRO  70           HG1      PRO  70   1.024  -1.902  -4.532
  519    HD2  PRO  70           HD2      PRO  70  -1.103  -3.588  -4.869
  520    HD3  PRO  70           HD1      PRO  70  -0.973  -2.025  -5.699
  521    H    SER  71           HN       SER  71   3.228  -4.981  -7.738
  522    HA   SER  71           HA       SER  71   2.652  -7.559  -6.505
  523    HB2  SER  71           HB2      SER  71   5.203  -6.673  -7.861
  524    HB3  SER  71           HB1      SER  71   4.567  -8.303  -7.685
  525    HG   SER  71           HG       SER  71   3.498  -6.218  -9.272
  526    H    ALA  72           HN       ALA  72   4.165  -8.368  -4.833
  527    HA   ALA  72           HA       ALA  72   4.702  -6.444  -2.825
  528    HB1  ALA  72           HB1      ALA  72   5.699  -8.296  -1.575
  529    HB2  ALA  72           HB2      ALA  72   5.714  -9.283  -3.035
  530    HB3  ALA  72           HB3      ALA  72   4.178  -8.794  -2.318
  531    H    ASP  73           HN       ASP  73   6.659  -8.031  -5.192
  532    HA   ASP  73           HA       ASP  73   9.230  -7.312  -4.370
  533    HB2  ASP  73           HB2      ASP  73   8.881  -8.969  -6.097
  534    HB3  ASP  73           HB1      ASP  73   8.131  -7.769  -7.144
  535    H    GLU  74           HN       GLU  74   6.975  -5.650  -6.512
  536    HA   GLU  74           HA       GLU  74   8.543  -3.438  -7.241
  537    HB2  GLU  74           HB2      GLU  74   5.555  -3.559  -6.824
  538    HB3  GLU  74           HB1      GLU  74   6.408  -2.281  -7.666
  539    HG2  GLU  74           HG2      GLU  74   7.095  -3.865  -9.370
  540    HG3  GLU  74           HG1      GLU  74   6.252  -5.158  -8.523
  541    H    VAL  75           HN       VAL  75   6.191  -3.875  -4.669
  542    HA   VAL  75           HA       VAL  75   6.313  -1.310  -3.581
  543    HB   VAL  75           HB       VAL  75   5.650  -3.907  -2.157
  544   HG11  VAL  75          HG11      VAL  75   6.148  -2.123  -0.578
  545   HG12  VAL  75          HG12      VAL  75   4.426  -2.506  -0.567
  546   HG13  VAL  75          HG13      VAL  75   5.005  -1.059  -1.397
  547   HG21  VAL  75          HG21      VAL  75   3.860  -1.894  -3.517
  548   HG22  VAL  75          HG22      VAL  75   3.316  -3.297  -2.599
  549   HG23  VAL  75          HG23      VAL  75   4.228  -3.518  -4.091
  550    H    LYS  76           HN       LYS  76   8.121  -4.216  -2.738
  551    HA   LYS  76           HA       LYS  76   9.487  -3.035  -0.577
  552    HB2  LYS  76           HB2      LYS  76   9.149  -5.492  -0.957
  553    HB3  LYS  76           HB1      LYS  76  10.332  -5.412  -2.232
  554    HG2  LYS  76           HG2      LYS  76  12.086  -4.912  -0.693
  555    HG3  LYS  76           HG1      LYS  76  10.936  -4.693   0.633
  556    HD2  LYS  76           HD2      LYS  76  10.285  -7.053   0.429
  557    HD3  LYS  76           HD1      LYS  76  11.447  -7.255  -0.877
  558    HE2  LYS  76           HE2      LYS  76  12.312  -8.112   1.226
  559    HE3  LYS  76           HE1      LYS  76  13.272  -6.758   0.656
  560    HZ1  LYS  76           HZ1      LYS  76  12.887  -6.620   3.021
  561    HZ2  LYS  76           HZ2      LYS  76  11.236  -6.649   2.866
  562    HZ3  LYS  76           HZ3      LYS  76  12.137  -5.329   2.280
  563    H    ALA  77           HN       ALA  77  10.261  -3.292  -4.016
  564    HA   ALA  77           HA       ALA  77  12.940  -2.286  -3.719
  565    HB1  ALA  77           HB1      ALA  77  12.319  -3.729  -5.622
  566    HB2  ALA  77           HB2      ALA  77  12.960  -2.180  -6.169
  567    HB3  ALA  77           HB3      ALA  77  11.224  -2.475  -6.201
  568    H    LYS  78           HN       LYS  78   9.817  -0.896  -4.355
  569    HA   LYS  78           HA       LYS  78  10.856   1.719  -4.887
  570    HB2  LYS  78           HB2      LYS  78   8.083   0.746  -4.200
  571    HB3  LYS  78           HB1      LYS  78   8.455   2.440  -4.530
  572    HG2  LYS  78           HG2      LYS  78   8.898   0.171  -6.458
  573    HG3  LYS  78           HG1      LYS  78   7.452   1.177  -6.424
  574    HD2  LYS  78           HD2      LYS  78   8.813   3.153  -6.876
  575    HD3  LYS  78           HD1      LYS  78  10.270   2.161  -6.887
  576    HE2  LYS  78           HE2      LYS  78   9.463   0.925  -8.804
  577    HE3  LYS  78           HE1      LYS  78   7.933   1.797  -8.757
  578    HZ1  LYS  78           HZ1      LYS  78  10.602   2.995  -9.324
  579    HZ2  LYS  78           HZ2      LYS  78   9.135   3.834  -9.258
  580    HZ3  LYS  78           HZ3      LYS  78   9.388   2.694 -10.447
  581    H    LEU  79           HN       LEU  79   9.640   0.002  -2.056
  582    HA   LEU  79           HA       LEU  79   9.488   2.101  -0.271
  583    HB2  LEU  79           HB2      LEU  79   8.762  -0.316   0.193
  584    HB3  LEU  79           HB1      LEU  79  10.450  -0.683   0.369
  585    HG   LEU  79           HG       LEU  79  10.513   0.987   2.258
  586   HD11  LEU  79          HD11      LEU  79   8.455   2.240   1.929
  587   HD12  LEU  79          HD12      LEU  79   8.371   1.355   3.440
  588   HD13  LEU  79          HD13      LEU  79   7.528   0.747   2.027
  589   HD21  LEU  79          HD21      LEU  79  10.631  -1.361   2.662
  590   HD22  LEU  79          HD22      LEU  79   8.896  -1.529   2.458
  591   HD23  LEU  79          HD23      LEU  79   9.539  -0.652   3.855
  592    H    VAL  80           HN       VAL  80  12.184  -0.073  -0.975
  593    HA   VAL  80           HA       VAL  80  13.956   1.040   0.864
  594    HB   VAL  80           HB       VAL  80  15.772  -0.137  -0.315
  595   HG11  VAL  80          HG11      VAL  80  14.448  -1.373   1.249
  596   HG12  VAL  80          HG12      VAL  80  14.923  -2.397  -0.106
  597   HG13  VAL  80          HG13      VAL  80  13.280  -1.758  -0.015
  598   HG21  VAL  80          HG21      VAL  80  13.677  -0.682  -2.366
  599   HG22  VAL  80          HG22      VAL  80  15.228  -1.532  -2.284
  600   HG23  VAL  80          HG23      VAL  80  15.182   0.207  -2.607
  601    H    LYS  81           HN       LYS  81  13.245   2.060  -2.408
  602    HA   LYS  81           HA       LYS  81  15.469   3.866  -2.318
  603    HB2  LYS  81           HB2      LYS  81  14.785   4.719  -4.499
  604    HB3  LYS  81           HB1      LYS  81  14.854   2.965  -4.505
  605    HG2  LYS  81           HG2      LYS  81  12.520   2.777  -4.473
  606    HG3  LYS  81           HG1      LYS  81  12.308   4.498  -4.168
  607    HD2  LYS  81           HD2      LYS  81  13.511   3.304  -6.673
  608    HD3  LYS  81           HD1      LYS  81  11.856   3.899  -6.530
  609    HE2  LYS  81           HE2      LYS  81  12.799   6.153  -5.942
  610    HE3  LYS  81           HE1      LYS  81  14.402   5.512  -6.277
  611    HZ1  LYS  81           HZ1      LYS  81  13.543   6.701  -8.161
  612    HZ2  LYS  81           HZ2      LYS  81  12.178   5.730  -8.218
  613    HZ3  LYS  81           HZ3      LYS  81  13.703   5.062  -8.548
  614    H    ILE  82           HN       ILE  82  11.951   4.161  -1.865
  615    HA   ILE  82           HA       ILE  82  12.199   6.999  -1.712
  616    HB   ILE  82           HB       ILE  82   9.807   7.122  -1.109
  617   HG12  ILE  82          HG12      ILE  82   8.440   4.941  -1.421
  618   HG13  ILE  82          HG11      ILE  82   9.944   4.098  -1.089
  619   HG21  ILE  82          HG21      ILE  82  10.391   5.377  -3.475
  620   HG22  ILE  82          HG22      ILE  82  10.439   7.138  -3.410
  621   HG23  ILE  82          HG23      ILE  82   8.903   6.290  -3.220
  622   HD11  ILE  82          HD11      ILE  82   8.509   5.981   0.781
  623   HD12  ILE  82          HD12      ILE  82  10.021   5.140   1.129
  624   HD13  ILE  82          HD13      ILE  82   8.536   4.220   0.890
  625    H    ALA  83           HN       ALA  83  12.409   4.501   0.580
  626    HA   ALA  83           HA       ALA  83  12.238   6.374   2.793
  627    HB1  ALA  83           HB1      ALA  83  12.652   4.419   4.211
  628    HB2  ALA  83           HB2      ALA  83  12.939   3.435   2.778
  629    HB3  ALA  83           HB3      ALA  83  11.335   4.105   3.078
  630    H    GLY  84           HN       GLY  84  14.604   4.699   0.860
  631    HA2  GLY  84           HA2      GLY  84  16.861   4.984   0.673
  632    HA3  GLY  84           HA1      GLY  84  16.712   6.400   1.710
  633    H    LEU  85           HN       LEU  85  15.608   3.219   2.619
  634    HA   LEU  85           HA       LEU  85  17.854   2.787   4.393
  635    HB2  LEU  85           HB2      LEU  85  16.116   4.230   5.583
  636    HB3  LEU  85           HB1      LEU  85  14.995   2.906   5.388
  637    HG   LEU  85           HG       LEU  85  16.554   1.482   6.743
  638   HD11  LEU  85          HD11      LEU  85  18.231   2.604   8.111
  639   HD12  LEU  85          HD12      LEU  85  17.920   4.116   7.259
  640   HD13  LEU  85          HD13      LEU  85  18.603   2.737   6.395
  641   HD21  LEU  85          HD21      LEU  85  14.574   2.491   7.733
  642   HD22  LEU  85          HD22      LEU  85  15.474   3.973   8.061
  643   HD23  LEU  85          HD23      LEU  85  15.904   2.476   8.887
  644    H    GLU  86           HN       GLU  86  17.819   0.544   5.124
  645    HA   GLU  86           HA       GLU  86  17.634  -1.682   4.800
  646    HB2  GLU  86           HB2      GLU  86  14.802  -0.984   3.955
  647    HB3  GLU  86           HB1      GLU  86  15.372  -2.626   4.215
  648    HG2  GLU  86           HG2      GLU  86  15.296  -0.460   6.305
  649    HG3  GLU  86           HG1      GLU  86  14.110  -1.751   6.130
  650    H    HIS  87           HN       HIS  87  18.441   0.153   2.778
  651    HA   HIS  87           HA       HIS  87  17.619  -0.950   0.210
  652    HB2  HIS  87           HB2      HIS  87  17.870   1.561   0.738
  653    HB3  HIS  87           HB1      HIS  87  19.594   1.265   0.759
  654    HD1  HIS  87           HD1      HIS  87  16.907   2.173  -1.484
  655    HD2  HIS  87           HD2      HIS  87  20.584   0.284  -1.799
  656    HE1  HIS  87           HE1      HIS  87  17.489   2.197  -3.933
  657    H    HIS  88           HN       HIS  88  20.319  -0.839   2.409
  658    HA   HIS  88           HA       HIS  88  21.726  -2.787   0.800
  659    HB2  HIS  88           HB2      HIS  88  22.611  -0.498   0.215
  660    HB3  HIS  88           HB1      HIS  88  23.041  -0.293   1.908
  661    HD1  HIS  88           HD1      HIS  88  23.952  -2.423  -1.092
  662    HD2  HIS  88           HD2      HIS  88  25.461  -1.314   2.615
  663    HE1  HIS  88           HE1      HIS  88  26.356  -3.200  -1.048
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1   8.912   6.788  15.358
    2    H2   MET   1           HT2      MET   1   8.586   6.058  16.827
    3    H3   MET   1           HT3      MET   1   8.099   7.648  16.560
    4    HA   MET   1           HA       MET   1   6.249   6.110  16.410
    5    HB2  MET   1           HB2      MET   1   7.102   7.246  13.719
    6    HB3  MET   1           HB1      MET   1   5.483   6.677  14.099
    7    HG2  MET   1           HG2      MET   1   6.863   8.967  15.489
    8    HG3  MET   1           HG1      MET   1   5.717   9.140  14.161
    9    HE1  MET   1           HE1      MET   1   3.449   7.092  14.704
   10    HE2  MET   1           HE2      MET   1   3.135   8.788  14.363
   11    HE3  MET   1           HE3      MET   1   2.361   8.007  15.744
   12    H    VAL   2           HN       VAL   2   5.312   4.640  14.400
   13    HA   VAL   2           HA       VAL   2   6.927   2.296  14.508
   14    HB   VAL   2           HB       VAL   2   5.177   1.222  13.082
   15   HG11  VAL   2          HG11      VAL   2   4.987   1.172  15.489
   16   HG12  VAL   2          HG12      VAL   2   3.393   1.336  14.754
   17   HG13  VAL   2          HG13      VAL   2   4.177   2.738  15.477
   18   HG21  VAL   2          HG21      VAL   2   3.833   3.925  13.239
   19   HG22  VAL   2          HG22      VAL   2   3.110   2.451  12.597
   20   HG23  VAL   2          HG23      VAL   2   4.496   3.179  11.786
   21    H    THR   3           HN       THR   3   6.923   4.896  12.388
   22    HA   THR   3           HA       THR   3   8.121   5.398  10.545
   23    HB   THR   3           HB       THR   3   9.495   2.684  10.778
   24    HG1  THR   3           HG1      THR   3   9.572   4.888  12.482
   25   HG21  THR   3          HG21      THR   3  11.426   3.918   9.849
   26   HG22  THR   3          HG22      THR   3  10.459   5.393   9.809
   27   HG23  THR   3          HG23      THR   3  10.031   4.030   8.776
   28    H    ALA   4           HN       ALA   4   5.613   4.463  10.191
   29    HA   ALA   4           HA       ALA   4   5.583   2.382   8.189
   30    HB1  ALA   4           HB1      ALA   4   3.158   2.744   8.111
   31    HB2  ALA   4           HB2      ALA   4   3.329   4.158   9.151
   32    HB3  ALA   4           HB3      ALA   4   3.708   2.553   9.776
   33    H    ALA   5           HN       ALA   5   6.729   3.097   6.515
   34    HA   ALA   5           HA       ALA   5   6.237   5.696   5.339
   35    HB1  ALA   5           HB1      ALA   5   8.086   5.130   3.841
   36    HB2  ALA   5           HB2      ALA   5   8.122   3.492   4.493
   37    HB3  ALA   5           HB3      ALA   5   8.531   4.861   5.527
   38    H    LEU   6           HN       LEU   6   4.654   2.890   5.222
   39    HA   LEU   6           HA       LEU   6   3.823   3.308   2.453
   40    HB2  LEU   6           HB2      LEU   6   5.261   1.198   2.956
   41    HB3  LEU   6           HB1      LEU   6   3.825   0.634   3.802
   42    HG   LEU   6           HG       LEU   6   2.572   0.892   1.697
   43   HD11  LEU   6          HD11      LEU   6   5.338   1.404   0.642
   44   HD12  LEU   6          HD12      LEU   6   3.952   2.505   0.590
   45   HD13  LEU   6          HD13      LEU   6   3.938   1.019  -0.349
   46   HD21  LEU   6          HD21      LEU   6   3.499  -1.124   0.684
   47   HD22  LEU   6          HD22      LEU   6   3.440  -1.276   2.439
   48   HD23  LEU   6          HD23      LEU   6   4.969  -0.925   1.628
   49    H    THR   7           HN       THR   7   1.634   3.423   2.270
   50    HA   THR   7           HA       THR   7   0.051   2.708   4.621
   51    HB   THR   7           HB       THR   7  -0.359   4.998   2.679
   52    HG1  THR   7           HG1      THR   7   0.426   4.834   5.400
   53   HG21  THR   7          HG21      THR   7  -1.855   4.254   5.196
   54   HG22  THR   7          HG22      THR   7  -2.475   4.114   3.551
   55   HG23  THR   7          HG23      THR   7  -2.128   5.702   4.231
   56    H    ILE   8           HN       ILE   8  -1.409   1.181   4.191
   57    HA   ILE   8           HA       ILE   8  -2.043   0.629   1.378
   58    HB   ILE   8           HB       ILE   8  -1.901  -1.289   3.719
   59   HG12  ILE   8          HG12      ILE   8  -0.274  -1.110   1.179
   60   HG13  ILE   8          HG11      ILE   8   0.275  -0.676   2.793
   61   HG21  ILE   8          HG21      ILE   8  -2.466  -3.080   2.141
   62   HG22  ILE   8          HG22      ILE   8  -2.733  -1.888   0.867
   63   HG23  ILE   8          HG23      ILE   8  -3.765  -1.899   2.303
   64   HD11  ILE   8          HD11      ILE   8   0.008  -3.012   3.481
   65   HD12  ILE   8          HD12      ILE   8   1.138  -2.816   2.143
   66   HD13  ILE   8          HD13      ILE   8  -0.490  -3.423   1.838
   67    H    TYR   9           HN       TYR   9  -4.094   0.643   0.792
   68    HA   TYR   9           HA       TYR   9  -6.034   1.261   2.814
   69    HB2  TYR   9           HB2      TYR   9  -6.190   1.237  -0.195
   70    HB3  TYR   9           HB1      TYR   9  -7.561   1.620   0.843
   71    HD1  TYR   9           HD1      TYR   9  -7.558   3.657   2.186
   72    HD2  TYR   9           HD2      TYR   9  -4.381   2.841  -0.508
   73    HE1  TYR   9           HE1      TYR   9  -6.833   5.996   2.342
   74    HE2  TYR   9           HE2      TYR   9  -3.639   5.180  -0.352
   75    HH   TYR   9           HH       TYR   9  -4.635   7.375   0.207
   76    H    THR  10           HN       THR  10  -7.509  -0.087   3.603
   77    HA   THR  10           HA       THR  10  -7.871  -2.641   2.290
   78    HB   THR  10           HB       THR  10  -7.932  -3.612   4.655
   79    HG1  THR  10           HG1      THR  10  -7.045  -2.491   6.244
   80   HG21  THR  10          HG21      THR  10  -6.136  -4.121   3.071
   81   HG22  THR  10          HG22      THR  10  -5.499  -3.965   4.709
   82   HG23  THR  10          HG23      THR  10  -5.287  -2.652   3.551
   83    H    THR  11           HN       THR  11  -9.814  -3.793   3.242
   84    HA   THR  11           HA       THR  11 -11.809  -2.098   4.465
   85    HB   THR  11           HB       THR  11 -12.442  -3.604   1.896
   86    HG1  THR  11           HG1      THR  11 -11.169  -1.201   2.226
   87   HG21  THR  11          HG21      THR  11 -14.405  -2.173   1.888
   88   HG22  THR  11          HG22      THR  11 -13.804  -1.320   3.296
   89   HG23  THR  11          HG23      THR  11 -14.280  -3.018   3.437
   90    H    SER  12           HN       SER  12 -13.203  -3.471   5.699
   91    HA   SER  12           HA       SER  12 -12.455  -6.043   6.347
   92    HB2  SER  12           HB2      SER  12 -15.245  -4.865   6.461
   93    HB3  SER  12           HB1      SER  12 -14.684  -6.271   7.371
   94    HG   SER  12           HG       SER  12 -14.109  -3.559   7.689
   95    H    TRP  13           HN       TRP  13 -14.890  -5.049   3.925
   96    HA   TRP  13           HA       TRP  13 -14.998  -7.792   3.095
   97    HB2  TRP  13           HB2      TRP  13 -16.773  -7.159   1.536
   98    HB3  TRP  13           HB1      TRP  13 -17.140  -6.588   3.152
   99    HD1  TRP  13           HD1      TRP  13 -16.614  -5.489  -0.376
  100    HE1  TRP  13           HE1      TRP  13 -17.081  -3.027  -0.615
  101    HE3  TRP  13           HE3      TRP  13 -17.018  -4.269   4.568
  102    HZ2  TRP  13           HZ2      TRP  13 -17.602  -0.788   1.052
  103    HZ3  TRP  13           HZ3      TRP  13 -17.517  -1.922   5.155
  104    HH2  TRP  13           HH2      TRP  13 -17.804  -0.229   3.433
  105    H    CYS  14           HN       CYS  14 -13.057  -8.276   2.430
  106    HA   CYS  14           HA       CYS  14 -12.385  -7.564  -0.225
  107    HB2  CYS  14           HB2      CYS  14 -11.425  -5.629   0.933
  108    HB3  CYS  14           HB1      CYS  14 -10.585  -6.695   2.049
  109    H    GLY  15           HN       GLY  15 -10.740  -8.951  -0.993
  110    HA2  GLY  15           HA2      GLY  15  -9.865 -11.068   0.849
  111    HA3  GLY  15           HA1      GLY  15 -10.598 -11.490  -0.696
  112    H    TYR  16           HN       TYR  16  -9.493  -9.561  -2.336
  113    HA   TYR  16           HA       TYR  16  -7.076 -10.793  -3.030
  114    HB2  TYR  16           HB2      TYR  16  -8.649  -9.702  -4.622
  115    HB3  TYR  16           HB1      TYR  16  -8.184  -8.136  -3.980
  116    HD1  TYR  16           HD2      TYR  16  -6.612 -11.170  -5.475
  117    HD2  TYR  16           HD1      TYR  16  -6.573  -6.939  -5.158
  118    HE1  TYR  16           HE2      TYR  16  -4.804 -11.075  -7.124
  119    HE2  TYR  16           HE1      TYR  16  -4.750  -6.830  -6.816
  120    HH   TYR  16           HH       TYR  16  -3.770  -9.658  -8.590
  121    H    CYS  17           HN       CYS  17  -7.766  -7.906  -1.161
  122    HA   CYS  17           HA       CYS  17  -5.232  -6.761  -1.285
  123    HB2  CYS  17           HB2      CYS  17  -5.926  -5.578   0.873
  124    HB3  CYS  17           HB1      CYS  17  -7.016  -5.361  -0.489
  125    H    LEU  18           HN       LEU  18  -6.636  -9.245   0.744
  126    HA   LEU  18           HA       LEU  18  -4.898  -9.195   2.924
  127    HB2  LEU  18           HB2      LEU  18  -6.511 -11.457   1.816
  128    HB3  LEU  18           HB1      LEU  18  -5.750 -11.437   3.393
  129    HG   LEU  18           HG       LEU  18  -7.949  -9.581   2.472
  130   HD11  LEU  18          HD11      LEU  18  -7.873 -11.801   4.442
  131   HD12  LEU  18          HD12      LEU  18  -8.673 -11.832   2.861
  132   HD13  LEU  18          HD13      LEU  18  -9.267 -10.754   4.146
  133   HD21  LEU  18          HD21      LEU  18  -6.464  -8.428   4.026
  134   HD22  LEU  18          HD22      LEU  18  -6.552  -9.792   5.142
  135   HD23  LEU  18          HD23      LEU  18  -7.990  -8.828   4.818
  136    H    ARG  19           HN       ARG  19  -4.807 -11.006  -0.080
  137    HA   ARG  19           HA       ARG  19  -2.661 -12.717   0.473
  138    HB2  ARG  19           HB2      ARG  19  -4.101 -13.055  -1.438
  139    HB3  ARG  19           HB1      ARG  19  -3.606 -11.524  -2.130
  140    HG2  ARG  19           HG2      ARG  19  -2.568 -13.369  -3.339
  141    HG3  ARG  19           HG1      ARG  19  -1.345 -12.442  -2.486
  142    HD2  ARG  19           HD2      ARG  19  -2.550 -14.913  -1.306
  143    HD3  ARG  19           HD1      ARG  19  -1.236 -15.014  -2.471
  144    HE   ARG  19           HE       ARG  19  -0.614 -13.222  -0.375
  145   HH11  ARG  19          HH11      ARG  19  -0.814 -16.698  -1.101
  146   HH12  ARG  19          HH12      ARG  19   0.375 -17.116   0.041
  147   HH21  ARG  19          HH21      ARG  19   1.029 -13.880   1.201
  148   HH22  ARG  19          HH22      ARG  19   1.382 -15.519   1.349
  149    H    LEU  20           HN       LEU  20  -2.701  -9.483  -0.930
  150    HA   LEU  20           HA       LEU  20   0.103  -9.444  -1.308
  151    HB2  LEU  20           HB2      LEU  20  -1.271  -8.131  -2.780
  152    HB3  LEU  20           HB1      LEU  20  -2.001  -7.289  -1.439
  153    HG   LEU  20           HG       LEU  20   0.330  -6.294  -1.025
  154   HD11  LEU  20          HD11      LEU  20   1.662  -5.994  -3.093
  155   HD12  LEU  20          HD12      LEU  20   0.808  -7.346  -3.812
  156   HD13  LEU  20          HD13      LEU  20   1.819  -7.573  -2.372
  157   HD21  LEU  20          HD21      LEU  20  -1.233  -5.566  -3.476
  158   HD22  LEU  20          HD22      LEU  20  -0.054  -4.522  -2.665
  159   HD23  LEU  20          HD23      LEU  20  -1.531  -5.002  -1.831
  160    H    LYS  21           HN       LYS  21  -2.127  -8.224   1.103
  161    HA   LYS  21           HA       LYS  21  -0.392  -6.508   2.479
  162    HB2  LYS  21           HB2      LYS  21  -2.993  -6.868   2.624
  163    HB3  LYS  21           HB1      LYS  21  -2.562  -7.989   3.908
  164    HG2  LYS  21           HG2      LYS  21  -1.374  -6.166   5.060
  165    HG3  LYS  21           HG1      LYS  21  -1.891  -5.058   3.789
  166    HD2  LYS  21           HD2      LYS  21  -3.427  -4.735   5.545
  167    HD3  LYS  21           HD1      LYS  21  -4.267  -5.759   4.378
  168    HE2  LYS  21           HE2      LYS  21  -4.696  -6.623   6.560
  169    HE3  LYS  21           HE1      LYS  21  -3.596  -7.736   5.751
  170    HZ1  LYS  21           HZ1      LYS  21  -2.876  -7.351   8.011
  171    HZ2  LYS  21           HZ2      LYS  21  -2.896  -5.685   7.774
  172    HZ3  LYS  21           HZ3      LYS  21  -1.737  -6.613   6.994
  173    H    THR  22           HN       THR  22  -1.172  -9.956   2.999
  174    HA   THR  22           HA       THR  22   0.567 -10.146   5.230
  175    HB   THR  22           HB       THR  22  -1.324 -11.737   4.966
  176    HG1  THR  22           HG1      THR  22   0.844 -12.298   5.988
  177   HG21  THR  22          HG21      THR  22  -1.181 -13.605   3.378
  178   HG22  THR  22          HG22      THR  22   0.288 -12.905   2.694
  179   HG23  THR  22          HG23      THR  22  -1.247 -12.053   2.537
  180    H    ALA  23           HN       ALA  23   1.029 -10.388   1.804
  181    HA   ALA  23           HA       ALA  23   3.575 -11.702   1.821
  182    HB1  ALA  23           HB1      ALA  23   2.416  -9.805  -0.219
  183    HB2  ALA  23           HB2      ALA  23   2.159 -11.551  -0.208
  184    HB3  ALA  23           HB3      ALA  23   3.778 -10.897  -0.470
  185    H    LEU  24           HN       LEU  24   2.586  -8.341   1.897
  186    HA   LEU  24           HA       LEU  24   5.249  -7.366   1.879
  187    HB2  LEU  24           HB2      LEU  24   2.706  -6.069   2.818
  188    HB3  LEU  24           HB1      LEU  24   4.225  -5.217   2.588
  189    HG   LEU  24           HG       LEU  24   2.636  -6.613   0.468
  190   HD11  LEU  24          HD11      LEU  24   3.019  -3.677   1.006
  191   HD12  LEU  24          HD12      LEU  24   1.534  -4.614   1.211
  192   HD13  LEU  24          HD13      LEU  24   2.196  -4.358  -0.400
  193   HD21  LEU  24          HD21      LEU  24   4.156  -5.561  -1.132
  194   HD22  LEU  24          HD22      LEU  24   5.008  -6.660  -0.046
  195   HD23  LEU  24          HD23      LEU  24   5.098  -4.914   0.207
  196    H    THR  25           HN       THR  25   3.032  -8.275   4.425
  197    HA   THR  25           HA       THR  25   4.603  -7.353   6.579
  198    HB   THR  25           HB       THR  25   2.696  -9.719   6.567
  199    HG1  THR  25           HG1      THR  25   1.561  -7.938   5.816
  200   HG21  THR  25          HG21      THR  25   2.377  -9.140   8.946
  201   HG22  THR  25          HG22      THR  25   3.559  -7.844   8.792
  202   HG23  THR  25          HG23      THR  25   4.064  -9.525   8.614
  203    H    ALA  26           HN       ALA  26   4.430 -10.482   4.882
  204    HA   ALA  26           HA       ALA  26   6.467 -11.785   6.344
  205    HB1  ALA  26           HB1      ALA  26   5.557 -12.278   3.505
  206    HB2  ALA  26           HB2      ALA  26   4.838 -12.989   4.948
  207    HB3  ALA  26           HB3      ALA  26   6.497 -13.390   4.499
  208    H    ASN  27           HN       ASN  27   6.493  -9.665   3.606
  209    HA   ASN  27           HA       ASN  27   9.298  -9.996   3.113
  210    HB2  ASN  27           HB2      ASN  27   7.124  -8.391   1.996
  211    HB3  ASN  27           HB1      ASN  27   8.760  -7.740   1.707
  212   HD21  ASN  27          HD21      ASN  27   7.604 -11.079   1.832
  213   HD22  ASN  27          HD22      ASN  27   7.978 -11.480   0.191
  214    H    ARG  28           HN       ARG  28   7.698  -8.605   5.544
  215    HA   ARG  28           HA       ARG  28   8.323  -7.451   7.342
  216    HB2  ARG  28           HB2      ARG  28  11.088  -7.346   6.106
  217    HB3  ARG  28           HB1      ARG  28  10.693  -7.011   7.786
  218    HG2  ARG  28           HG2      ARG  28  10.445  -9.671   6.375
  219    HG3  ARG  28           HG1      ARG  28  11.628  -9.241   7.611
  220    HD2  ARG  28           HD2      ARG  28   9.798  -8.937   9.224
  221    HD3  ARG  28           HD1      ARG  28   8.634  -9.388   7.987
  222    HE   ARG  28           HE       ARG  28  10.447 -11.462   8.151
  223   HH11  ARG  28          HH11      ARG  28   8.117  -9.932  10.373
  224   HH12  ARG  28          HH12      ARG  28   7.849 -11.364  11.250
  225   HH21  ARG  28          HH21      ARG  28  10.052 -13.369   9.360
  226   HH22  ARG  28          HH22      ARG  28   8.946 -13.360  10.667
  227    H    ILE  29           HN       ILE  29   7.288  -6.185   5.016
  228    HA   ILE  29           HA       ILE  29   8.469  -3.557   4.993
  229    HB   ILE  29           HB       ILE  29   6.106  -4.737   3.444
  230   HG12  ILE  29          HG12      ILE  29   8.922  -3.967   2.617
  231   HG13  ILE  29          HG11      ILE  29   8.346  -5.603   2.881
  232   HG21  ILE  29          HG21      ILE  29   7.363  -1.998   3.224
  233   HG22  ILE  29          HG22      ILE  29   5.730  -2.360   3.781
  234   HG23  ILE  29          HG23      ILE  29   6.183  -2.689   2.110
  235   HD11  ILE  29          HD11      ILE  29   8.486  -4.991   0.521
  236   HD12  ILE  29          HD12      ILE  29   7.270  -3.732   0.784
  237   HD13  ILE  29          HD13      ILE  29   6.862  -5.434   1.026
  238    H    ALA  30           HN       ALA  30   7.859  -1.986   6.315
  239    HA   ALA  30           HA       ALA  30   5.631  -2.340   8.107
  240    HB1  ALA  30           HB1      ALA  30   7.722  -1.395   8.951
  241    HB2  ALA  30           HB2      ALA  30   6.392  -0.250   9.116
  242    HB3  ALA  30           HB3      ALA  30   7.568  -0.052   7.820
  243    H    TYR  31           HN       TYR  31   3.667  -1.747   7.603
  244    HA   TYR  31           HA       TYR  31   3.252   0.671   6.024
  245    HB2  TYR  31           HB2      TYR  31   1.464  -0.452   4.759
  246    HB3  TYR  31           HB1      TYR  31   3.008  -1.247   4.490
  247    HD1  TYR  31           HD2      TYR  31  -0.278  -1.552   6.172
  248    HD2  TYR  31           HD1      TYR  31   3.347  -3.530   5.141
  249    HE1  TYR  31           HE2      TYR  31  -1.274  -3.692   6.826
  250    HE2  TYR  31           HE1      TYR  31   2.352  -5.679   5.781
  251    HH   TYR  31           HH       TYR  31   0.615  -6.555   7.111
  252    H    ASP  32           HN       ASP  32   1.066   1.515   6.369
  253    HA   ASP  32           HA       ASP  32  -0.231   0.376   8.731
  254    HB2  ASP  32           HB2      ASP  32  -1.020   2.563   9.393
  255    HB3  ASP  32           HB1      ASP  32   0.704   2.697   9.123
  256    H    GLU  33           HN       GLU  33  -2.410   0.034   8.585
  257    HA   GLU  33           HA       GLU  33  -3.428   0.167   5.846
  258    HB2  GLU  33           HB2      GLU  33  -5.042  -1.656   6.672
  259    HB3  GLU  33           HB1      GLU  33  -3.358  -2.104   6.469
  260    HG2  GLU  33           HG2      GLU  33  -3.079  -1.710   8.940
  261    HG3  GLU  33           HG1      GLU  33  -4.833  -1.578   9.034
  262    H    VAL  34           HN       VAL  34  -5.415   1.038   5.395
  263    HA   VAL  34           HA       VAL  34  -6.096   3.062   7.379
  264    HB   VAL  34           HB       VAL  34  -6.942   3.104   4.479
  265   HG11  VAL  34          HG11      VAL  34  -7.250   5.487   4.814
  266   HG12  VAL  34          HG12      VAL  34  -6.883   5.291   6.531
  267   HG13  VAL  34          HG13      VAL  34  -8.305   4.505   5.828
  268   HG21  VAL  34          HG21      VAL  34  -4.512   3.059   4.645
  269   HG22  VAL  34          HG22      VAL  34  -4.563   4.397   5.791
  270   HG23  VAL  34          HG23      VAL  34  -5.087   4.640   4.124
  271    H    ASP  35           HN       ASP  35  -7.841   3.482   8.203
  272    HA   ASP  35           HA       ASP  35  -9.971   1.827   8.718
  273    HB2  ASP  35           HB2      ASP  35  -9.625   4.763   9.207
  274    HB3  ASP  35           HB1      ASP  35 -10.941   3.792   9.861
  275    H    ILE  36           HN       ILE  36  -9.777   3.028   5.747
  276    HA   ILE  36           HA       ILE  36 -11.536   5.078   5.229
  277    HB   ILE  36           HB       ILE  36 -11.884   4.262   2.937
  278   HG12  ILE  36          HG12      ILE  36 -10.162   1.937   3.703
  279   HG13  ILE  36          HG11      ILE  36 -11.921   1.811   3.617
  280   HG21  ILE  36          HG21      ILE  36  -9.573   4.356   2.245
  281   HG22  ILE  36          HG22      ILE  36  -9.057   4.063   3.908
  282   HG23  ILE  36          HG23      ILE  36  -9.921   5.548   3.498
  283   HD11  ILE  36          HD11      ILE  36 -10.069   2.503   1.323
  284   HD12  ILE  36          HD12      ILE  36 -11.823   2.400   1.218
  285   HD13  ILE  36          HD13      ILE  36 -10.885   0.960   1.568
  286    H    GLU  37           HN       GLU  37 -12.709   1.814   5.828
  287    HA   GLU  37           HA       GLU  37 -15.241   2.351   4.665
  288    HB2  GLU  37           HB2      GLU  37 -16.001   0.331   5.821
  289    HB3  GLU  37           HB1      GLU  37 -14.465   0.123   4.984
  290    HG2  GLU  37           HG2      GLU  37 -13.282   0.354   7.119
  291    HG3  GLU  37           HG1      GLU  37 -14.839   0.469   7.942
  292    H    HIS  38           HN       HIS  38 -13.790   3.132   7.669
  293    HA   HIS  38           HA       HIS  38 -16.322   4.213   8.729
  294    HB2  HIS  38           HB2      HIS  38 -13.746   3.587  10.207
  295    HB3  HIS  38           HB1      HIS  38 -15.229   4.185  10.933
  296    HD1  HIS  38           HD1      HIS  38 -13.415   1.139  10.504
  297    HD2  HIS  38           HD2      HIS  38 -17.432   2.196  10.476
  298    HE1  HIS  38           HE1      HIS  38 -14.697  -0.988  10.877
  299    H    ASN  39           HN       ASN  39 -13.963   5.143   6.853
  300    HA   ASN  39           HA       ASN  39 -13.917   7.840   7.916
  301    HB2  ASN  39           HB2      ASN  39 -11.846   6.821   8.822
  302    HB3  ASN  39           HB1      ASN  39 -11.350   6.397   7.190
  303   HD21  ASN  39          HD21      ASN  39 -10.478   7.959   5.894
  304   HD22  ASN  39          HD22      ASN  39 -10.052   9.539   6.475
  305    H    ARG  40           HN       ARG  40 -15.153   8.495   6.330
  306    HA   ARG  40           HA       ARG  40 -14.986   7.617   3.668
  307    HB2  ARG  40           HB2      ARG  40 -16.658   9.306   3.156
  308    HB3  ARG  40           HB1      ARG  40 -17.069   8.373   4.588
  309    HG2  ARG  40           HG2      ARG  40 -16.417  10.189   6.020
  310    HG3  ARG  40           HG1      ARG  40 -15.836  11.114   4.635
  311    HD2  ARG  40           HD2      ARG  40 -18.671  10.232   5.108
  312    HD3  ARG  40           HD1      ARG  40 -18.030  11.863   5.364
  313    HE   ARG  40           HE       ARG  40 -17.423  11.293   2.760
  314   HH11  ARG  40          HH11      ARG  40 -20.452  11.294   4.591
  315   HH12  ARG  40          HH12      ARG  40 -21.395  11.802   3.270
  316   HH21  ARG  40          HH21      ARG  40 -18.672  11.881   0.980
  317   HH22  ARG  40          HH22      ARG  40 -20.357  12.101   1.110
  318    H    ALA  41           HN       ALA  41 -13.480  10.331   5.272
  319    HA   ALA  41           HA       ALA  41 -12.989  11.965   3.059
  320    HB1  ALA  41           HB1      ALA  41 -11.211  12.979   4.384
  321    HB2  ALA  41           HB2      ALA  41 -11.248  11.603   5.493
  322    HB3  ALA  41           HB3      ALA  41 -12.648  12.670   5.359
  323    H    ALA  42           HN       ALA  42 -11.237   9.219   4.264
  324    HA   ALA  42           HA       ALA  42  -9.238   9.488   2.180
  325    HB1  ALA  42           HB1      ALA  42  -8.486   8.727   4.351
  326    HB2  ALA  42           HB2      ALA  42  -8.232   7.448   3.157
  327    HB3  ALA  42           HB3      ALA  42  -9.589   7.360   4.287
  328    H    ALA  43           HN       ALA  43 -12.153   7.680   2.832
  329    HA   ALA  43           HA       ALA  43 -11.806   5.608   0.935
  330    HB1  ALA  43           HB1      ALA  43 -13.496   5.564   2.770
  331    HB2  ALA  43           HB2      ALA  43 -14.153   5.171   1.184
  332    HB3  ALA  43           HB3      ALA  43 -14.422   6.771   1.872
  333    H    GLU  44           HN       GLU  44 -13.368   8.768   0.715
  334    HA   GLU  44           HA       GLU  44 -14.166   8.431  -1.967
  335    HB2  GLU  44           HB2      GLU  44 -13.840  10.942  -0.291
  336    HB3  GLU  44           HB1      GLU  44 -14.583  10.916  -1.888
  337    HG2  GLU  44           HG2      GLU  44 -16.350   9.454  -1.102
  338    HG3  GLU  44           HG1      GLU  44 -15.573   9.303   0.464
  339    H    PHE  45           HN       PHE  45 -11.233   9.496  -0.464
  340    HA   PHE  45           HA       PHE  45  -9.950  10.561  -2.765
  341    HB2  PHE  45           HB2      PHE  45  -9.038  11.094  -0.590
  342    HB3  PHE  45           HB1      PHE  45  -8.857   9.393  -0.192
  343    HD1  PHE  45           HD1      PHE  45  -7.597  12.036  -2.475
  344    HD2  PHE  45           HD2      PHE  45  -6.861   8.276  -0.630
  345    HE1  PHE  45           HE1      PHE  45  -5.286  12.072  -3.312
  346    HE2  PHE  45           HE2      PHE  45  -4.550   8.312  -1.461
  347    HZ   PHE  45           HZ       PHE  45  -3.758  10.214  -2.803
  348    H    VAL  46           HN       VAL  46 -10.078   7.366  -1.320
  349    HA   VAL  46           HA       VAL  46  -8.317   5.923  -2.882
  350    HB   VAL  46           HB       VAL  46 -10.995   5.055  -1.747
  351   HG11  VAL  46          HG11      VAL  46  -8.759   3.368  -2.822
  352   HG12  VAL  46          HG12      VAL  46 -10.358   3.536  -3.525
  353   HG13  VAL  46          HG13      VAL  46 -10.166   2.748  -1.950
  354   HG21  VAL  46          HG21      VAL  46  -9.388   5.783  -0.085
  355   HG22  VAL  46          HG22      VAL  46  -8.186   4.677  -0.751
  356   HG23  VAL  46          HG23      VAL  46  -9.647   4.042   0.005
  357    H    GLY  47           HN       GLY  47 -11.728   6.524  -3.486
  358    HA2  GLY  47           HA2      GLY  47 -11.860   5.154  -5.945
  359    HA3  GLY  47           HA1      GLY  47 -12.994   6.380  -5.403
  360    H    SER  48           HN       SER  48 -10.905   8.400  -5.140
  361    HA   SER  48           HA       SER  48 -11.135   9.501  -7.712
  362    HB2  SER  48           HB2      SER  48 -11.006  10.832  -5.604
  363    HB3  SER  48           HB1      SER  48  -9.317  10.365  -5.447
  364    HG   SER  48           HG       SER  48  -8.834  11.888  -6.714
  365    H    VAL  49           HN       VAL  49  -8.564   7.668  -6.126
  366    HA   VAL  49           HA       VAL  49  -6.798   8.177  -8.393
  367    HB   VAL  49           HB       VAL  49  -5.009   7.051  -7.121
  368   HG11  VAL  49          HG11      VAL  49  -5.282   9.446  -6.892
  369   HG12  VAL  49          HG12      VAL  49  -4.750   8.749  -5.361
  370   HG13  VAL  49          HG13      VAL  49  -6.436   9.214  -5.582
  371   HG21  VAL  49          HG21      VAL  49  -6.351   5.467  -5.822
  372   HG22  VAL  49          HG22      VAL  49  -7.070   6.802  -4.921
  373   HG23  VAL  49          HG23      VAL  49  -5.347   6.453  -4.756
  374    H    ASN  50           HN       ASN  50  -9.024   5.896  -7.491
  375    HA   ASN  50           HA       ASN  50  -7.719   3.752  -9.006
  376    HB2  ASN  50           HB2      ASN  50 -10.364   3.749  -7.544
  377    HB3  ASN  50           HB1      ASN  50  -9.712   2.386  -8.421
  378   HD21  ASN  50          HD21      ASN  50  -6.923   2.883  -7.379
  379   HD22  ASN  50          HD22      ASN  50  -7.023   2.358  -5.746
  380    H    GLY  51           HN       GLY  51 -10.762   5.596  -8.999
  381    HA2  GLY  51           HA2      GLY  51 -11.313   6.450 -11.287
  382    HA3  GLY  51           HA1      GLY  51 -11.228   4.757 -11.765
  383    H    GLY  52           HN       GLY  52 -13.323   4.313 -12.208
  384    HA2  GLY  52           HA2      GLY  52 -15.450   5.198 -10.459
  385    HA3  GLY  52           HA1      GLY  52 -15.622   4.187 -11.890
  386    H    ASN  53           HN       ASN  53 -13.419   2.490 -10.767
  387    HA   ASN  53           HA       ASN  53 -15.125   0.801  -9.067
  388    HB2  ASN  53           HB2      ASN  53 -14.214  -0.234 -11.111
  389    HB3  ASN  53           HB1      ASN  53 -12.585   0.174 -10.592
  390   HD21  ASN  53          HD21      ASN  53 -11.841  -1.899 -10.503
  391   HD22  ASN  53          HD22      ASN  53 -12.408  -3.076  -9.375
  392    H    ARG  54           HN       ARG  54 -14.732   1.071  -6.924
  393    HA   ARG  54           HA       ARG  54 -12.256   2.144  -5.953
  394    HB2  ARG  54           HB2      ARG  54 -14.349   2.475  -4.651
  395    HB3  ARG  54           HB1      ARG  54 -14.439   0.735  -4.363
  396    HG2  ARG  54           HG2      ARG  54 -12.310   0.895  -3.141
  397    HG3  ARG  54           HG1      ARG  54 -12.343   2.641  -3.405
  398    HD2  ARG  54           HD2      ARG  54 -14.439   1.057  -1.930
  399    HD3  ARG  54           HD1      ARG  54 -13.185   2.046  -1.184
  400    HE   ARG  54           HE       ARG  54 -14.463   3.774  -2.840
  401   HH11  ARG  54          HH11      ARG  54 -15.601   1.632  -0.243
  402   HH12  ARG  54          HH12      ARG  54 -16.924   2.656   0.140
  403   HH21  ARG  54          HH21      ARG  54 -16.290   5.110  -2.272
  404   HH22  ARG  54          HH22      ARG  54 -17.308   4.639  -0.992
  405    H    THR  55           HN       THR  55 -10.452   1.070  -5.849
  406    HA   THR  55           HA       THR  55 -10.499  -1.845  -5.870
  407    HB   THR  55           HB       THR  55  -8.268   0.123  -6.415
  408    HG1  THR  55           HG1      THR  55 -10.269  -0.069  -7.848
  409   HG21  THR  55          HG21      THR  55  -7.477  -2.073  -5.762
  410   HG22  THR  55          HG22      THR  55  -7.205  -1.835  -7.489
  411   HG23  THR  55          HG23      THR  55  -8.560  -2.835  -6.927
  412    H    VAL  56           HN       VAL  56  -9.628  -2.944  -4.086
  413    HA   VAL  56           HA       VAL  56  -9.326  -1.284  -1.806
  414    HB   VAL  56           HB       VAL  56  -8.756  -4.226  -1.763
  415   HG11  VAL  56          HG11      VAL  56  -9.058  -3.941   0.652
  416   HG12  VAL  56          HG12      VAL  56  -9.493  -2.252   0.382
  417   HG13  VAL  56          HG13      VAL  56  -7.858  -2.762   0.073
  418   HG21  VAL  56          HG21      VAL  56 -10.934  -4.437  -0.928
  419   HG22  VAL  56          HG22      VAL  56 -10.978  -3.642  -2.547
  420   HG23  VAL  56          HG23      VAL  56 -11.134  -2.680  -1.045
  421    HA   PRO  57           HA       PRO  57  -5.465  -2.782  -1.187
  422    HB2  PRO  57           HB2      PRO  57  -3.615  -4.240  -2.592
  423    HB3  PRO  57           HB1      PRO  57  -4.890  -4.891  -1.559
  424    HG2  PRO  57           HG2      PRO  57  -4.877  -4.551  -4.525
  425    HG3  PRO  57           HG1      PRO  57  -5.568  -5.865  -3.555
  426    HD2  PRO  57           HD2      PRO  57  -6.984  -3.730  -4.617
  427    HD3  PRO  57           HD1      PRO  57  -7.483  -4.822  -3.295
  428    H    THR  58           HN       THR  58  -5.545  -0.578  -2.120
  429    HA   THR  58           HA       THR  58  -3.790   0.314  -4.204
  430    HB   THR  58           HB       THR  58  -5.734   1.574  -2.315
  431    HG1  THR  58           HG1      THR  58  -7.151   0.761  -3.711
  432   HG21  THR  58          HG21      THR  58  -5.694   3.547  -3.827
  433   HG22  THR  58          HG22      THR  58  -4.455   2.760  -4.794
  434   HG23  THR  58          HG23      THR  58  -4.097   3.248  -3.128
  435    H    VAL  59           HN       VAL  59  -1.778   0.838  -3.596
  436    HA   VAL  59           HA       VAL  59  -1.293   1.279  -0.751
  437    HB   VAL  59           HB       VAL  59  -0.066  -0.642  -1.793
  438   HG11  VAL  59          HG11      VAL  59   0.161   0.073  -3.983
  439   HG12  VAL  59          HG12      VAL  59   1.775  -0.216  -3.302
  440   HG13  VAL  59          HG13      VAL  59   1.130   1.443  -3.468
  441   HG21  VAL  59          HG21      VAL  59   1.722   1.608  -0.897
  442   HG22  VAL  59          HG22      VAL  59   2.143  -0.099  -0.918
  443   HG23  VAL  59          HG23      VAL  59   0.900   0.482   0.167
  444    H    LYS  60           HN       LYS  60  -0.381   3.092  -0.062
  445    HA   LYS  60           HA       LYS  60   0.280   5.147  -2.030
  446    HB2  LYS  60           HB2      LYS  60  -1.732   5.747  -0.806
  447    HB3  LYS  60           HB1      LYS  60  -0.944   5.405   0.730
  448    HG2  LYS  60           HG2      LYS  60   0.499   7.333   0.389
  449    HG3  LYS  60           HG1      LYS  60  -0.219   7.604  -1.196
  450    HD2  LYS  60           HD2      LYS  60  -2.415   7.939  -0.171
  451    HD3  LYS  60           HD1      LYS  60  -1.720   7.645   1.420
  452    HE2  LYS  60           HE2      LYS  60  -0.833   9.835  -0.422
  453    HE3  LYS  60           HE1      LYS  60  -2.074  10.049   0.813
  454    HZ1  LYS  60           HZ1      LYS  60   0.156  10.766   1.561
  455    HZ2  LYS  60           HZ2      LYS  60   0.740   9.199   1.401
  456    HZ3  LYS  60           HZ3      LYS  60  -0.452   9.528   2.508
  457    H    PHE  61           HN       PHE  61   2.293   5.611  -2.051
  458    HA   PHE  61           HA       PHE  61   4.056   4.749   0.054
  459    HB2  PHE  61           HB2      PHE  61   4.547   5.994  -2.657
  460    HB3  PHE  61           HB1      PHE  61   5.846   5.631  -1.523
  461    HD1  PHE  61           HD1      PHE  61   3.181   4.104  -3.627
  462    HD2  PHE  61           HD2      PHE  61   6.629   3.423  -1.211
  463    HE1  PHE  61           HE1      PHE  61   3.271   1.732  -4.385
  464    HE2  PHE  61           HE2      PHE  61   6.704   1.126  -1.962
  465    HZ   PHE  61           HZ       PHE  61   5.032   0.271  -3.569
  466    H    ALA  62           HN       ALA  62   5.703   6.214   0.848
  467    HA   ALA  62           HA       ALA  62   4.677   8.168   2.429
  468    HB1  ALA  62           HB1      ALA  62   6.944   8.779   2.972
  469    HB2  ALA  62           HB2      ALA  62   7.529   8.006   1.499
  470    HB3  ALA  62           HB3      ALA  62   6.812   7.032   2.781
  471    H    ASP  63           HN       ASP  63   5.888   8.700  -0.850
  472    HA   ASP  63           HA       ASP  63   5.902  11.577  -0.401
  473    HB2  ASP  63           HB2      ASP  63   7.074  11.807  -2.406
  474    HB3  ASP  63           HB1      ASP  63   7.636  10.251  -1.812
  475    H    GLY  64           HN       GLY  64   3.593   9.328  -1.212
  476    HA2  GLY  64           HA2      GLY  64   1.350  10.134  -1.562
  477    HA3  GLY  64           HA1      GLY  64   2.017  11.422  -2.551
  478    H    SER  65           HN       SER  65   3.656   8.685  -3.426
  479    HA   SER  65           HA       SER  65   2.206   8.393  -5.877
  480    HB2  SER  65           HB2      SER  65   4.340   6.578  -4.705
  481    HB3  SER  65           HB1      SER  65   3.818   6.629  -6.385
  482    HG   SER  65           HG       SER  65   5.247   8.567  -4.907
  483    H    THR  66           HN       THR  66   0.426   7.095  -6.222
  484    HA   THR  66           HA       THR  66  -0.075   4.998  -4.231
  485    HB   THR  66           HB       THR  66  -2.464   5.206  -4.946
  486    HG1  THR  66           HG1      THR  66  -1.932   6.126  -6.978
  487   HG21  THR  66          HG21      THR  66  -2.918   7.349  -3.810
  488   HG22  THR  66          HG22      THR  66  -1.215   7.787  -3.955
  489   HG23  THR  66          HG23      THR  66  -1.693   6.419  -2.949
  490    H    LEU  67           HN       LEU  67  -0.389   2.978  -4.973
  491    HA   LEU  67           HA       LEU  67  -0.443   2.568  -7.870
  492    HB2  LEU  67           HB2      LEU  67   1.243   1.208  -5.804
  493    HB3  LEU  67           HB1      LEU  67   0.664   0.261  -7.150
  494    HG   LEU  67           HG       LEU  67   1.818   1.765  -8.710
  495   HD11  LEU  67          HD11      LEU  67   2.922   3.223  -6.317
  496   HD12  LEU  67          HD12      LEU  67   1.848   3.835  -7.557
  497   HD13  LEU  67          HD13      LEU  67   3.484   3.363  -7.981
  498   HD21  LEU  67          HD21      LEU  67   3.595   0.564  -6.592
  499   HD22  LEU  67          HD22      LEU  67   4.115   1.066  -8.198
  500   HD23  LEU  67          HD23      LEU  67   2.944  -0.234  -8.023
  501    H    THR  68           HN       THR  68  -2.206   1.696  -8.515
  502    HA   THR  68           HA       THR  68  -4.036   0.420  -6.684
  503    HB   THR  68           HB       THR  68  -4.243   1.099  -9.628
  504    HG1  THR  68           HG1      THR  68  -4.379   3.049  -8.845
  505   HG21  THR  68          HG21      THR  68  -6.678   0.887  -9.296
  506   HG22  THR  68          HG22      THR  68  -6.398   0.382  -7.628
  507   HG23  THR  68          HG23      THR  68  -5.843  -0.630  -8.964
  508    H    ASN  69           HN       ASN  69  -3.757  -1.695  -6.338
  509    HA   ASN  69           HA       ASN  69  -3.268  -3.863  -6.511
  510    HB2  ASN  69           HB2      ASN  69  -4.187  -3.447  -9.353
  511    HB3  ASN  69           HB1      ASN  69  -3.647  -5.014  -8.767
  512   HD21  ASN  69          HD21      ASN  69  -6.185  -4.309  -9.815
  513   HD22  ASN  69          HD22      ASN  69  -7.351  -4.635  -8.583
  514    HA   PRO  70           HA       PRO  70   0.916  -3.388  -8.342
  515    HB2  PRO  70           HB2      PRO  70   2.380  -3.073  -6.168
  516    HB3  PRO  70           HB1      PRO  70   1.445  -1.711  -6.798
  517    HG2  PRO  70           HG2      PRO  70   0.754  -3.596  -4.571
  518    HG3  PRO  70           HG1      PRO  70   0.684  -1.823  -4.577
  519    HD2  PRO  70           HD2      PRO  70  -1.520  -3.377  -5.041
  520    HD3  PRO  70           HD1      PRO  70  -1.268  -1.772  -5.754
  521    H    SER  71           HN       SER  71   2.938  -4.684  -7.508
  522    HA   SER  71           HA       SER  71   2.101  -7.311  -6.501
  523    HB2  SER  71           HB2      SER  71   4.351  -6.600  -8.390
  524    HB3  SER  71           HB1      SER  71   3.966  -8.229  -7.821
  525    HG   SER  71           HG       SER  71   2.128  -6.573  -9.196
  526    H    ALA  72           HN       ALA  72   3.614  -8.362  -5.072
  527    HA   ALA  72           HA       ALA  72   4.468  -6.750  -3.005
  528    HB1  ALA  72           HB1      ALA  72   5.379  -9.560  -3.569
  529    HB2  ALA  72           HB2      ALA  72   3.874  -9.114  -2.768
  530    HB3  ALA  72           HB3      ALA  72   5.424  -8.738  -2.011
  531    H    ASP  73           HN       ASP  73   6.527  -8.297  -5.463
  532    HA   ASP  73           HA       ASP  73   8.907  -7.296  -4.249
  533    HB2  ASP  73           HB2      ASP  73   8.549  -8.512  -6.997
  534    HB3  ASP  73           HB1      ASP  73  10.100  -8.071  -6.303
  535    H    GLU  74           HN       GLU  74   6.732  -6.037  -6.566
  536    HA   GLU  74           HA       GLU  74   8.464  -3.970  -7.478
  537    HB2  GLU  74           HB2      GLU  74   5.498  -4.320  -7.532
  538    HB3  GLU  74           HB1      GLU  74   6.226  -2.796  -7.969
  539    HG2  GLU  74           HG2      GLU  74   6.940  -5.393  -9.295
  540    HG3  GLU  74           HG1      GLU  74   5.779  -4.238  -9.946
  541    H    VAL  75           HN       VAL  75   5.970  -4.207  -5.002
  542    HA   VAL  75           HA       VAL  75   6.093  -1.578  -4.173
  543    HB   VAL  75           HB       VAL  75   5.372  -4.032  -2.532
  544   HG11  VAL  75          HG11      VAL  75   5.938  -2.166  -1.045
  545   HG12  VAL  75          HG12      VAL  75   4.212  -2.512  -0.999
  546   HG13  VAL  75          HG13      VAL  75   4.807  -1.127  -1.913
  547   HG21  VAL  75          HG21      VAL  75   3.058  -3.360  -2.993
  548   HG22  VAL  75          HG22      VAL  75   3.958  -3.694  -4.471
  549   HG23  VAL  75          HG23      VAL  75   3.655  -2.028  -3.985
  550    H    LYS  76           HN       LYS  76   7.824  -4.415  -3.094
  551    HA   LYS  76           HA       LYS  76   9.328  -3.308  -1.010
  552    HB2  LYS  76           HB2      LYS  76   8.965  -5.718  -1.478
  553    HB3  LYS  76           HB1      LYS  76   9.989  -5.537  -2.891
  554    HG2  LYS  76           HG2      LYS  76  11.940  -5.232  -1.542
  555    HG3  LYS  76           HG1      LYS  76  10.964  -5.081  -0.073
  556    HD2  LYS  76           HD2      LYS  76  11.982  -7.325  -0.260
  557    HD3  LYS  76           HD1      LYS  76  10.220  -7.393  -0.296
  558    HE2  LYS  76           HE2      LYS  76  10.448  -7.395  -2.855
  559    HE3  LYS  76           HE1      LYS  76  12.158  -7.691  -2.561
  560    HZ1  LYS  76           HZ1      LYS  76  11.655  -9.759  -1.549
  561    HZ2  LYS  76           HZ2      LYS  76  10.697  -9.684  -2.970
  562    HZ3  LYS  76           HZ3      LYS  76  10.010  -9.384  -1.466
  563    H    ALA  77           HN       ALA  77  10.084  -3.682  -4.477
  564    HA   ALA  77           HA       ALA  77  12.663  -2.519  -4.322
  565    HB1  ALA  77           HB1      ALA  77  12.583  -2.445  -6.759
  566    HB2  ALA  77           HB2      ALA  77  10.848  -2.769  -6.717
  567    HB3  ALA  77           HB3      ALA  77  11.985  -3.994  -6.159
  568    H    LYS  78           HN       LYS  78   9.515  -1.162  -4.496
  569    HA   LYS  78           HA       LYS  78  10.466   1.462  -5.253
  570    HB2  LYS  78           HB2      LYS  78   7.786   0.544  -4.220
  571    HB3  LYS  78           HB1      LYS  78   8.126   2.194  -4.765
  572    HG2  LYS  78           HG2      LYS  78   8.235  -0.309  -6.423
  573    HG3  LYS  78           HG1      LYS  78   6.890   0.821  -6.380
  574    HD2  LYS  78           HD2      LYS  78   8.254   2.558  -7.297
  575    HD3  LYS  78           HD1      LYS  78   9.696   1.535  -7.220
  576    HE2  LYS  78           HE2      LYS  78   7.224   0.925  -8.836
  577    HE3  LYS  78           HE1      LYS  78   8.697   1.633  -9.489
  578    HZ1  LYS  78           HZ1      LYS  78   8.672  -1.003  -8.098
  579    HZ2  LYS  78           HZ2      LYS  78   9.898  -0.364  -9.071
  580    HZ3  LYS  78           HZ3      LYS  78   8.462  -0.854  -9.744
  581    H    LEU  79           HN       LEU  79   9.454  -0.258  -2.347
  582    HA   LEU  79           HA       LEU  79   9.457   1.798  -0.508
  583    HB2  LEU  79           HB2      LEU  79   8.781  -0.632  -0.035
  584    HB3  LEU  79           HB1      LEU  79  10.482  -0.994  -0.009
  585    HG   LEU  79           HG       LEU  79  10.676   0.677   1.888
  586   HD11  LEU  79          HD11      LEU  79   8.661   0.957   3.267
  587   HD12  LEU  79          HD12      LEU  79   7.686   0.340   1.941
  588   HD13  LEU  79          HD13      LEU  79   8.566   1.852   1.764
  589   HD21  LEU  79          HD21      LEU  79  10.907  -1.696   2.221
  590   HD22  LEU  79          HD22      LEU  79   9.157  -1.888   2.247
  591   HD23  LEU  79          HD23      LEU  79   9.963  -1.007   3.547
  592    H    VAL  80           HN       VAL  80  12.086  -0.323  -1.512
  593    HA   VAL  80           HA       VAL  80  14.028   0.743   0.183
  594    HB   VAL  80           HB       VAL  80  15.706  -0.385  -1.162
  595   HG11  VAL  80          HG11      VAL  80  13.222  -2.061  -0.876
  596   HG12  VAL  80          HG12      VAL  80  14.449  -1.781   0.362
  597   HG13  VAL  80          HG13      VAL  80  14.847  -2.692  -1.092
  598   HG21  VAL  80          HG21      VAL  80  13.515  -0.775  -3.174
  599   HG22  VAL  80          HG22      VAL  80  15.063  -1.632  -3.220
  600   HG23  VAL  80          HG23      VAL  80  15.015   0.122  -3.399
  601    H    LYS  81           HN       LYS  81  12.983   1.826  -2.972
  602    HA   LYS  81           HA       LYS  81  15.214   3.618  -3.144
  603    HB2  LYS  81           HB2      LYS  81  14.363   4.338  -5.300
  604    HB3  LYS  81           HB1      LYS  81  14.378   2.593  -5.211
  605    HG2  LYS  81           HG2      LYS  81  12.292   2.738  -6.070
  606    HG3  LYS  81           HG1      LYS  81  11.843   3.144  -4.420
  607    HD2  LYS  81           HD2      LYS  81  10.853   4.761  -5.924
  608    HD3  LYS  81           HD1      LYS  81  12.123   5.554  -4.992
  609    HE2  LYS  81           HE2      LYS  81  13.666   5.332  -6.880
  610    HE3  LYS  81           HE1      LYS  81  12.432   4.472  -7.790
  611    HZ1  LYS  81           HZ1      LYS  81  12.204   7.289  -6.870
  612    HZ2  LYS  81           HZ2      LYS  81  11.101   6.472  -7.831
  613    HZ3  LYS  81           HZ3      LYS  81  12.627   6.820  -8.428
  614    H    ILE  82           HN       ILE  82  11.872   3.832  -2.140
  615    HA   ILE  82           HA       ILE  82  12.052   6.700  -2.051
  616    HB   ILE  82           HB       ILE  82   9.761   6.747  -1.154
  617   HG12  ILE  82          HG12      ILE  82   8.432   4.515  -1.238
  618   HG13  ILE  82          HG11      ILE  82   9.995   3.731  -1.107
  619   HG21  ILE  82          HG21      ILE  82   8.602   5.813  -3.109
  620   HG22  ILE  82          HG22      ILE  82  10.096   4.982  -3.555
  621   HG23  ILE  82          HG23      ILE  82  10.046   6.740  -3.518
  622   HD11  ILE  82          HD11      ILE  82  10.344   4.791   1.064
  623   HD12  ILE  82          HD12      ILE  82   8.851   3.853   1.048
  624   HD13  ILE  82          HD13      ILE  82   8.791   5.612   0.915
  625    H    ALA  83           HN       ALA  83  12.998   4.254  -0.051
  626    HA   ALA  83           HA       ALA  83  12.825   5.829   2.381
  627    HB1  ALA  83           HB1      ALA  83  12.410   3.395   2.444
  628    HB2  ALA  83           HB2      ALA  83  13.731   3.882   3.496
  629    HB3  ALA  83           HB3      ALA  83  14.079   3.113   1.940
  630    H    GLY  84           HN       GLY  84  14.702   5.958  -0.204
  631    HA2  GLY  84           HA2      GLY  84  16.571   7.291  -0.492
  632    HA3  GLY  84           HA1      GLY  84  16.834   7.260   1.248
  633    H    LEU  85           HN       LEU  85  18.609   6.266   1.801
  634    HA   LEU  85           HA       LEU  85  19.623   4.137   0.066
  635    HB2  LEU  85           HB2      LEU  85  21.021   6.200   0.524
  636    HB3  LEU  85           HB1      LEU  85  21.105   5.684   2.192
  637    HG   LEU  85           HG       LEU  85  22.256   3.602   1.435
  638   HD11  LEU  85          HD11      LEU  85  22.325   5.026  -1.215
  639   HD12  LEU  85          HD12      LEU  85  21.454   3.536  -0.856
  640   HD13  LEU  85          HD13      LEU  85  23.216   3.561  -0.812
  641   HD21  LEU  85          HD21      LEU  85  23.508   5.490   2.298
  642   HD22  LEU  85          HD22      LEU  85  23.566   6.214   0.690
  643   HD23  LEU  85          HD23      LEU  85  24.405   4.693   1.007
  644    H    GLU  86           HN       GLU  86  17.795   4.458   2.723
  645    HA   GLU  86           HA       GLU  86  19.067   2.436   4.333
  646    HB2  GLU  86           HB2      GLU  86  16.537   4.028   4.735
  647    HB3  GLU  86           HB1      GLU  86  17.014   2.717   5.808
  648    HG2  GLU  86           HG2      GLU  86  18.606   5.209   5.250
  649    HG3  GLU  86           HG1      GLU  86  17.650   4.893   6.698
  650    H    HIS  87           HN       HIS  87  19.046   0.602   3.303
  651    HA   HIS  87           HA       HIS  87  16.605  -0.449   2.080
  652    HB2  HIS  87           HB2      HIS  87  19.442  -1.498   2.102
  653    HB3  HIS  87           HB1      HIS  87  18.100  -2.267   1.280
  654    HD1  HIS  87           HD1      HIS  87  20.351   0.794   1.047
  655    HD2  HIS  87           HD2      HIS  87  17.496  -1.254  -1.182
  656    HE1  HIS  87           HE1      HIS  87  20.457   1.747  -1.261
  657    H    HIS  88           HN       HIS  88  18.637  -0.886   4.876
  658    HA   HIS  88           HA       HIS  88  17.319  -3.447   5.444
  659    HB2  HIS  88           HB2      HIS  88  20.058  -2.551   6.377
  660    HB3  HIS  88           HB1      HIS  88  19.314  -4.109   6.691
  661    HD1  HIS  88           HD1      HIS  88  19.073  -5.731   4.517
  662    HD2  HIS  88           HD2      HIS  88  21.384  -2.310   4.024
  663    HE1  HIS  88           HE1      HIS  88  20.377  -6.064   2.395
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  13.260   3.484  11.998
    2    H2   MET   1           HT2      MET   1  14.359   2.822  13.064
    3    H3   MET   1           HT3      MET   1  12.790   2.186  12.932
    4    HA   MET   1           HA       MET   1  14.774   2.243  10.780
    5    HB2  MET   1           HB2      MET   1  13.960  -0.038  12.585
    6    HB3  MET   1           HB1      MET   1  14.776  -0.291  11.056
    7    HG2  MET   1           HG2      MET   1  16.400  -0.397  12.812
    8    HG3  MET   1           HG1      MET   1  16.661   1.073  11.886
    9    HE1  MET   1           HE1      MET   1  13.965   0.358  14.734
   10    HE2  MET   1           HE2      MET   1  14.857   0.947  16.135
   11    HE3  MET   1           HE3      MET   1  15.429  -0.471  15.262
   12    H    VAL   2           HN       VAL   2  12.001   0.115  11.647
   13    HA   VAL   2           HA       VAL   2  11.007   0.857   9.027
   14    HB   VAL   2           HB       VAL   2  11.810  -1.420   8.856
   15   HG11  VAL   2          HG11      VAL   2  10.055  -2.086  11.195
   16   HG12  VAL   2          HG12      VAL   2  11.817  -2.136  11.128
   17   HG13  VAL   2          HG13      VAL   2  10.864  -3.270  10.172
   18   HG21  VAL   2          HG21      VAL   2   9.764  -2.606   8.148
   19   HG22  VAL   2          HG22      VAL   2   9.812  -0.938   7.578
   20   HG23  VAL   2          HG23      VAL   2   8.798  -1.368   8.953
   21    H    THR   3           HN       THR   3   9.560   2.253   9.375
   22    HA   THR   3           HA       THR   3   7.500   1.778  11.396
   23    HB   THR   3           HB       THR   3   8.886   3.850  11.703
   24    HG1  THR   3           HG1      THR   3   7.100   4.467  12.523
   25   HG21  THR   3          HG21      THR   3   7.735   4.669   9.028
   26   HG22  THR   3          HG22      THR   3   9.430   4.324   9.369
   27   HG23  THR   3          HG23      THR   3   8.648   5.721  10.110
   28    H    ALA   4           HN       ALA   4   5.359   2.955  10.590
   29    HA   ALA   4           HA       ALA   4   4.645   1.654   8.133
   30    HB1  ALA   4           HB1      ALA   4   2.383   2.456   8.557
   31    HB2  ALA   4           HB2      ALA   4   2.975   3.497   9.850
   32    HB3  ALA   4           HB3      ALA   4   3.063   1.742  10.021
   33    H    ALA   5           HN       ALA   5   5.841   2.614   6.592
   34    HA   ALA   5           HA       ALA   5   5.525   5.479   6.132
   35    HB1  ALA   5           HB1      ALA   5   7.328   5.230   4.506
   36    HB2  ALA   5           HB2      ALA   5   7.305   3.481   4.736
   37    HB3  ALA   5           HB3      ALA   5   7.786   4.539   6.063
   38    H    LEU   6           HN       LEU   6   3.840   2.848   5.391
   39    HA   LEU   6           HA       LEU   6   3.079   3.838   2.719
   40    HB2  LEU   6           HB2      LEU   6   2.795   1.038   3.768
   41    HB3  LEU   6           HB1      LEU   6   2.351   1.606   2.177
   42    HG   LEU   6           HG       LEU   6   5.118   1.275   3.288
   43   HD11  LEU   6          HD11      LEU   6   4.026  -0.762   2.583
   44   HD12  LEU   6          HD12      LEU   6   5.328  -0.328   1.474
   45   HD13  LEU   6          HD13      LEU   6   3.651  -0.034   1.021
   46   HD21  LEU   6          HD21      LEU   6   4.243   2.399   0.641
   47   HD22  LEU   6          HD22      LEU   6   5.894   1.972   1.112
   48   HD23  LEU   6          HD23      LEU   6   5.051   3.283   1.946
   49    H    THR   7           HN       THR   7   1.004   4.293   2.448
   50    HA   THR   7           HA       THR   7  -0.822   3.656   4.641
   51    HB   THR   7           HB       THR   7  -1.179   5.656   2.388
   52    HG1  THR   7           HG1      THR   7   0.401   5.692   4.553
   53   HG21  THR   7          HG21      THR   7  -3.245   4.924   3.538
   54   HG22  THR   7          HG22      THR   7  -2.874   6.613   3.880
   55   HG23  THR   7          HG23      THR   7  -2.531   5.369   5.086
   56    H    ILE   8           HN       ILE   8  -2.042   1.901   4.209
   57    HA   ILE   8           HA       ILE   8  -2.547   1.272   1.405
   58    HB   ILE   8           HB       ILE   8  -2.148  -0.614   3.736
   59   HG12  ILE   8          HG12      ILE   8  -0.714  -0.265   1.101
   60   HG13  ILE   8          HG11      ILE   8  -0.101   0.164   2.692
   61   HG21  ILE   8          HG21      ILE   8  -4.046  -1.400   2.452
   62   HG22  ILE   8          HG22      ILE   8  -2.670  -2.477   2.236
   63   HG23  ILE   8          HG23      ILE   8  -3.112  -1.347   0.952
   64   HD11  ILE   8          HD11      ILE   8  -0.704  -2.608   1.703
   65   HD12  ILE   8          HD12      ILE   8  -0.107  -2.198   3.313
   66   HD13  ILE   8          HD13      ILE   8   0.894  -1.887   1.894
   67    H    TYR   9           HN       TYR   9  -4.484   1.263   0.787
   68    HA   TYR   9           HA       TYR   9  -6.531   1.792   2.681
   69    HB2  TYR   9           HB2      TYR   9  -6.541   1.649  -0.331
   70    HB3  TYR   9           HB1      TYR   9  -7.957   2.086   0.616
   71    HD1  TYR   9           HD2      TYR   9  -7.930   4.187   1.974
   72    HD2  TYR   9           HD1      TYR   9  -4.761   3.247  -0.695
   73    HE1  TYR   9           HE2      TYR   9  -7.142   6.518   2.095
   74    HE2  TYR   9           HE1      TYR   9  -3.961   5.567  -0.577
   75    HH   TYR   9           HH       TYR   9  -5.085   7.783   1.761
   76    H    THR  10           HN       THR  10  -8.025   0.400   3.474
   77    HA   THR  10           HA       THR  10  -8.196  -2.285   2.354
   78    HB   THR  10           HB       THR  10  -8.090  -3.051   4.800
   79    HG1  THR  10           HG1      THR  10  -7.986  -1.223   5.960
   80   HG21  THR  10          HG21      THR  10  -6.367  -3.619   3.139
   81   HG22  THR  10          HG22      THR  10  -5.634  -3.283   4.710
   82   HG23  THR  10          HG23      THR  10  -5.586  -2.067   3.432
   83    H    THR  11           HN       THR  11  -9.885  -3.552   3.847
   84    HA   THR  11           HA       THR  11 -11.963  -1.990   5.043
   85    HB   THR  11           HB       THR  11 -12.630  -3.701   2.539
   86    HG1  THR  11           HG1      THR  11 -11.717  -1.193   2.729
   87   HG21  THR  11          HG21      THR  11 -14.397  -3.489   4.251
   88   HG22  THR  11          HG22      THR  11 -14.783  -2.683   2.717
   89   HG23  THR  11          HG23      THR  11 -14.279  -1.730   4.108
   90    H    SER  12           HN       SER  12 -13.454  -3.600   6.255
   91    HA   SER  12           HA       SER  12 -12.116  -5.930   7.163
   92    HB2  SER  12           HB2      SER  12 -15.113  -5.402   7.237
   93    HB3  SER  12           HB1      SER  12 -14.196  -6.434   8.332
   94    HG   SER  12           HG       SER  12 -14.344  -3.655   8.152
   95    H    TRP  13           HN       TRP  13 -14.936  -5.473   5.079
   96    HA   TRP  13           HA       TRP  13 -14.763  -8.011   3.694
   97    HB2  TRP  13           HB2      TRP  13 -16.843  -7.202   3.139
   98    HB3  TRP  13           HB1      TRP  13 -16.464  -5.598   3.725
   99    HD1  TRP  13           HD1      TRP  13 -15.390  -7.656   0.686
  100    HE1  TRP  13           HE1      TRP  13 -15.474  -6.247  -1.293
  101    HE3  TRP  13           HE3      TRP  13 -17.285  -3.458   2.874
  102    HZ2  TRP  13           HZ2      TRP  13 -16.370  -3.562  -2.016
  103    HZ3  TRP  13           HZ3      TRP  13 -17.756  -1.510   1.451
  104    HH2  TRP  13           HH2      TRP  13 -17.309  -1.565  -0.947
  105    H    CYS  14           HN       CYS  14 -13.131  -8.696   2.774
  106    HA   CYS  14           HA       CYS  14 -11.619  -7.043   0.978
  107    HB2  CYS  14           HB2      CYS  14 -10.705  -6.239   3.051
  108    HB3  CYS  14           HB1      CYS  14 -10.478  -7.880   3.667
  109    H    GLY  15           HN       GLY  15 -10.798  -8.321  -0.564
  110    HA2  GLY  15           HA2      GLY  15 -10.475 -11.182   0.052
  111    HA3  GLY  15           HA1      GLY  15 -11.084 -10.593  -1.493
  112    H    TYR  16           HN       TYR  16  -9.636  -9.234  -2.767
  113    HA   TYR  16           HA       TYR  16  -7.133 -10.527  -3.086
  114    HB2  TYR  16           HB2      TYR  16  -8.428  -9.556  -4.983
  115    HB3  TYR  16           HB1      TYR  16  -8.100  -7.946  -4.354
  116    HD1  TYR  16           HD1      TYR  16  -6.626 -10.883  -6.001
  117    HD2  TYR  16           HD2      TYR  16  -5.967  -6.916  -4.690
  118    HE1  TYR  16           HE1      TYR  16  -4.560 -10.809  -7.314
  119    HE2  TYR  16           HE2      TYR  16  -3.870  -6.813  -5.999
  120    HH   TYR  16           HH       TYR  16  -3.128  -8.949  -8.378
  121    H    CYS  17           HN       CYS  17  -8.133  -7.529  -1.600
  122    HA   CYS  17           HA       CYS  17  -5.697  -6.293  -1.255
  123    HB2  CYS  17           HB2      CYS  17  -6.951  -5.457   0.976
  124    HB3  CYS  17           HB1      CYS  17  -7.423  -4.850  -0.602
  125    H    LEU  18           HN       LEU  18  -7.206  -8.842   0.619
  126    HA   LEU  18           HA       LEU  18  -5.547  -8.717   2.904
  127    HB2  LEU  18           HB2      LEU  18  -7.871  -9.688   2.752
  128    HB3  LEU  18           HB1      LEU  18  -7.207 -11.028   1.860
  129    HG   LEU  18           HG       LEU  18  -7.783 -11.506   4.249
  130   HD11  LEU  18          HD11      LEU  18  -6.238 -12.963   3.122
  131   HD12  LEU  18          HD12      LEU  18  -5.776 -12.758   4.814
  132   HD13  LEU  18          HD13      LEU  18  -4.890 -11.906   3.549
  133   HD21  LEU  18          HD21      LEU  18  -6.295 -10.718   6.015
  134   HD22  LEU  18          HD22      LEU  18  -7.133  -9.383   5.226
  135   HD23  LEU  18          HD23      LEU  18  -5.442  -9.708   4.851
  136    H    ARG  19           HN       ARG  19  -5.399 -10.424  -0.114
  137    HA   ARG  19           HA       ARG  19  -3.375 -12.282   0.503
  138    HB2  ARG  19           HB2      ARG  19  -4.772 -12.440  -1.517
  139    HB3  ARG  19           HB1      ARG  19  -4.019 -10.986  -2.149
  140    HG2  ARG  19           HG2      ARG  19  -1.849 -12.155  -2.187
  141    HG3  ARG  19           HG1      ARG  19  -2.651 -13.621  -1.625
  142    HD2  ARG  19           HD2      ARG  19  -3.219 -12.144  -4.192
  143    HD3  ARG  19           HD1      ARG  19  -2.356 -13.675  -4.036
  144    HE   ARG  19           HE       ARG  19  -4.731 -14.144  -2.846
  145   HH11  ARG  19          HH11      ARG  19  -3.829 -12.986  -6.051
  146   HH12  ARG  19          HH12      ARG  19  -5.190 -13.649  -6.839
  147   HH21  ARG  19          HH21      ARG  19  -6.604 -15.052  -3.891
  148   HH22  ARG  19          HH22      ARG  19  -6.816 -14.864  -5.561
  149    H    LEU  20           HN       LEU  20  -3.189  -9.090  -1.027
  150    HA   LEU  20           HA       LEU  20  -0.387  -9.122  -1.179
  151    HB2  LEU  20           HB2      LEU  20  -1.646  -7.675  -2.644
  152    HB3  LEU  20           HB1      LEU  20  -2.354  -6.839  -1.283
  153    HG   LEU  20           HG       LEU  20   0.019  -6.031  -0.759
  154   HD11  LEU  20          HD11      LEU  20   0.520  -7.010  -3.560
  155   HD12  LEU  20          HD12      LEU  20   1.503  -7.325  -2.103
  156   HD13  LEU  20          HD13      LEU  20   1.420  -5.734  -2.793
  157   HD21  LEU  20          HD21      LEU  20  -1.695  -4.570  -1.547
  158   HD22  LEU  20          HD22      LEU  20  -1.445  -5.125  -3.198
  159   HD23  LEU  20          HD23      LEU  20  -0.177  -4.195  -2.372
  160    H    LYS  21           HN       LYS  21  -2.685  -7.885   1.123
  161    HA   LYS  21           HA       LYS  21  -1.057  -6.354   2.774
  162    HB2  LYS  21           HB2      LYS  21  -3.572  -6.507   2.717
  163    HB3  LYS  21           HB1      LYS  21  -3.433  -8.012   3.602
  164    HG2  LYS  21           HG2      LYS  21  -2.456  -6.856   5.471
  165    HG3  LYS  21           HG1      LYS  21  -2.475  -5.340   4.568
  166    HD2  LYS  21           HD2      LYS  21  -4.936  -5.540   4.381
  167    HD3  LYS  21           HD1      LYS  21  -4.861  -6.971   5.414
  168    HE2  LYS  21           HE2      LYS  21  -3.953  -4.196   6.161
  169    HE3  LYS  21           HE1      LYS  21  -5.476  -4.926   6.638
  170    HZ1  LYS  21           HZ1      LYS  21  -2.774  -5.936   7.416
  171    HZ2  LYS  21           HZ2      LYS  21  -4.288  -6.573   7.891
  172    HZ3  LYS  21           HZ3      LYS  21  -3.847  -5.010   8.349
  173    H    THR  22           HN       THR  22  -1.847  -9.818   2.921
  174    HA   THR  22           HA       THR  22  -0.330 -10.330   5.257
  175    HB   THR  22           HB       THR  22  -1.139 -12.290   3.076
  176    HG1  THR  22           HG1      THR  22  -3.001 -11.365   3.819
  177   HG21  THR  22          HG21      THR  22  -1.026 -13.968   4.880
  178   HG22  THR  22          HG22      THR  22  -0.511 -12.721   6.014
  179   HG23  THR  22          HG23      THR  22   0.537 -13.178   4.672
  180    H    ALA  23           HN       ALA  23   0.405 -10.402   1.811
  181    HA   ALA  23           HA       ALA  23   2.991 -11.619   1.943
  182    HB1  ALA  23           HB1      ALA  23   1.910  -9.669  -0.082
  183    HB2  ALA  23           HB2      ALA  23   1.662 -11.415  -0.142
  184    HB3  ALA  23           HB3      ALA  23   3.289 -10.746  -0.298
  185    H    LEU  24           HN       LEU  24   1.951  -8.275   2.056
  186    HA   LEU  24           HA       LEU  24   4.593  -7.269   2.155
  187    HB2  LEU  24           HB2      LEU  24   2.019  -6.021   3.088
  188    HB3  LEU  24           HB1      LEU  24   3.527  -5.148   2.865
  189    HG   LEU  24           HG       LEU  24   1.846  -6.458   0.737
  190   HD11  LEU  24          HD11      LEU  24   1.598  -4.193  -0.114
  191   HD12  LEU  24          HD12      LEU  24   2.514  -3.579   1.264
  192   HD13  LEU  24          HD13      LEU  24   0.955  -4.365   1.518
  193   HD21  LEU  24          HD21      LEU  24   4.188  -6.738   0.177
  194   HD22  LEU  24          HD22      LEU  24   4.471  -5.018   0.454
  195   HD23  LEU  24          HD23      LEU  24   3.435  -5.537  -0.874
  196    H    THR  25           HN       THR  25   2.284  -8.169   4.638
  197    HA   THR  25           HA       THR  25   3.801  -7.301   6.845
  198    HB   THR  25           HB       THR  25   1.802  -9.599   6.761
  199    HG1  THR  25           HG1      THR  25   0.723  -7.817   5.990
  200   HG21  THR  25          HG21      THR  25   2.643  -7.745   8.998
  201   HG22  THR  25          HG22      THR  25   3.107  -9.440   8.853
  202   HG23  THR  25          HG23      THR  25   1.417  -9.006   9.117
  203    H    ALA  26           HN       ALA  26   3.757 -10.323   5.005
  204    HA   ALA  26           HA       ALA  26   5.576 -11.756   6.644
  205    HB1  ALA  26           HB1      ALA  26   4.896 -12.152   3.732
  206    HB2  ALA  26           HB2      ALA  26   4.022 -12.851   5.094
  207    HB3  ALA  26           HB3      ALA  26   5.694 -13.324   4.780
  208    H    ASN  27           HN       ASN  27   5.944  -9.435   4.155
  209    HA   ASN  27           HA       ASN  27   8.777 -10.003   3.764
  210    HB2  ASN  27           HB2      ASN  27   6.699  -8.477   2.356
  211    HB3  ASN  27           HB1      ASN  27   8.357  -7.859   2.156
  212   HD21  ASN  27          HD21      ASN  27   6.039 -10.302   1.458
  213   HD22  ASN  27          HD22      ASN  27   6.957 -11.155   0.272
  214    H    ARG  28           HN       ARG  28   7.306  -8.628   6.157
  215    HA   ARG  28           HA       ARG  28   7.813  -7.166   7.818
  216    HB2  ARG  28           HB2      ARG  28  10.467  -6.958   6.405
  217    HB3  ARG  28           HB1      ARG  28  10.117  -6.184   7.937
  218    HG2  ARG  28           HG2      ARG  28   9.658  -8.477   8.855
  219    HG3  ARG  28           HG1      ARG  28  10.313  -9.116   7.338
  220    HD2  ARG  28           HD2      ARG  28  12.051  -9.008   9.039
  221    HD3  ARG  28           HD1      ARG  28  12.390  -7.879   7.720
  222    HE   ARG  28           HE       ARG  28  10.982  -6.886  10.067
  223   HH11  ARG  28          HH11      ARG  28  14.060  -6.972   8.277
  224   HH12  ARG  28          HH12      ARG  28  14.689  -5.586   9.022
  225   HH21  ARG  28          HH21      ARG  28  11.895  -4.988  11.140
  226   HH22  ARG  28          HH22      ARG  28  13.438  -4.444  10.668
  227    H    ILE  29           HN       ILE  29   6.615  -6.212   5.324
  228    HA   ILE  29           HA       ILE  29   7.616  -3.508   5.197
  229    HB   ILE  29           HB       ILE  29   5.446  -4.908   3.610
  230   HG12  ILE  29          HG12      ILE  29   8.241  -4.034   2.820
  231   HG13  ILE  29          HG11      ILE  29   7.780  -5.684   3.214
  232   HG21  ILE  29          HG21      ILE  29   6.643  -2.156   3.269
  233   HG22  ILE  29          HG22      ILE  29   5.036  -2.504   3.867
  234   HG23  ILE  29          HG23      ILE  29   5.455  -2.900   2.192
  235   HD11  ILE  29          HD11      ILE  29   7.949  -5.319   0.820
  236   HD12  ILE  29          HD12      ILE  29   6.709  -4.063   0.917
  237   HD13  ILE  29          HD13      ILE  29   6.306  -5.738   1.294
  238    H    ALA  30           HN       ALA  30   6.882  -2.076   6.518
  239    HA   ALA  30           HA       ALA  30   4.484  -2.582   8.052
  240    HB1  ALA  30           HB1      ALA  30   5.239  -0.719   9.424
  241    HB2  ALA  30           HB2      ALA  30   6.533  -0.412   8.258
  242    HB3  ALA  30           HB3      ALA  30   6.524  -1.911   9.184
  243    H    TYR  31           HN       TYR  31   2.654  -1.603   7.771
  244    HA   TYR  31           HA       TYR  31   2.482   0.784   6.105
  245    HB2  TYR  31           HB2      TYR  31   0.538  -0.228   4.925
  246    HB3  TYR  31           HB1      TYR  31   2.057  -1.046   4.583
  247    HD1  TYR  31           HD1      TYR  31  -1.167  -1.326   6.366
  248    HD2  TYR  31           HD2      TYR  31   2.410  -3.327   5.230
  249    HE1  TYR  31           HE1      TYR  31  -2.153  -3.472   7.049
  250    HE2  TYR  31           HE2      TYR  31   1.434  -5.467   5.917
  251    HH   TYR  31           HH       TYR  31  -0.237  -6.313   7.298
  252    H    ASP  32           HN       ASP  32   0.286   1.682   6.223
  253    HA   ASP  32           HA       ASP  32  -1.002   1.246   8.823
  254    HB2  ASP  32           HB2      ASP  32   0.095   3.407   8.777
  255    HB3  ASP  32           HB1      ASP  32  -0.599   3.772   7.208
  256    H    GLU  33           HN       GLU  33  -3.029   0.487   8.631
  257    HA   GLU  33           HA       GLU  33  -4.259   0.550   6.000
  258    HB2  GLU  33           HB2      GLU  33  -5.769  -1.220   6.839
  259    HB3  GLU  33           HB1      GLU  33  -4.091  -1.638   7.025
  260    HG2  GLU  33           HG2      GLU  33  -4.203  -0.994   9.418
  261    HG3  GLU  33           HG1      GLU  33  -5.930  -0.716   9.216
  262    H    VAL  34           HN       VAL  34  -6.218   1.410   5.564
  263    HA   VAL  34           HA       VAL  34  -6.760   3.725   7.265
  264    HB   VAL  34           HB       VAL  34  -7.728   3.323   4.434
  265   HG11  VAL  34          HG11      VAL  34  -7.367   5.834   6.007
  266   HG12  VAL  34          HG12      VAL  34  -8.891   5.070   5.563
  267   HG13  VAL  34          HG13      VAL  34  -7.841   5.731   4.311
  268   HG21  VAL  34          HG21      VAL  34  -5.168   4.605   5.363
  269   HG22  VAL  34          HG22      VAL  34  -5.781   4.611   3.708
  270   HG23  VAL  34          HG23      VAL  34  -5.311   3.090   4.468
  271    H    ASP  35           HN       ASP  35  -8.801   4.576   7.561
  272    HA   ASP  35           HA       ASP  35 -10.813   2.815   8.555
  273    HB2  ASP  35           HB2      ASP  35 -10.670   5.827   8.471
  274    HB3  ASP  35           HB1      ASP  35 -11.934   4.918   9.276
  275    H    ILE  36           HN       ILE  36 -10.400   3.725   5.475
  276    HA   ILE  36           HA       ILE  36 -12.506   5.198   4.496
  277    HB   ILE  36           HB       ILE  36 -12.343   4.157   2.319
  278   HG12  ILE  36          HG12      ILE  36 -10.328   2.219   3.374
  279   HG13  ILE  36          HG11      ILE  36 -12.040   1.804   3.389
  280   HG21  ILE  36          HG21      ILE  36  -9.668   4.493   3.635
  281   HG22  ILE  36          HG22      ILE  36 -10.677   5.773   2.965
  282   HG23  ILE  36          HG23      ILE  36  -9.988   4.550   1.900
  283   HD11  ILE  36          HD11      ILE  36 -12.171   2.030   1.000
  284   HD12  ILE  36          HD12      ILE  36 -10.834   0.951   1.378
  285   HD13  ILE  36          HD13      ILE  36 -10.536   2.642   0.924
  286    H    GLU  37           HN       GLU  37 -12.931   1.947   5.687
  287    HA   GLU  37           HA       GLU  37 -15.139   1.113   4.183
  288    HB2  GLU  37           HB2      GLU  37 -13.851  -0.255   5.847
  289    HB3  GLU  37           HB1      GLU  37 -14.633   0.666   7.110
  290    HG2  GLU  37           HG2      GLU  37 -16.793  -0.179   6.451
  291    HG3  GLU  37           HG1      GLU  37 -16.047  -1.105   5.146
  292    H    HIS  38           HN       HIS  38 -15.061   2.825   7.290
  293    HA   HIS  38           HA       HIS  38 -17.826   3.625   6.811
  294    HB2  HIS  38           HB2      HIS  38 -17.331   2.685   9.048
  295    HB3  HIS  38           HB1      HIS  38 -16.164   3.976   9.325
  296    HD1  HIS  38           HD1      HIS  38 -19.922   3.705   8.553
  297    HD2  HIS  38           HD2      HIS  38 -17.217   6.097  10.623
  298    HE1  HIS  38           HE1      HIS  38 -21.288   5.452   9.728
  299    H    ASN  39           HN       ASN  39 -14.592   4.952   7.154
  300    HA   ASN  39           HA       ASN  39 -15.429   7.688   7.231
  301    HB2  ASN  39           HB2      ASN  39 -13.200   7.012   8.055
  302    HB3  ASN  39           HB1      ASN  39 -12.730   6.603   6.406
  303   HD21  ASN  39          HD21      ASN  39 -11.246   8.133   5.958
  304   HD22  ASN  39          HD22      ASN  39 -11.456   9.818   6.147
  305    H    ARG  40           HN       ARG  40 -16.472   8.560   5.625
  306    HA   ARG  40           HA       ARG  40 -16.215   7.592   2.960
  307    HB2  ARG  40           HB2      ARG  40 -17.970   9.204   2.389
  308    HB3  ARG  40           HB1      ARG  40 -18.391   8.300   3.833
  309    HG2  ARG  40           HG2      ARG  40 -19.062  10.446   4.390
  310    HG3  ARG  40           HG1      ARG  40 -17.446  10.378   5.089
  311    HD2  ARG  40           HD2      ARG  40 -17.648  12.473   3.977
  312    HD3  ARG  40           HD1      ARG  40 -16.599  11.457   2.983
  313    HE   ARG  40           HE       ARG  40 -19.417  12.050   2.458
  314   HH11  ARG  40          HH11      ARG  40 -16.268  10.977   1.120
  315   HH12  ARG  40          HH12      ARG  40 -16.771  11.246  -0.490
  316   HH21  ARG  40          HH21      ARG  40 -19.979  12.399   0.253
  317   HH22  ARG  40          HH22      ARG  40 -18.851  12.100  -0.988
  318    H    ALA  41           HN       ALA  41 -14.671  10.074   4.768
  319    HA   ALA  41           HA       ALA  41 -14.089  11.676   2.531
  320    HB1  ALA  41           HB1      ALA  41 -12.702  11.776   5.203
  321    HB2  ALA  41           HB2      ALA  41 -14.177  12.626   4.770
  322    HB3  ALA  41           HB3      ALA  41 -12.670  13.009   3.943
  323    H    ALA  42           HN       ALA  42 -12.144   9.270   4.155
  324    HA   ALA  42           HA       ALA  42 -10.040   9.654   2.224
  325    HB1  ALA  42           HB1      ALA  42 -10.419   7.405   4.199
  326    HB2  ALA  42           HB2      ALA  42  -9.524   8.893   4.489
  327    HB3  ALA  42           HB3      ALA  42  -8.951   7.742   3.277
  328    H    ALA  43           HN       ALA  43 -12.897   7.735   2.503
  329    HA   ALA  43           HA       ALA  43 -12.255   5.766   0.574
  330    HB1  ALA  43           HB1      ALA  43 -14.654   5.326   0.515
  331    HB2  ALA  43           HB2      ALA  43 -14.958   6.856   1.339
  332    HB3  ALA  43           HB3      ALA  43 -14.119   5.559   2.186
  333    H    GLU  44           HN       GLU  44 -13.428   9.014   0.450
  334    HA   GLU  44           HA       GLU  44 -14.283   9.030  -2.233
  335    HB2  GLU  44           HB2      GLU  44 -14.795  10.718  -0.388
  336    HB3  GLU  44           HB1      GLU  44 -13.206  11.388  -0.711
  337    HG2  GLU  44           HG2      GLU  44 -14.918  12.652  -1.873
  338    HG3  GLU  44           HG1      GLU  44 -13.867  11.820  -3.026
  339    H    PHE  45           HN       PHE  45 -11.182   9.544  -0.627
  340    HA   PHE  45           HA       PHE  45  -9.739  10.498  -2.857
  341    HB2  PHE  45           HB2      PHE  45  -8.815  10.617  -0.554
  342    HB3  PHE  45           HB1      PHE  45  -8.741   8.861  -0.490
  343    HD1  PHE  45           HD1      PHE  45  -7.227  11.887  -1.898
  344    HD2  PHE  45           HD2      PHE  45  -6.998   7.643  -1.664
  345    HE1  PHE  45           HE1      PHE  45  -4.974  11.955  -2.870
  346    HE2  PHE  45           HE2      PHE  45  -4.738   7.710  -2.634
  347    HZ   PHE  45           HZ       PHE  45  -3.732   9.875  -3.247
  348    H    VAL  46           HN       VAL  46 -10.364   7.297  -1.588
  349    HA   VAL  46           HA       VAL  46  -8.874   5.811  -3.431
  350    HB   VAL  46           HB       VAL  46 -11.438   4.970  -2.041
  351   HG11  VAL  46          HG11      VAL  46 -10.831   3.452  -3.846
  352   HG12  VAL  46          HG12      VAL  46 -10.570   2.684  -2.279
  353   HG13  VAL  46          HG13      VAL  46  -9.199   3.309  -3.196
  354   HG21  VAL  46          HG21      VAL  46  -9.801   5.763  -0.445
  355   HG22  VAL  46          HG22      VAL  46  -8.576   4.712  -1.154
  356   HG23  VAL  46          HG23      VAL  46  -9.971   4.013  -0.337
  357    H    GLY  47           HN       GLY  47 -12.281   6.769  -3.435
  358    HA2  GLY  47           HA2      GLY  47 -12.961   5.631  -5.924
  359    HA3  GLY  47           HA1      GLY  47 -13.838   6.912  -5.105
  360    H    SER  48           HN       SER  48 -11.292   8.534  -5.119
  361    HA   SER  48           HA       SER  48 -11.664   9.725  -7.697
  362    HB2  SER  48           HB2      SER  48  -9.863  10.509  -5.406
  363    HB3  SER  48           HB1      SER  48 -10.125  11.457  -6.873
  364    HG   SER  48           HG       SER  48 -12.149  10.641  -5.069
  365    H    VAL  49           HN       VAL  49  -9.029   8.024  -6.017
  366    HA   VAL  49           HA       VAL  49  -7.190   8.470  -8.151
  367    HB   VAL  49           HB       VAL  49  -6.402   8.203  -5.825
  368   HG11  VAL  49          HG11      VAL  49  -7.138   5.304  -6.102
  369   HG12  VAL  49          HG12      VAL  49  -7.900   6.497  -5.055
  370   HG13  VAL  49          HG13      VAL  49  -6.224   6.016  -4.766
  371   HG21  VAL  49          HG21      VAL  49  -5.252   6.152  -7.715
  372   HG22  VAL  49          HG22      VAL  49  -4.451   6.769  -6.269
  373   HG23  VAL  49          HG23      VAL  49  -4.803   7.856  -7.613
  374    H    ASN  50           HN       ASN  50  -9.366   5.804  -7.407
  375    HA   ASN  50           HA       ASN  50  -8.524   4.719  -9.978
  376    HB2  ASN  50           HB2      ASN  50  -9.312   2.438  -9.242
  377    HB3  ASN  50           HB1      ASN  50  -7.889   3.017  -8.400
  378   HD21  ASN  50          HD21      ASN  50  -7.940   3.140  -6.231
  379   HD22  ASN  50          HD22      ASN  50  -9.312   2.757  -5.263
  380    H    GLY  51           HN       GLY  51 -10.200   3.646 -11.224
  381    HA2  GLY  51           HA2      GLY  51 -12.680   5.184 -10.828
  382    HA3  GLY  51           HA1      GLY  51 -11.993   4.818 -12.398
  383    H    GLY  52           HN       GLY  52 -14.620   4.295 -11.516
  384    HA2  GLY  52           HA2      GLY  52 -16.176   2.695 -11.918
  385    HA3  GLY  52           HA1      GLY  52 -14.879   1.645 -12.477
  386    H    ASN  53           HN       ASN  53 -14.220   0.071 -11.229
  387    HA   ASN  53           HA       ASN  53 -15.761  -0.523  -8.853
  388    HB2  ASN  53           HB2      ASN  53 -15.081  -2.244 -10.621
  389    HB3  ASN  53           HB1      ASN  53 -13.444  -2.105  -9.996
  390   HD21  ASN  53          HD21      ASN  53 -15.083  -4.426 -10.063
  391   HD22  ASN  53          HD22      ASN  53 -15.287  -4.962  -8.437
  392    H    ARG  54           HN       ARG  54 -15.133   0.154  -6.923
  393    HA   ARG  54           HA       ARG  54 -12.855   1.653  -6.363
  394    HB2  ARG  54           HB2      ARG  54 -15.002   1.534  -4.982
  395    HB3  ARG  54           HB1      ARG  54 -14.390   0.021  -4.328
  396    HG2  ARG  54           HG2      ARG  54 -12.338   1.337  -3.630
  397    HG3  ARG  54           HG1      ARG  54 -13.299   2.778  -3.968
  398    HD2  ARG  54           HD2      ARG  54 -13.510   2.276  -1.634
  399    HD3  ARG  54           HD1      ARG  54 -15.042   1.874  -2.410
  400    HE   ARG  54           HE       ARG  54 -13.787  -0.463  -2.507
  401   HH11  ARG  54          HH11      ARG  54 -14.554   1.677   0.197
  402   HH12  ARG  54          HH12      ARG  54 -14.181   0.521   1.385
  403   HH21  ARG  54          HH21      ARG  54 -13.372  -2.030  -0.925
  404   HH22  ARG  54          HH22      ARG  54 -13.423  -1.645   0.750
  405    H    THR  55           HN       THR  55 -10.885   0.896  -6.532
  406    HA   THR  55           HA       THR  55 -10.248  -1.880  -6.114
  407    HB   THR  55           HB       THR  55  -8.368   0.448  -6.589
  408    HG1  THR  55           HG1      THR  55 -10.329  -0.226  -8.055
  409   HG21  THR  55          HG21      THR  55  -8.218  -2.516  -7.151
  410   HG22  THR  55          HG22      THR  55  -7.292  -1.628  -5.929
  411   HG23  THR  55          HG23      THR  55  -7.004  -1.331  -7.647
  412    H    VAL  56           HN       VAL  56  -9.676  -2.672  -4.156
  413    HA   VAL  56           HA       VAL  56  -9.516  -0.842  -1.991
  414    HB   VAL  56           HB       VAL  56  -8.873  -3.771  -1.785
  415   HG11  VAL  56          HG11      VAL  56  -9.685  -1.735   0.290
  416   HG12  VAL  56          HG12      VAL  56  -8.041  -2.201  -0.017
  417   HG13  VAL  56          HG13      VAL  56  -9.191  -3.407   0.608
  418   HG21  VAL  56          HG21      VAL  56 -11.106  -3.361  -2.582
  419   HG22  VAL  56          HG22      VAL  56 -11.294  -2.236  -1.201
  420   HG23  VAL  56          HG23      VAL  56 -11.031  -3.980  -0.905
  421    HA   PRO  57           HA       PRO  57  -5.633  -2.290  -1.164
  422    HB2  PRO  57           HB2      PRO  57  -3.770  -3.815  -2.456
  423    HB3  PRO  57           HB1      PRO  57  -5.106  -4.433  -1.482
  424    HG2  PRO  57           HG2      PRO  57  -4.923  -4.143  -4.439
  425    HG3  PRO  57           HG1      PRO  57  -5.711  -5.418  -3.475
  426    HD2  PRO  57           HD2      PRO  57  -6.956  -3.222  -4.674
  427    HD3  PRO  57           HD1      PRO  57  -7.643  -4.297  -3.434
  428    H    THR  58           HN       THR  58  -5.522  -0.129  -1.942
  429    HA   THR  58           HA       THR  58  -3.753   0.699  -4.067
  430    HB   THR  58           HB       THR  58  -5.857   2.086  -2.379
  431    HG1  THR  58           HG1      THR  58  -6.994   0.828  -3.682
  432   HG21  THR  58          HG21      THR  58  -4.169   3.687  -3.285
  433   HG22  THR  58          HG22      THR  58  -5.745   3.862  -4.086
  434   HG23  THR  58          HG23      THR  58  -4.442   3.001  -4.894
  435    H    VAL  59           HN       VAL  59  -1.760   1.280  -3.397
  436    HA   VAL  59           HA       VAL  59  -1.408   1.928  -0.564
  437    HB   VAL  59           HB       VAL  59  -0.286  -0.166  -1.074
  438   HG11  VAL  59          HG11      VAL  59   1.543  -0.252  -2.724
  439   HG12  VAL  59          HG12      VAL  59   0.970   1.338  -3.307
  440   HG13  VAL  59          HG13      VAL  59  -0.080  -0.057  -3.396
  441   HG21  VAL  59          HG21      VAL  59   0.895   1.305   0.483
  442   HG22  VAL  59          HG22      VAL  59   1.740   2.065  -0.863
  443   HG23  VAL  59          HG23      VAL  59   2.039   0.370  -0.481
  444    H    LYS  60           HN       LYS  60  -0.556   3.755  -0.036
  445    HA   LYS  60           HA       LYS  60   0.526   5.484  -2.137
  446    HB2  LYS  60           HB2      LYS  60  -1.538   6.285  -0.982
  447    HB3  LYS  60           HB1      LYS  60  -0.668   6.218   0.541
  448    HG2  LYS  60           HG2      LYS  60   0.794   7.980  -0.172
  449    HG3  LYS  60           HG1      LYS  60   0.088   7.948  -1.789
  450    HD2  LYS  60           HD2      LYS  60  -2.104   8.537  -0.817
  451    HD3  LYS  60           HD1      LYS  60  -1.346   8.641   0.763
  452    HE2  LYS  60           HE2      LYS  60  -0.445  10.272  -1.579
  453    HE3  LYS  60           HE1      LYS  60  -1.656  10.830  -0.426
  454    HZ1  LYS  60           HZ1      LYS  60  -0.092  10.685   1.320
  455    HZ2  LYS  60           HZ2      LYS  60   0.636  11.597   0.115
  456    HZ3  LYS  60           HZ3      LYS  60   1.084   9.979   0.374
  457    H    PHE  61           HN       PHE  61   2.592   5.937  -2.008
  458    HA   PHE  61           HA       PHE  61   4.132   4.978   0.279
  459    HB2  PHE  61           HB2      PHE  61   4.991   5.908  -2.477
  460    HB3  PHE  61           HB1      PHE  61   6.120   5.554  -1.192
  461    HD1  PHE  61           HD1      PHE  61   3.281   3.933  -3.013
  462    HD2  PHE  61           HD2      PHE  61   7.029   3.454  -1.042
  463    HE1  PHE  61           HE1      PHE  61   3.327   1.534  -3.623
  464    HE2  PHE  61           HE2      PHE  61   7.047   1.104  -1.644
  465    HZ   PHE  61           HZ       PHE  61   5.197   0.135  -2.946
  466    H    ALA  62           HN       ALA  62   6.109   6.384   0.767
  467    HA   ALA  62           HA       ALA  62   5.252   8.780   1.940
  468    HB1  ALA  62           HB1      ALA  62   7.124   7.434   2.791
  469    HB2  ALA  62           HB2      ALA  62   7.572   9.124   2.556
  470    HB3  ALA  62           HB3      ALA  62   8.086   7.906   1.390
  471    H    ASP  63           HN       ASP  63   6.352   8.133  -1.223
  472    HA   ASP  63           HA       ASP  63   7.257  10.765  -1.917
  473    HB2  ASP  63           HB2      ASP  63   6.254   8.511  -3.664
  474    HB3  ASP  63           HB1      ASP  63   6.874  10.022  -4.293
  475    H    GLY  64           HN       GLY  64   4.206   9.354  -1.393
  476    HA2  GLY  64           HA2      GLY  64   2.199  10.565  -1.345
  477    HA3  GLY  64           HA1      GLY  64   2.879  11.710  -2.500
  478    H    SER  65           HN       SER  65   3.903   9.058  -3.827
  479    HA   SER  65           HA       SER  65   1.894   9.014  -5.787
  480    HB2  SER  65           HB2      SER  65   3.503   7.216  -6.693
  481    HB3  SER  65           HB1      SER  65   4.094   8.876  -6.567
  482    HG   SER  65           HG       SER  65   5.541   7.299  -5.716
  483    H    THR  66           HN       THR  66   0.601   7.309  -6.365
  484    HA   THR  66           HA       THR  66   0.161   5.312  -4.286
  485    HB   THR  66           HB       THR  66  -2.160   5.309  -5.502
  486    HG1  THR  66           HG1      THR  66  -1.657   6.752  -7.166
  487   HG21  THR  66          HG21      THR  66  -1.306   7.572  -3.685
  488   HG22  THR  66          HG22      THR  66  -1.816   5.968  -3.160
  489   HG23  THR  66          HG23      THR  66  -2.969   7.047  -3.952
  490    H    LEU  67           HN       LEU  67   0.083   3.246  -4.869
  491    HA   LEU  67           HA       LEU  67   0.281   2.596  -7.706
  492    HB2  LEU  67           HB2      LEU  67   1.657   1.332  -5.341
  493    HB3  LEU  67           HB1      LEU  67   1.336   0.378  -6.770
  494    HG   LEU  67           HG       LEU  67   2.686   1.997  -8.091
  495   HD11  LEU  67          HD11      LEU  67   3.464   3.220  -5.453
  496   HD12  LEU  67          HD12      LEU  67   2.565   3.971  -6.761
  497   HD13  LEU  67          HD13      LEU  67   4.242   3.505  -7.010
  498   HD21  LEU  67          HD21      LEU  67   4.122   0.601  -5.836
  499   HD22  LEU  67          HD22      LEU  67   4.872   1.196  -7.311
  500   HD23  LEU  67          HD23      LEU  67   3.663  -0.078  -7.396
  501    H    THR  68           HN       THR  68  -1.284   1.440  -8.495
  502    HA   THR  68           HA       THR  68  -3.338   0.458  -6.652
  503    HB   THR  68           HB       THR  68  -3.508   1.026  -9.625
  504    HG1  THR  68           HG1      THR  68  -3.041   2.868  -8.352
  505   HG21  THR  68          HG21      THR  68  -5.941   1.058  -9.220
  506   HG22  THR  68          HG22      THR  68  -5.665   0.653  -7.525
  507   HG23  THR  68          HG23      THR  68  -5.249  -0.505  -8.788
  508    H    ASN  69           HN       ASN  69  -3.233  -1.649  -6.238
  509    HA   ASN  69           HA       ASN  69  -2.840  -3.849  -6.305
  510    HB2  ASN  69           HB2      ASN  69  -3.486  -3.565  -9.247
  511    HB3  ASN  69           HB1      ASN  69  -3.257  -5.108  -8.448
  512   HD21  ASN  69          HD21      ASN  69  -5.507  -4.166  -9.860
  513   HD22  ASN  69          HD22      ASN  69  -6.844  -4.168  -8.777
  514    HA   PRO  70           HA       PRO  70   1.472  -3.614  -8.064
  515    HB2  PRO  70           HB2      PRO  70   2.894  -3.057  -5.920
  516    HB3  PRO  70           HB1      PRO  70   1.974  -1.757  -6.702
  517    HG2  PRO  70           HG2      PRO  70   1.184  -3.465  -4.366
  518    HG3  PRO  70           HG1      PRO  70   1.218  -1.679  -4.437
  519    HD2  PRO  70           HD2      PRO  70  -1.080  -3.060  -4.868
  520    HD3  PRO  70           HD1      PRO  70  -0.684  -1.599  -5.778
  521    H    SER  71           HN       SER  71   3.351  -4.998  -7.288
  522    HA   SER  71           HA       SER  71   2.410  -7.327  -5.801
  523    HB2  SER  71           HB2      SER  71   4.644  -7.084  -7.836
  524    HB3  SER  71           HB1      SER  71   4.134  -8.580  -7.040
  525    HG   SER  71           HG       SER  71   1.966  -7.824  -7.927
  526    H    ALA  72           HN       ALA  72   3.910  -8.268  -4.291
  527    HA   ALA  72           HA       ALA  72   4.917  -6.458  -2.460
  528    HB1  ALA  72           HB1      ALA  72   5.804  -8.367  -1.261
  529    HB2  ALA  72           HB2      ALA  72   5.645  -9.370  -2.704
  530    HB3  ALA  72           HB3      ALA  72   4.205  -8.729  -1.914
  531    H    ASP  73           HN       ASP  73   6.656  -8.098  -5.028
  532    HA   ASP  73           HA       ASP  73   9.255  -7.537  -4.097
  533    HB2  ASP  73           HB2      ASP  73  10.077  -8.147  -6.305
  534    HB3  ASP  73           HB1      ASP  73   8.820  -9.264  -5.822
  535    H    GLU  74           HN       GLU  74   7.075  -5.683  -6.119
  536    HA   GLU  74           HA       GLU  74   8.973  -3.592  -6.602
  537    HB2  GLU  74           HB2      GLU  74   6.009  -3.785  -6.940
  538    HB3  GLU  74           HB1      GLU  74   6.812  -2.236  -7.044
  539    HG2  GLU  74           HG2      GLU  74   7.516  -4.610  -8.727
  540    HG3  GLU  74           HG1      GLU  74   6.480  -3.277  -9.239
  541    H    VAL  75           HN       VAL  75   6.430  -4.167  -4.300
  542    HA   VAL  75           HA       VAL  75   6.437  -1.624  -3.185
  543    HB   VAL  75           HB       VAL  75   5.687  -4.214  -1.785
  544   HG11  VAL  75          HG11      VAL  75   6.039  -2.379  -0.197
  545   HG12  VAL  75          HG12      VAL  75   4.333  -2.816  -0.305
  546   HG13  VAL  75          HG13      VAL  75   4.924  -1.369  -1.118
  547   HG21  VAL  75          HG21      VAL  75   3.387  -3.635  -2.415
  548   HG22  VAL  75          HG22      VAL  75   4.417  -3.869  -3.830
  549   HG23  VAL  75          HG23      VAL  75   3.991  -2.237  -3.306
  550    H    LYS  76           HN       LYS  76   8.311  -4.496  -2.378
  551    HA   LYS  76           HA       LYS  76   9.584  -3.430  -0.089
  552    HB2  LYS  76           HB2      LYS  76   9.506  -5.863  -0.693
  553    HB3  LYS  76           HB1      LYS  76  10.665  -5.536  -1.968
  554    HG2  LYS  76           HG2      LYS  76  12.310  -4.825  -0.321
  555    HG3  LYS  76           HG1      LYS  76  11.163  -5.125   0.984
  556    HD2  LYS  76           HD2      LYS  76  12.662  -6.988   0.861
  557    HD3  LYS  76           HD1      LYS  76  11.101  -7.523   0.248
  558    HE2  LYS  76           HE2      LYS  76  11.905  -7.206  -2.053
  559    HE3  LYS  76           HE1      LYS  76  13.466  -6.681  -1.429
  560    HZ1  LYS  76           HZ1      LYS  76  12.250  -9.355  -1.048
  561    HZ2  LYS  76           HZ2      LYS  76  13.776  -8.897  -0.475
  562    HZ3  LYS  76           HZ3      LYS  76  13.476  -8.984  -2.133
  563    H    ALA  77           HN       ALA  77  10.543  -3.490  -3.507
  564    HA   ALA  77           HA       ALA  77  13.101  -2.298  -3.085
  565    HB1  ALA  77           HB1      ALA  77  13.196  -2.100  -5.513
  566    HB2  ALA  77           HB2      ALA  77  11.474  -2.450  -5.623
  567    HB3  ALA  77           HB3      ALA  77  12.591  -3.687  -5.045
  568    H    LYS  78           HN       LYS  78   9.935  -1.023  -3.882
  569    HA   LYS  78           HA       LYS  78  10.914   1.688  -4.180
  570    HB2  LYS  78           HB2      LYS  78   8.109   0.560  -3.987
  571    HB3  LYS  78           HB1      LYS  78   8.477   2.257  -4.305
  572    HG2  LYS  78           HG2      LYS  78   9.341  -0.045  -6.052
  573    HG3  LYS  78           HG1      LYS  78   7.870   0.899  -6.306
  574    HD2  LYS  78           HD2      LYS  78   9.139   2.889  -6.706
  575    HD3  LYS  78           HD1      LYS  78  10.634   2.103  -6.207
  576    HE2  LYS  78           HE2      LYS  78  10.409   2.351  -8.670
  577    HE3  LYS  78           HE1      LYS  78  10.619   0.692  -8.137
  578    HZ1  LYS  78           HZ1      LYS  78   8.389   0.188  -8.633
  579    HZ2  LYS  78           HZ2      LYS  78   8.914   1.132  -9.905
  580    HZ3  LYS  78           HZ3      LYS  78   7.930   1.819  -8.731
  581    H    LEU  79           HN       LEU  79   9.890  -0.296  -1.556
  582    HA   LEU  79           HA       LEU  79   9.369   1.832   0.219
  583    HB2  LEU  79           HB2      LEU  79   8.705  -0.620   0.666
  584    HB3  LEU  79           HB1      LEU  79  10.396  -0.919   0.927
  585    HG   LEU  79           HG       LEU  79  10.320   0.720   2.823
  586   HD11  LEU  79          HD11      LEU  79   7.351   0.501   2.388
  587   HD12  LEU  79          HD12      LEU  79   8.303   1.987   2.400
  588   HD13  LEU  79          HD13      LEU  79   8.093   1.060   3.867
  589   HD21  LEU  79          HD21      LEU  79   9.296  -0.913   4.369
  590   HD22  LEU  79          HD22      LEU  79  10.394  -1.653   3.209
  591   HD23  LEU  79          HD23      LEU  79   8.653  -1.785   2.974
  592    H    VAL  80           HN       VAL  80  12.193  -0.174  -0.467
  593    HA   VAL  80           HA       VAL  80  13.799   1.044   1.479
  594    HB   VAL  80           HB       VAL  80  15.765  -0.026   0.404
  595   HG11  VAL  80          HG11      VAL  80  15.066  -2.341   0.740
  596   HG12  VAL  80          HG12      VAL  80  13.382  -1.802   0.771
  597   HG13  VAL  80          HG13      VAL  80  14.505  -1.264   2.019
  598   HG21  VAL  80          HG21      VAL  80  13.745  -0.824  -1.611
  599   HG22  VAL  80          HG22      VAL  80  15.344  -1.585  -1.477
  600   HG23  VAL  80          HG23      VAL  80  15.197   0.127  -1.904
  601    H    LYS  81           HN       LYS  81  13.127   2.056  -1.773
  602    HA   LYS  81           HA       LYS  81  15.379   3.842  -1.825
  603    HB2  LYS  81           HB2      LYS  81  14.574   4.707  -3.884
  604    HB3  LYS  81           HB1      LYS  81  14.110   3.014  -3.917
  605    HG2  LYS  81           HG2      LYS  81  11.854   3.562  -3.335
  606    HG3  LYS  81           HG1      LYS  81  12.285   5.245  -3.082
  607    HD2  LYS  81           HD2      LYS  81  12.970   5.289  -5.529
  608    HD3  LYS  81           HD1      LYS  81  12.153   3.730  -5.683
  609    HE2  LYS  81           HE2      LYS  81  10.570   5.410  -6.305
  610    HE3  LYS  81           HE1      LYS  81  10.100   4.797  -4.728
  611    HZ1  LYS  81           HZ1      LYS  81  11.345   6.799  -3.771
  612    HZ2  LYS  81           HZ2      LYS  81   9.919   7.123  -4.537
  613    HZ3  LYS  81           HZ3      LYS  81  11.373   7.417  -5.336
  614    H    ILE  82           HN       ILE  82  12.095   4.000  -0.618
  615    HA   ILE  82           HA       ILE  82  12.241   6.868  -0.376
  616    HB   ILE  82           HB       ILE  82   9.912   6.860   0.376
  617   HG12  ILE  82          HG12      ILE  82   8.648   4.568   0.197
  618   HG13  ILE  82          HG11      ILE  82  10.225   3.863   0.514
  619   HG21  ILE  82          HG21      ILE  82   8.839   5.943  -1.605
  620   HG22  ILE  82          HG22      ILE  82  10.281   5.012  -1.965
  621   HG23  ILE  82          HG23      ILE  82  10.338   6.777  -2.006
  622   HD11  ILE  82          HD11      ILE  82   8.724   5.754   2.295
  623   HD12  ILE  82          HD12      ILE  82  10.309   5.054   2.649
  624   HD13  ILE  82          HD13      ILE  82   8.883   4.015   2.526
  625    H    ALA  83           HN       ALA  83  13.025   4.220   1.457
  626    HA   ALA  83           HA       ALA  83  12.805   5.467   4.034
  627    HB1  ALA  83           HB1      ALA  83  14.030   3.510   4.854
  628    HB2  ALA  83           HB2      ALA  83  14.374   3.026   3.196
  629    HB3  ALA  83           HB3      ALA  83  12.711   3.024   3.787
  630    H    GLY  84           HN       GLY  84  15.133   5.362   1.498
  631    HA2  GLY  84           HA2      GLY  84  16.746   7.176   1.453
  632    HA3  GLY  84           HA1      GLY  84  16.988   6.905   3.177
  633    H    LEU  85           HN       LEU  85  19.245   6.611   2.735
  634    HA   LEU  85           HA       LEU  85  19.875   4.210   1.234
  635    HB2  LEU  85           HB2      LEU  85  21.710   6.320   2.374
  636    HB3  LEU  85           HB1      LEU  85  22.241   4.915   1.472
  637    HG   LEU  85           HG       LEU  85  20.552   7.176   0.388
  638   HD11  LEU  85          HD11      LEU  85  22.845   7.846   0.770
  639   HD12  LEU  85          HD12      LEU  85  22.527   7.700  -0.956
  640   HD13  LEU  85          HD13      LEU  85  23.430   6.437  -0.116
  641   HD21  LEU  85          HD21      LEU  85  19.984   5.069  -0.694
  642   HD22  LEU  85          HD22      LEU  85  21.693   4.741  -0.989
  643   HD23  LEU  85          HD23      LEU  85  20.904   6.096  -1.795
  644    H    GLU  86           HN       GLU  86  18.935   2.850   2.767
  645    HA   GLU  86           HA       GLU  86  20.529   2.482   5.195
  646    HB2  GLU  86           HB2      GLU  86  18.044   2.640   5.466
  647    HB3  GLU  86           HB1      GLU  86  17.872   1.225   4.441
  648    HG2  GLU  86           HG2      GLU  86  19.029  -0.135   6.041
  649    HG3  GLU  86           HG1      GLU  86  19.363   1.266   7.048
  650    H    HIS  87           HN       HIS  87  19.042   0.710   2.552
  651    HA   HIS  87           HA       HIS  87  21.013  -1.394   2.812
  652    HB2  HIS  87           HB2      HIS  87  18.591  -1.125   1.009
  653    HB3  HIS  87           HB1      HIS  87  19.723  -2.462   0.912
  654    HD1  HIS  87           HD1      HIS  87  19.140  -4.448   2.310
  655    HD2  HIS  87           HD2      HIS  87  17.246  -0.990   3.613
  656    HE1  HIS  87           HE1      HIS  87  17.532  -5.168   4.116
  657    H    HIS  88           HN       HIS  88  22.735  -0.018   2.285
  658    HA   HIS  88           HA       HIS  88  23.139   0.222  -0.556
  659    HB2  HIS  88           HB2      HIS  88  22.158   2.400   0.167
  660    HB3  HIS  88           HB1      HIS  88  23.456   2.573   1.337
  661    HD1  HIS  88           HD1      HIS  88  25.135   4.207   0.502
  662    HD2  HIS  88           HD2      HIS  88  23.445   2.002  -2.582
  663    HE1  HIS  88           HE1      HIS  88  26.174   5.053  -1.612
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1   1.736   5.686  16.309
    2    H2   MET   1           HT2      MET   1   2.665   5.040  15.057
    3    H3   MET   1           HT3      MET   1   3.356   5.319  16.551
    4    HA   MET   1           HA       MET   1   2.035   3.670  17.617
    5    HB2  MET   1           HB2      MET   1   1.018   3.070  14.823
    6    HB3  MET   1           HB1      MET   1   0.679   2.127  16.259
    7    HG2  MET   1           HG2      MET   1  -0.538   4.018  17.219
    8    HG3  MET   1           HG1      MET   1  -0.194   4.961  15.772
    9    HE1  MET   1           HE1      MET   1  -0.516   2.768  13.460
   10    HE2  MET   1           HE2      MET   1  -1.169   4.403  13.366
   11    HE3  MET   1           HE3      MET   1  -2.205   3.018  13.024
   12    H    VAL   2           HN       VAL   2   3.107   3.150  14.251
   13    HA   VAL   2           HA       VAL   2   5.379   1.683  15.244
   14    HB   VAL   2           HB       VAL   2   3.604  -0.004  14.740
   15   HG11  VAL   2          HG11      VAL   2   2.816  -0.372  12.448
   16   HG12  VAL   2          HG12      VAL   2   3.650   1.098  11.941
   17   HG13  VAL   2          HG13      VAL   2   2.318   1.196  13.090
   18   HG21  VAL   2          HG21      VAL   2   5.907  -0.664  14.405
   19   HG22  VAL   2          HG22      VAL   2   5.884  -0.027  12.762
   20   HG23  VAL   2          HG23      VAL   2   4.890  -1.424  13.182
   21    H    THR   3           HN       THR   3   7.160   1.885  13.715
   22    HA   THR   3           HA       THR   3   6.979   4.197  12.108
   23    HB   THR   3           HB       THR   3   9.326   3.455  11.355
   24    HG1  THR   3           HG1      THR   3   9.706   1.460  11.803
   25   HG21  THR   3          HG21      THR   3  10.334   4.083  13.513
   26   HG22  THR   3          HG22      THR   3   8.784   3.817  14.309
   27   HG23  THR   3          HG23      THR   3   8.954   5.114  13.128
   28    H    ALA   4           HN       ALA   4   5.556   4.011  10.529
   29    HA   ALA   4           HA       ALA   4   5.974   1.909   8.529
   30    HB1  ALA   4           HB1      ALA   4   3.577   2.046   8.042
   31    HB2  ALA   4           HB2      ALA   4   3.391   3.258   9.313
   32    HB3  ALA   4           HB3      ALA   4   3.865   1.610   9.727
   33    H    ALA   5           HN       ALA   5   6.544   2.625   6.625
   34    HA   ALA   5           HA       ALA   5   6.323   5.494   6.079
   35    HB1  ALA   5           HB1      ALA   5   8.115   3.420   4.817
   36    HB2  ALA   5           HB2      ALA   5   8.593   4.563   6.070
   37    HB3  ALA   5           HB3      ALA   5   8.136   5.147   4.470
   38    H    LEU   6           HN       LEU   6   4.589   2.841   5.500
   39    HA   LEU   6           HA       LEU   6   4.027   3.585   2.714
   40    HB2  LEU   6           HB2      LEU   6   5.024   1.262   3.239
   41    HB3  LEU   6           HB1      LEU   6   3.438   0.907   3.910
   42    HG   LEU   6           HG       LEU   6   2.447   1.401   1.739
   43   HD11  LEU   6          HD11      LEU   6   5.334   1.639   0.939
   44   HD12  LEU   6          HD12      LEU   6   4.097   2.900   0.845
   45   HD13  LEU   6          HD13      LEU   6   3.993   1.481  -0.184
   46   HD21  LEU   6          HD21      LEU   6   4.617  -0.686   1.765
   47   HD22  LEU   6          HD22      LEU   6   3.242  -0.641   0.661
   48   HD23  LEU   6          HD23      LEU   6   2.977  -0.886   2.387
   49    H    THR   7           HN       THR   7   1.907   4.043   2.203
   50    HA   THR   7           HA       THR   7  -0.069   3.837   4.372
   51    HB   THR   7           HB       THR   7  -0.137   5.609   1.921
   52    HG1  THR   7           HG1      THR   7   1.452   5.805   3.989
   53   HG21  THR   7          HG21      THR   7  -1.802   6.883   3.210
   54   HG22  THR   7          HG22      THR   7  -1.655   5.728   4.531
   55   HG23  THR   7          HG23      THR   7  -2.309   5.212   2.978
   56    H    ILE   8           HN       ILE   8  -1.520   2.198   3.997
   57    HA   ILE   8           HA       ILE   8  -2.150   1.550   1.190
   58    HB   ILE   8           HB       ILE   8  -1.995  -0.393   3.526
   59   HG12  ILE   8          HG12      ILE   8  -0.357  -0.161   1.003
   60   HG13  ILE   8          HG11      ILE   8   0.190   0.172   2.642
   61   HG21  ILE   8          HG21      ILE   8  -2.584  -2.176   1.960
   62   HG22  ILE   8          HG22      ILE   8  -2.789  -1.006   0.661
   63   HG23  ILE   8          HG23      ILE   8  -3.861  -0.965   2.067
   64   HD11  ILE   8          HD11      ILE   8   0.996  -1.977   1.872
   65   HD12  ILE   8          HD12      ILE   8  -0.654  -2.498   1.551
   66   HD13  ILE   8          HD13      ILE   8  -0.135  -2.192   3.208
   67    H    TYR   9           HN       TYR   9  -4.271   1.203   0.695
   68    HA   TYR   9           HA       TYR   9  -6.171   2.068   2.731
   69    HB2  TYR   9           HB2      TYR   9  -6.466   1.832  -0.280
   70    HB3  TYR   9           HB1      TYR   9  -7.666   2.510   0.818
   71    HD1  TYR   9           HD1      TYR   9  -7.235   4.661   1.948
   72    HD2  TYR   9           HD2      TYR   9  -4.533   3.128  -0.951
   73    HE1  TYR   9           HE1      TYR   9  -6.192   6.880   1.752
   74    HE2  TYR   9           HE2      TYR   9  -3.474   5.343  -1.141
   75    HH   TYR   9           HH       TYR   9  -4.092   7.655  -0.775
   76    H    THR  10           HN       THR  10  -7.613   0.607   3.618
   77    HA   THR  10           HA       THR  10  -7.822  -1.981   2.297
   78    HB   THR  10           HB       THR  10  -7.626  -3.007   4.588
   79    HG1  THR  10           HG1      THR  10  -6.618  -1.792   6.160
   80   HG21  THR  10          HG21      THR  10  -5.188  -1.627   3.464
   81   HG22  THR  10          HG22      THR  10  -5.821  -3.189   2.928
   82   HG23  THR  10          HG23      THR  10  -5.164  -3.007   4.557
   83    H    THR  11           HN       THR  11  -9.368  -3.402   3.646
   84    HA   THR  11           HA       THR  11 -11.520  -2.011   4.987
   85    HB   THR  11           HB       THR  11 -12.092  -4.176   2.919
   86    HG1  THR  11           HG1      THR  11 -11.418  -1.541   2.546
   87   HG21  THR  11          HG21      THR  11 -13.753  -1.949   4.088
   88   HG22  THR  11          HG22      THR  11 -13.806  -3.641   4.595
   89   HG23  THR  11          HG23      THR  11 -14.323  -3.183   2.967
   90    H    SER  12           HN       SER  12 -12.425  -3.523   6.552
   91    HA   SER  12           HA       SER  12 -10.602  -5.410   7.538
   92    HB2  SER  12           HB2      SER  12 -13.577  -5.289   8.086
   93    HB3  SER  12           HB1      SER  12 -12.339  -5.974   9.141
   94    HG   SER  12           HG       SER  12 -12.760  -3.272   8.406
   95    H    TRP  13           HN       TRP  13 -13.534  -5.786   5.583
   96    HA   TRP  13           HA       TRP  13 -12.938  -8.588   5.326
   97    HB2  TRP  13           HB2      TRP  13 -15.106  -8.743   4.137
   98    HB3  TRP  13           HB1      TRP  13 -15.242  -8.193   5.812
   99    HD1  TRP  13           HD1      TRP  13 -16.022  -7.288   2.261
  100    HE1  TRP  13           HE1      TRP  13 -17.277  -5.107   2.168
  101    HE3  TRP  13           HE3      TRP  13 -15.474  -5.864   7.128
  102    HZ2  TRP  13           HZ2      TRP  13 -17.996  -2.994   3.930
  103    HZ3  TRP  13           HZ3      TRP  13 -16.488  -3.742   7.849
  104    HH2  TRP  13           HH2      TRP  13 -17.721  -2.340   6.290
  105    H    CYS  14           HN       CYS  14 -11.199  -8.699   4.096
  106    HA   CYS  14           HA       CYS  14 -11.704  -8.575   1.291
  107    HB2  CYS  14           HB2      CYS  14 -11.062  -6.218   1.708
  108    HB3  CYS  14           HB1      CYS  14  -9.555  -6.762   2.431
  109    H    GLY  15           HN       GLY  15 -10.887 -10.440   0.657
  110    HA2  GLY  15           HA2      GLY  15  -8.741 -11.691   2.162
  111    HA3  GLY  15           HA1      GLY  15  -9.666 -12.412   0.850
  112    H    TYR  16           HN       TYR  16  -9.294 -10.169  -0.907
  113    HA   TYR  16           HA       TYR  16  -6.925 -11.036  -2.213
  114    HB2  TYR  16           HB2      TYR  16  -9.054 -10.060  -3.216
  115    HB3  TYR  16           HB1      TYR  16  -8.424  -8.484  -2.750
  116    HD1  TYR  16           HD1      TYR  16  -7.726 -11.478  -4.761
  117    HD2  TYR  16           HD2      TYR  16  -6.885  -7.360  -4.178
  118    HE1  TYR  16           HE1      TYR  16  -6.533 -11.441  -6.887
  119    HE2  TYR  16           HE2      TYR  16  -5.674  -7.303  -6.327
  120    HH   TYR  16           HH       TYR  16  -5.969  -9.818  -8.559
  121    H    CYS  17           HN       CYS  17  -7.704  -8.495  -0.032
  122    HA   CYS  17           HA       CYS  17  -5.427  -6.897  -0.430
  123    HB2  CYS  17           HB2      CYS  17  -7.235  -7.144   1.975
  124    HB3  CYS  17           HB1      CYS  17  -6.073  -5.841   1.702
  125    H    LEU  18           HN       LEU  18  -6.161  -9.748   1.466
  126    HA   LEU  18           HA       LEU  18  -4.024  -9.600   3.320
  127    HB2  LEU  18           HB2      LEU  18  -5.630 -11.955   2.397
  128    HB3  LEU  18           HB1      LEU  18  -4.563 -11.924   3.789
  129    HG   LEU  18           HG       LEU  18  -7.096 -10.325   3.455
  130   HD11  LEU  18          HD11      LEU  18  -7.888 -11.709   5.269
  131   HD12  LEU  18          HD12      LEU  18  -6.332 -12.561   5.238
  132   HD13  LEU  18          HD13      LEU  18  -7.424 -12.675   3.851
  133   HD21  LEU  18          HD21      LEU  18  -5.478  -9.041   4.723
  134   HD22  LEU  18          HD22      LEU  18  -5.142 -10.435   5.753
  135   HD23  LEU  18          HD23      LEU  18  -6.725  -9.663   5.804
  136    H    ARG  19           HN       ARG  19  -4.488 -10.857   0.144
  137    HA   ARG  19           HA       ARG  19  -2.299 -12.533  -0.220
  138    HB2  ARG  19           HB2      ARG  19  -4.162 -12.216  -1.823
  139    HB3  ARG  19           HB1      ARG  19  -3.582 -10.602  -2.171
  140    HG2  ARG  19           HG2      ARG  19  -2.954 -12.031  -3.968
  141    HG3  ARG  19           HG1      ARG  19  -1.493 -11.629  -3.066
  142    HD2  ARG  19           HD2      ARG  19  -1.588 -13.792  -1.940
  143    HD3  ARG  19           HD1      ARG  19  -3.085 -14.173  -2.795
  144    HE   ARG  19           HE       ARG  19  -1.037 -13.514  -4.615
  145   HH11  ARG  19          HH11      ARG  19  -1.996 -16.171  -2.469
  146   HH12  ARG  19          HH12      ARG  19  -1.379 -17.392  -3.472
  147   HH21  ARG  19          HH21      ARG  19  -0.157 -15.209  -5.985
  148   HH22  ARG  19          HH22      ARG  19  -0.292 -16.830  -5.497
  149    H    LEU  20           HN       LEU  20  -2.593  -9.023  -0.593
  150    HA   LEU  20           HA       LEU  20   0.149  -8.731  -1.232
  151    HB2  LEU  20           HB2      LEU  20  -1.441  -7.165  -2.172
  152    HB3  LEU  20           HB1      LEU  20  -1.985  -6.699  -0.580
  153    HG   LEU  20           HG       LEU  20   0.361  -5.721  -0.244
  154   HD11  LEU  20          HD11      LEU  20   0.504  -6.093  -3.229
  155   HD12  LEU  20          HD12      LEU  20   1.713  -6.609  -2.020
  156   HD13  LEU  20          HD13      LEU  20   1.430  -4.926  -2.332
  157   HD21  LEU  20          HD21      LEU  20  -1.511  -4.544  -2.280
  158   HD22  LEU  20          HD22      LEU  20  -0.259  -3.642  -1.436
  159   HD23  LEU  20          HD23      LEU  20  -1.606  -4.345  -0.533
  160    H    LYS  21           HN       LYS  21  -1.849  -8.194   1.639
  161    HA   LYS  21           HA       LYS  21   0.028  -6.940   3.281
  162    HB2  LYS  21           HB2      LYS  21  -2.274  -8.735   4.010
  163    HB3  LYS  21           HB1      LYS  21  -1.252  -7.994   5.225
  164    HG2  LYS  21           HG2      LYS  21  -1.873  -5.764   4.312
  165    HG3  LYS  21           HG1      LYS  21  -3.002  -6.574   3.220
  166    HD2  LYS  21           HD2      LYS  21  -4.266  -7.446   5.073
  167    HD3  LYS  21           HD1      LYS  21  -3.058  -6.872   6.219
  168    HE2  LYS  21           HE2      LYS  21  -3.587  -4.552   5.569
  169    HE3  LYS  21           HE1      LYS  21  -4.825  -5.164   4.476
  170    HZ1  LYS  21           HZ1      LYS  21  -4.829  -5.677   7.395
  171    HZ2  LYS  21           HZ2      LYS  21  -6.106  -5.946   6.328
  172    HZ3  LYS  21           HZ3      LYS  21  -5.609  -4.372   6.706
  173    H    THR  22           HN       THR  22  -0.536 -10.418   2.883
  174    HA   THR  22           HA       THR  22   1.325 -11.271   4.789
  175    HB   THR  22           HB       THR  22   0.533 -12.740   2.250
  176    HG1  THR  22           HG1      THR  22  -1.388 -12.464   3.093
  177   HG21  THR  22          HG21      THR  22   2.343 -13.791   3.553
  178   HG22  THR  22          HG22      THR  22   0.863 -14.749   3.640
  179   HG23  THR  22          HG23      THR  22   1.334 -13.732   4.998
  180    H    ALA  23           HN       ALA  23   1.590 -10.453   1.391
  181    HA   ALA  23           HA       ALA  23   4.265 -11.350   0.929
  182    HB1  ALA  23           HB1      ALA  23   4.092 -10.076  -1.119
  183    HB2  ALA  23           HB2      ALA  23   2.661  -9.241  -0.505
  184    HB3  ALA  23           HB3      ALA  23   2.590 -10.967  -0.853
  185    H    LEU  24           HN       LEU  24   2.907  -8.229   1.783
  186    HA   LEU  24           HA       LEU  24   5.413  -6.914   1.664
  187    HB2  LEU  24           HB2      LEU  24   2.917  -6.093   3.118
  188    HB3  LEU  24           HB1      LEU  24   4.279  -5.048   2.793
  189    HG   LEU  24           HG       LEU  24   2.353  -6.220   0.816
  190   HD11  LEU  24          HD11      LEU  24   1.535  -4.310   1.994
  191   HD12  LEU  24          HD12      LEU  24   1.925  -3.859   0.329
  192   HD13  LEU  24          HD13      LEU  24   3.012  -3.420   1.640
  193   HD21  LEU  24          HD21      LEU  24   4.818  -4.583   0.260
  194   HD22  LEU  24          HD22      LEU  24   3.598  -5.045  -0.927
  195   HD23  LEU  24          HD23      LEU  24   4.596  -6.284  -0.163
  196    H    THR  25           HN       THR  25   3.574  -8.292   4.353
  197    HA   THR  25           HA       THR  25   5.458  -7.492   6.291
  198    HB   THR  25           HB       THR  25   3.425  -9.747   6.412
  199    HG1  THR  25           HG1      THR  25   2.163  -8.031   6.180
  200   HG21  THR  25          HG21      THR  25   3.503  -9.386   8.850
  201   HG22  THR  25          HG22      THR  25   4.738  -8.148   8.632
  202   HG23  THR  25          HG23      THR  25   5.099  -9.826   8.246
  203    H    ALA  26           HN       ALA  26   5.384 -10.136   4.039
  204    HA   ALA  26           HA       ALA  26   7.439 -11.680   5.356
  205    HB1  ALA  26           HB1      ALA  26   6.336 -11.872   2.554
  206    HB2  ALA  26           HB2      ALA  26   5.748 -12.764   3.953
  207    HB3  ALA  26           HB3      ALA  26   7.378 -13.055   3.340
  208    H    ASN  27           HN       ASN  27   7.338  -8.930   3.464
  209    HA   ASN  27           HA       ASN  27  10.090  -9.266   2.487
  210    HB2  ASN  27           HB2      ASN  27   7.693  -7.920   1.437
  211    HB3  ASN  27           HB1      ASN  27   9.230  -7.073   1.151
  212   HD21  ASN  27          HD21      ASN  27   7.200  -9.734   0.423
  213   HD22  ASN  27          HD22      ASN  27   8.158 -10.357  -0.887
  214    H    ARG  28           HN       ARG  28   8.878  -8.330   5.119
  215    HA   ARG  28           HA       ARG  28   9.151  -6.809   6.746
  216    HB2  ARG  28           HB2      ARG  28  11.497  -7.580   6.519
  217    HB3  ARG  28           HB1      ARG  28  11.810  -6.252   5.402
  218    HG2  ARG  28           HG2      ARG  28  11.267  -4.661   7.221
  219    HG3  ARG  28           HG1      ARG  28  11.061  -6.025   8.315
  220    HD2  ARG  28           HD2      ARG  28  13.590  -5.259   6.864
  221    HD3  ARG  28           HD1      ARG  28  13.260  -5.034   8.581
  222    HE   ARG  28           HE       ARG  28  13.258  -7.717   7.405
  223   HH11  ARG  28          HH11      ARG  28  14.799  -5.368   9.561
  224   HH12  ARG  28          HH12      ARG  28  15.671  -6.510  10.451
  225   HH21  ARG  28          HH21      ARG  28  14.530  -9.316   8.584
  226   HH22  ARG  28          HH22      ARG  28  15.511  -8.821   9.886
  227    H    ILE  29           HN       ILE  29   7.420  -5.791   5.391
  228    HA   ILE  29           HA       ILE  29   8.215  -3.029   4.911
  229    HB   ILE  29           HB       ILE  29   6.039  -4.629   3.555
  230   HG12  ILE  29          HG12      ILE  29   8.582  -3.389   2.444
  231   HG13  ILE  29          HG11      ILE  29   8.314  -5.095   2.741
  232   HG21  ILE  29          HG21      ILE  29   5.267  -2.375   3.948
  233   HG22  ILE  29          HG22      ILE  29   5.626  -2.566   2.228
  234   HG23  ILE  29          HG23      ILE  29   6.751  -1.703   3.289
  235   HD11  ILE  29          HD11      ILE  29   6.593  -5.142   1.060
  236   HD12  ILE  29          HD12      ILE  29   8.103  -4.529   0.391
  237   HD13  ILE  29          HD13      ILE  29   6.789  -3.412   0.780
  238    H    ALA  30           HN       ALA  30   7.513  -1.824   6.495
  239    HA   ALA  30           HA       ALA  30   5.244  -2.626   8.083
  240    HB1  ALA  30           HB1      ALA  30   7.085  -0.259   8.265
  241    HB2  ALA  30           HB2      ALA  30   7.233  -1.762   9.181
  242    HB3  ALA  30           HB3      ALA  30   5.855  -0.685   9.457
  243    H    TYR  31           HN       TYR  31   3.328  -2.119   7.384
  244    HA   TYR  31           HA       TYR  31   3.003   0.339   5.852
  245    HB2  TYR  31           HB2      TYR  31   1.088  -0.797   4.712
  246    HB3  TYR  31           HB1      TYR  31   2.670  -1.480   4.357
  247    HD1  TYR  31           HD2      TYR  31  -0.515  -2.059   6.168
  248    HD2  TYR  31           HD1      TYR  31   3.201  -3.726   4.943
  249    HE1  TYR  31           HE2      TYR  31  -1.307  -4.297   6.822
  250    HE2  TYR  31           HE1      TYR  31   2.418  -5.958   5.584
  251    HH   TYR  31           HH       TYR  31  -0.869  -6.576   6.506
  252    H    ASP  32           HN       ASP  32   1.302   1.611   6.228
  253    HA   ASP  32           HA       ASP  32  -0.286   1.002   8.601
  254    HB2  ASP  32           HB2      ASP  32   1.178   2.918   8.939
  255    HB3  ASP  32           HB1      ASP  32   0.626   3.639   7.434
  256    H    GLU  33           HN       GLU  33  -2.342   0.646   8.170
  257    HA   GLU  33           HA       GLU  33  -3.261   1.298   5.504
  258    HB2  GLU  33           HB2      GLU  33  -5.042  -0.370   5.925
  259    HB3  GLU  33           HB1      GLU  33  -3.422  -1.025   6.010
  260    HG2  GLU  33           HG2      GLU  33  -3.599  -0.836   8.509
  261    HG3  GLU  33           HG1      GLU  33  -5.303  -0.448   8.272
  262    H    VAL  34           HN       VAL  34  -5.276   2.207   5.152
  263    HA   VAL  34           HA       VAL  34  -5.816   4.286   7.133
  264    HB   VAL  34           HB       VAL  34  -6.664   4.234   4.228
  265   HG11  VAL  34          HG11      VAL  34  -6.501   6.527   6.158
  266   HG12  VAL  34          HG12      VAL  34  -7.971   5.722   5.603
  267   HG13  VAL  34          HG13      VAL  34  -6.970   6.606   4.451
  268   HG21  VAL  34          HG21      VAL  34  -4.260   5.538   5.483
  269   HG22  VAL  34          HG22      VAL  34  -4.779   5.720   3.807
  270   HG23  VAL  34          HG23      VAL  34  -4.242   4.148   4.399
  271    H    ASP  35           HN       ASP  35  -7.697   4.856   7.845
  272    HA   ASP  35           HA       ASP  35  -9.702   3.101   8.592
  273    HB2  ASP  35           HB2      ASP  35  -9.945   6.103   8.456
  274    HB3  ASP  35           HB1      ASP  35 -10.810   5.015   9.518
  275    H    ILE  36           HN       ILE  36  -9.387   4.144   5.512
  276    HA   ILE  36           HA       ILE  36 -11.628   5.487   4.660
  277    HB   ILE  36           HB       ILE  36 -11.284   4.609   2.390
  278   HG12  ILE  36          HG12      ILE  36  -8.862   3.288   2.529
  279   HG13  ILE  36          HG11      ILE  36  -9.801   2.557   3.814
  280   HG21  ILE  36          HG21      ILE  36  -8.779   5.426   3.797
  281   HG22  ILE  36          HG22      ILE  36 -10.046   6.493   3.190
  282   HG23  ILE  36          HG23      ILE  36  -9.088   5.542   2.064
  283   HD11  ILE  36          HD11      ILE  36 -10.694   2.736   0.930
  284   HD12  ILE  36          HD12      ILE  36 -11.621   2.044   2.254
  285   HD13  ILE  36          HD13      ILE  36 -10.114   1.284   1.749
  286    H    GLU  37           HN       GLU  37 -11.666   2.175   5.566
  287    HA   GLU  37           HA       GLU  37 -13.914   1.196   4.265
  288    HB2  GLU  37           HB2      GLU  37 -12.562  -0.155   5.770
  289    HB3  GLU  37           HB1      GLU  37 -13.055   0.838   7.135
  290    HG2  GLU  37           HG2      GLU  37 -15.391   0.111   6.745
  291    HG3  GLU  37           HG1      GLU  37 -14.809  -0.996   5.508
  292    H    HIS  38           HN       HIS  38 -13.718   3.112   7.242
  293    HA   HIS  38           HA       HIS  38 -16.596   3.632   7.000
  294    HB2  HIS  38           HB2      HIS  38 -16.080   2.419   9.049
  295    HB3  HIS  38           HB1      HIS  38 -14.853   3.601   9.469
  296    HD1  HIS  38           HD1      HIS  38 -15.595   5.224  11.160
  297    HD2  HIS  38           HD2      HIS  38 -18.776   3.738   8.955
  298    HE1  HIS  38           HE1      HIS  38 -17.665   6.277  12.139
  299    H    ASN  39           HN       ASN  39 -13.443   5.096   7.317
  300    HA   ASN  39           HA       ASN  39 -14.485   7.768   7.689
  301    HB2  ASN  39           HB2      ASN  39 -12.186   7.208   8.419
  302    HB3  ASN  39           HB1      ASN  39 -11.739   6.923   6.736
  303   HD21  ASN  39          HD21      ASN  39 -10.372   8.565   6.306
  304   HD22  ASN  39          HD22      ASN  39 -10.647  10.220   6.625
  305    H    ARG  40           HN       ARG  40 -15.783   8.455   6.060
  306    HA   ARG  40           HA       ARG  40 -15.209   7.675   3.397
  307    HB2  ARG  40           HB2      ARG  40 -17.040   8.998   2.609
  308    HB3  ARG  40           HB1      ARG  40 -17.540   8.245   4.109
  309    HG2  ARG  40           HG2      ARG  40 -17.426  10.266   5.287
  310    HG3  ARG  40           HG1      ARG  40 -16.507  11.058   4.000
  311    HD2  ARG  40           HD2      ARG  40 -19.380  10.127   3.841
  312    HD3  ARG  40           HD1      ARG  40 -18.830  11.795   4.027
  313    HE   ARG  40           HE       ARG  40 -17.815  10.429   1.674
  314   HH11  ARG  40          HH11      ARG  40 -20.402  12.557   2.925
  315   HH12  ARG  40          HH12      ARG  40 -20.847  13.099   1.382
  316   HH21  ARG  40          HH21      ARG  40 -18.496  11.176  -0.413
  317   HH22  ARG  40          HH22      ARG  40 -19.759  12.312  -0.536
  318    H    ALA  41           HN       ALA  41 -14.177  10.327   5.350
  319    HA   ALA  41           HA       ALA  41 -13.680  12.120   3.302
  320    HB1  ALA  41           HB1      ALA  41 -13.744  12.830   5.616
  321    HB2  ALA  41           HB2      ALA  41 -12.274  13.387   4.825
  322    HB3  ALA  41           HB3      ALA  41 -12.218  12.029   5.943
  323    H    ALA  42           HN       ALA  42 -11.544   9.653   4.490
  324    HA   ALA  42           HA       ALA  42  -9.612  10.472   2.479
  325    HB1  ALA  42           HB1      ALA  42  -8.748   9.677   4.620
  326    HB2  ALA  42           HB2      ALA  42  -8.221   8.607   3.316
  327    HB3  ALA  42           HB3      ALA  42  -9.540   8.122   4.380
  328    H    ALA  43           HN       ALA  43 -12.267   8.364   2.776
  329    HA   ALA  43           HA       ALA  43 -11.558   6.398   0.866
  330    HB1  ALA  43           HB1      ALA  43 -14.304   7.275   1.661
  331    HB2  ALA  43           HB2      ALA  43 -13.323   6.142   2.588
  332    HB3  ALA  43           HB3      ALA  43 -13.866   5.718   0.949
  333    H    GLU  44           HN       GLU  44 -13.144   9.514   0.688
  334    HA   GLU  44           HA       GLU  44 -14.061   9.348  -1.945
  335    HB2  GLU  44           HB2      GLU  44 -13.067  11.806  -0.504
  336    HB3  GLU  44           HB1      GLU  44 -14.080  11.811  -1.942
  337    HG2  GLU  44           HG2      GLU  44 -14.809  10.970   0.862
  338    HG3  GLU  44           HG1      GLU  44 -15.442  12.330  -0.051
  339    H    PHE  45           HN       PHE  45 -10.898  10.176  -0.642
  340    HA   PHE  45           HA       PHE  45  -9.726  10.982  -3.090
  341    HB2  PHE  45           HB2      PHE  45  -8.688  11.586  -0.950
  342    HB3  PHE  45           HB1      PHE  45  -8.423   9.891  -0.570
  343    HD1  PHE  45           HD2      PHE  45  -7.666  12.206  -3.414
  344    HD2  PHE  45           HD1      PHE  45  -6.226   9.194  -0.763
  345    HE1  PHE  45           HE2      PHE  45  -5.454  12.327  -4.479
  346    HE2  PHE  45           HE1      PHE  45  -3.993   9.328  -1.837
  347    HZ   PHE  45           HZ       PHE  45  -3.624  10.883  -3.690
  348    H    VAL  46           HN       VAL  46 -10.064   7.912  -1.477
  349    HA   VAL  46           HA       VAL  46  -8.477   6.330  -3.198
  350    HB   VAL  46           HB       VAL  46 -10.968   5.476  -1.691
  351   HG11  VAL  46          HG11      VAL  46  -8.625   3.878  -2.687
  352   HG12  VAL  46          HG12      VAL  46 -10.230   3.887  -3.388
  353   HG13  VAL  46          HG13      VAL  46  -9.985   3.239  -1.755
  354   HG21  VAL  46          HG21      VAL  46  -9.456   4.786   0.084
  355   HG22  VAL  46          HG22      VAL  46  -9.339   6.526  -0.210
  356   HG23  VAL  46          HG23      VAL  46  -8.093   5.439  -0.816
  357    H    GLY  47           HN       GLY  47 -11.868   7.243  -3.206
  358    HA2  GLY  47           HA2      GLY  47 -12.630   5.771  -5.507
  359    HA3  GLY  47           HA1      GLY  47 -13.506   7.116  -4.783
  360    H    SER  48           HN       SER  48 -10.952   8.721  -5.098
  361    HA   SER  48           HA       SER  48 -11.525   9.738  -7.722
  362    HB2  SER  48           HB2      SER  48  -9.384  10.558  -5.745
  363    HB3  SER  48           HB1      SER  48  -9.887  11.468  -7.167
  364    HG   SER  48           HG       SER  48 -11.799  10.770  -5.196
  365    H    VAL  49           HN       VAL  49  -8.918   7.931  -6.129
  366    HA   VAL  49           HA       VAL  49  -7.291   8.044  -8.485
  367    HB   VAL  49           HB       VAL  49  -5.638   6.671  -7.310
  368   HG11  VAL  49          HG11      VAL  49  -5.110   8.216  -5.478
  369   HG12  VAL  49          HG12      VAL  49  -6.721   8.915  -5.629
  370   HG13  VAL  49          HG13      VAL  49  -5.575   9.045  -6.964
  371   HG21  VAL  49          HG21      VAL  49  -7.643   6.560  -5.058
  372   HG22  VAL  49          HG22      VAL  49  -5.970   6.009  -4.953
  373   HG23  VAL  49          HG23      VAL  49  -7.107   5.194  -6.033
  374    H    ASN  50           HN       ASN  50  -9.409   5.680  -7.033
  375    HA   ASN  50           HA       ASN  50  -8.732   3.689  -9.030
  376    HB2  ASN  50           HB2      ASN  50 -11.041   3.776  -7.070
  377    HB3  ASN  50           HB1      ASN  50 -10.645   2.419  -8.102
  378   HD21  ASN  50          HD21      ASN  50  -7.688   2.697  -7.558
  379   HD22  ASN  50          HD22      ASN  50  -7.522   2.117  -5.951
  380    H    GLY  51           HN       GLY  51  -9.854   3.343 -10.895
  381    HA2  GLY  51           HA2      GLY  51 -11.892   5.339 -11.528
  382    HA3  GLY  51           HA1      GLY  51 -11.001   4.380 -12.702
  383    H    GLY  52           HN       GLY  52 -13.949   4.807 -12.028
  384    HA2  GLY  52           HA2      GLY  52 -15.789   3.496 -12.473
  385    HA3  GLY  52           HA1      GLY  52 -14.725   2.104 -12.623
  386    H    ASN  53           HN       ASN  53 -14.125   0.982 -10.767
  387    HA   ASN  53           HA       ASN  53 -15.767   1.567  -8.431
  388    HB2  ASN  53           HB2      ASN  53 -15.911  -0.891  -7.936
  389    HB3  ASN  53           HB1      ASN  53 -16.794  -0.372  -9.352
  390   HD21  ASN  53          HD21      ASN  53 -13.263  -0.978  -9.356
  391   HD22  ASN  53          HD22      ASN  53 -13.379  -2.383 -10.348
  392    H    ARG  54           HN       ARG  54 -15.000   1.189  -6.409
  393    HA   ARG  54           HA       ARG  54 -12.307   1.854  -6.058
  394    HB2  ARG  54           HB2      ARG  54 -14.076   2.388  -4.397
  395    HB3  ARG  54           HB1      ARG  54 -14.192   0.683  -3.987
  396    HG2  ARG  54           HG2      ARG  54 -11.861   0.723  -3.225
  397    HG3  ARG  54           HG1      ARG  54 -11.780   2.436  -3.628
  398    HD2  ARG  54           HD2      ARG  54 -12.153   2.233  -1.262
  399    HD3  ARG  54           HD1      ARG  54 -13.626   2.847  -2.005
  400    HE   ARG  54           HE       ARG  54 -13.517  -0.006  -1.683
  401   HH11  ARG  54          HH11      ARG  54 -14.607   3.046  -0.251
  402   HH12  ARG  54          HH12      ARG  54 -15.681   2.327   0.853
  403   HH21  ARG  54          HH21      ARG  54 -14.974  -1.005  -0.153
  404   HH22  ARG  54          HH22      ARG  54 -15.913  -0.058   0.888
  405    H    THR  55           HN       THR  55 -10.546   0.738  -5.795
  406    HA   THR  55           HA       THR  55 -10.648  -2.189  -5.756
  407    HB   THR  55           HB       THR  55  -8.365  -0.343  -6.551
  408    HG1  THR  55           HG1      THR  55 -10.594  -0.554  -7.770
  409   HG21  THR  55          HG21      THR  55  -7.750  -2.669  -5.965
  410   HG22  THR  55          HG22      THR  55  -7.510  -2.362  -7.685
  411   HG23  THR  55          HG23      THR  55  -8.917  -3.272  -7.142
  412    H    VAL  56           HN       VAL  56  -9.781  -3.033  -3.828
  413    HA   VAL  56           HA       VAL  56  -9.386  -1.025  -1.872
  414    HB   VAL  56           HB       VAL  56  -8.920  -3.916  -1.285
  415   HG11  VAL  56          HG11      VAL  56  -9.718  -1.559   0.417
  416   HG12  VAL  56          HG12      VAL  56  -8.087  -2.136   0.258
  417   HG13  VAL  56          HG13      VAL  56  -9.317  -3.177   1.013
  418   HG21  VAL  56          HG21      VAL  56 -11.096  -3.561  -2.236
  419   HG22  VAL  56          HG22      VAL  56 -11.312  -2.248  -1.037
  420   HG23  VAL  56          HG23      VAL  56 -11.118  -3.943  -0.489
  421    HA   PRO  57           HA       PRO  57  -5.565  -2.591  -0.999
  422    HB2  PRO  57           HB2      PRO  57  -3.760  -4.229  -2.243
  423    HB3  PRO  57           HB1      PRO  57  -5.030  -4.769  -1.148
  424    HG2  PRO  57           HG2      PRO  57  -5.152  -4.598  -4.146
  425    HG3  PRO  57           HG1      PRO  57  -5.673  -5.930  -3.090
  426    HD2  PRO  57           HD2      PRO  57  -7.411  -4.101  -4.074
  427    HD3  PRO  57           HD1      PRO  57  -7.537  -4.928  -2.474
  428    H    THR  58           HN       THR  58  -5.280  -0.485  -1.815
  429    HA   THR  58           HA       THR  58  -3.630   0.114  -4.136
  430    HB   THR  58           HB       THR  58  -5.763   1.650  -2.650
  431    HG1  THR  58           HG1      THR  58  -6.970   0.381  -3.881
  432   HG21  THR  58          HG21      THR  58  -4.298   2.344  -5.207
  433   HG22  THR  58          HG22      THR  58  -4.131   3.199  -3.664
  434   HG23  THR  58          HG23      THR  58  -5.665   3.234  -4.556
  435    H    VAL  59           HN       VAL  59  -1.773   1.200  -3.663
  436    HA   VAL  59           HA       VAL  59  -1.334   1.884  -0.846
  437    HB   VAL  59           HB       VAL  59  -0.073  -0.136  -1.514
  438   HG11  VAL  59          HG11      VAL  59   0.091   0.135  -3.820
  439   HG12  VAL  59          HG12      VAL  59   1.742   0.061  -3.161
  440   HG13  VAL  59          HG13      VAL  59   1.010   1.615  -3.621
  441   HG21  VAL  59          HG21      VAL  59   1.726   2.257  -1.159
  442   HG22  VAL  59          HG22      VAL  59   2.178   0.583  -0.877
  443   HG23  VAL  59          HG23      VAL  59   0.974   1.345   0.142
  444    H    LYS  60           HN       LYS  60  -0.280   3.741  -0.389
  445    HA   LYS  60           HA       LYS  60   0.319   5.573  -2.611
  446    HB2  LYS  60           HB2      LYS  60  -1.620   6.281  -1.177
  447    HB3  LYS  60           HB1      LYS  60  -0.575   6.212   0.219
  448    HG2  LYS  60           HG2      LYS  60   0.802   7.979  -0.862
  449    HG3  LYS  60           HG1      LYS  60  -0.453   8.095  -2.099
  450    HD2  LYS  60           HD2      LYS  60  -2.115   8.531  -0.349
  451    HD3  LYS  60           HD1      LYS  60  -0.843   8.465   0.865
  452    HE2  LYS  60           HE2      LYS  60   0.294  10.275  -0.473
  453    HE3  LYS  60           HE1      LYS  60  -1.225  10.455  -1.333
  454    HZ1  LYS  60           HZ1      LYS  60  -1.109  12.017   0.484
  455    HZ2  LYS  60           HZ2      LYS  60  -0.878  10.777   1.602
  456    HZ3  LYS  60           HZ3      LYS  60  -2.348  10.919   0.759
  457    H    PHE  61           HN       PHE  61   2.366   6.252  -2.651
  458    HA   PHE  61           HA       PHE  61   4.137   5.476  -0.434
  459    HB2  PHE  61           HB2      PHE  61   4.779   6.100  -3.332
  460    HB3  PHE  61           HB1      PHE  61   5.983   5.785  -2.098
  461    HD1  PHE  61           HD1      PHE  61   3.324   4.288  -4.148
  462    HD2  PHE  61           HD2      PHE  61   6.396   3.582  -1.291
  463    HE1  PHE  61           HE1      PHE  61   3.177   1.848  -4.557
  464    HE2  PHE  61           HE2      PHE  61   6.226   1.185  -1.704
  465    HZ   PHE  61           HZ       PHE  61   4.625   0.321  -3.354
  466    H    ALA  62           HN       ALA  62   6.138   7.028  -0.379
  467    HA   ALA  62           HA       ALA  62   5.303   9.582   0.462
  468    HB1  ALA  62           HB1      ALA  62   8.083   8.657  -0.287
  469    HB2  ALA  62           HB2      ALA  62   7.338   8.481   1.300
  470    HB3  ALA  62           HB3      ALA  62   7.695  10.088   0.669
  471    H    ASP  63           HN       ASP  63   5.910   8.348  -2.579
  472    HA   ASP  63           HA       ASP  63   6.708  10.615  -4.087
  473    HB2  ASP  63           HB2      ASP  63   6.959   8.406  -5.001
  474    HB3  ASP  63           HB1      ASP  63   5.252   8.059  -4.776
  475    H    GLY  64           HN       GLY  64   3.726   9.663  -2.636
  476    HA2  GLY  64           HA2      GLY  64   1.928  11.094  -2.296
  477    HA3  GLY  64           HA1      GLY  64   2.462  12.071  -3.654
  478    H    SER  65           HN       SER  65   2.712   9.480  -5.256
  479    HA   SER  65           HA       SER  65  -0.047   9.525  -6.073
  480    HB2  SER  65           HB2      SER  65   1.836   9.835  -7.704
  481    HB3  SER  65           HB1      SER  65   2.313   8.166  -7.408
  482    HG   SER  65           HG       SER  65  -0.290   8.882  -8.265
  483    H    THR  66           HN       THR  66  -0.971   7.355  -6.764
  484    HA   THR  66           HA       THR  66  -0.410   5.394  -4.681
  485    HB   THR  66           HB       THR  66  -2.836   4.750  -5.023
  486    HG1  THR  66           HG1      THR  66  -2.966   7.297  -6.295
  487   HG21  THR  66          HG21      THR  66  -2.122   6.070  -3.098
  488   HG22  THR  66          HG22      THR  66  -3.712   6.589  -3.653
  489   HG23  THR  66          HG23      THR  66  -2.283   7.555  -4.036
  490    H    LEU  67           HN       LEU  67  -0.200   3.325  -5.264
  491    HA   LEU  67           HA       LEU  67  -0.430   2.687  -8.109
  492    HB2  LEU  67           HB2      LEU  67   1.394   1.569  -5.993
  493    HB3  LEU  67           HB1      LEU  67   0.979   0.593  -7.380
  494    HG   LEU  67           HG       LEU  67   1.924   2.358  -8.845
  495   HD11  LEU  67          HD11      LEU  67   1.772   4.293  -7.446
  496   HD12  LEU  67          HD12      LEU  67   3.447   4.031  -7.932
  497   HD13  LEU  67          HD13      LEU  67   2.932   3.623  -6.303
  498   HD21  LEU  67          HD21      LEU  67   3.237   0.404  -8.340
  499   HD22  LEU  67          HD22      LEU  67   3.844   1.119  -6.857
  500   HD23  LEU  67          HD23      LEU  67   4.286   1.813  -8.412
  501    H    THR  68           HN       THR  68  -1.983   1.436  -8.702
  502    HA   THR  68           HA       THR  68  -3.578   0.107  -6.660
  503    HB   THR  68           HB       THR  68  -4.229   0.716  -9.561
  504    HG1  THR  68           HG1      THR  68  -3.921   2.420  -7.712
  505   HG21  THR  68          HG21      THR  68  -6.551   0.301  -8.861
  506   HG22  THR  68          HG22      THR  68  -5.997  -0.087  -7.234
  507   HG23  THR  68          HG23      THR  68  -5.551  -1.125  -8.588
  508    H    ASN  69           HN       ASN  69  -3.135  -1.960  -6.390
  509    HA   ASN  69           HA       ASN  69  -2.541  -4.098  -6.664
  510    HB2  ASN  69           HB2      ASN  69  -3.551  -3.664  -9.484
  511    HB3  ASN  69           HB1      ASN  69  -3.051  -5.230  -8.875
  512   HD21  ASN  69          HD21      ASN  69  -4.177  -4.931  -6.232
  513   HD22  ASN  69          HD22      ASN  69  -5.889  -4.959  -6.448
  514    HA   PRO  70           HA       PRO  70   1.524  -3.381  -8.743
  515    HB2  PRO  70           HB2      PRO  70   3.069  -2.582  -6.767
  516    HB3  PRO  70           HB1      PRO  70   1.911  -1.434  -7.459
  517    HG2  PRO  70           HG2      PRO  70   1.681  -3.084  -4.976
  518    HG3  PRO  70           HG1      PRO  70   1.320  -1.349  -5.180
  519    HD2  PRO  70           HD2      PRO  70  -0.569  -3.377  -5.249
  520    HD3  PRO  70           HD1      PRO  70  -0.763  -1.795  -6.036
  521    H    SER  71           HN       SER  71   3.601  -4.617  -8.174
  522    HA   SER  71           HA       SER  71   2.902  -7.127  -6.898
  523    HB2  SER  71           HB2      SER  71   5.550  -6.307  -8.068
  524    HB3  SER  71           HB1      SER  71   4.918  -7.935  -7.832
  525    HG   SER  71           HG       SER  71   4.212  -5.977  -9.694
  526    H    ALA  72           HN       ALA  72   4.101  -7.938  -5.093
  527    HA   ALA  72           HA       ALA  72   4.715  -6.113  -3.066
  528    HB1  ALA  72           HB1      ALA  72   5.573  -8.024  -1.824
  529    HB2  ALA  72           HB2      ALA  72   5.629  -8.977  -3.306
  530    HB3  ALA  72           HB3      ALA  72   4.077  -8.446  -2.658
  531    H    ASP  73           HN       ASP  73   6.780  -7.806  -5.359
  532    HA   ASP  73           HA       ASP  73   9.322  -7.101  -4.446
  533    HB2  ASP  73           HB2      ASP  73   8.390  -7.333  -7.321
  534    HB3  ASP  73           HB1      ASP  73  10.068  -7.304  -6.804
  535    H    GLU  74           HN       GLU  74   7.080  -5.380  -6.513
  536    HA   GLU  74           HA       GLU  74   8.794  -3.201  -7.102
  537    HB2  GLU  74           HB2      GLU  74   5.787  -3.402  -7.244
  538    HB3  GLU  74           HB1      GLU  74   6.741  -2.091  -7.918
  539    HG2  GLU  74           HG2      GLU  74   7.796  -3.605  -9.464
  540    HG3  GLU  74           HG1      GLU  74   6.954  -4.976  -8.750
  541    H    VAL  75           HN       VAL  75   6.185  -3.722  -4.781
  542    HA   VAL  75           HA       VAL  75   6.174  -1.156  -3.668
  543    HB   VAL  75           HB       VAL  75   5.524  -3.768  -2.257
  544   HG11  VAL  75          HG11      VAL  75   4.171  -2.407  -0.741
  545   HG12  VAL  75          HG12      VAL  75   4.714  -0.944  -1.561
  546   HG13  VAL  75          HG13      VAL  75   5.869  -1.938  -0.675
  547   HG21  VAL  75          HG21      VAL  75   4.178  -3.460  -4.256
  548   HG22  VAL  75          HG22      VAL  75   3.729  -1.842  -3.723
  549   HG23  VAL  75          HG23      VAL  75   3.193  -3.252  -2.808
  550    H    LYS  76           HN       LYS  76   8.035  -4.035  -2.808
  551    HA   LYS  76           HA       LYS  76   9.344  -2.987  -0.532
  552    HB2  LYS  76           HB2      LYS  76   9.143  -5.443  -1.494
  553    HB3  LYS  76           HB1      LYS  76  10.583  -5.020  -2.382
  554    HG2  LYS  76           HG2      LYS  76  10.377  -5.001   0.641
  555    HG3  LYS  76           HG1      LYS  76  10.980  -6.353  -0.304
  556    HD2  LYS  76           HD2      LYS  76  12.753  -4.764  -1.182
  557    HD3  LYS  76           HD1      LYS  76  12.194  -3.618   0.034
  558    HE2  LYS  76           HE2      LYS  76  13.168  -6.414   0.635
  559    HE3  LYS  76           HE1      LYS  76  14.174  -4.991   0.782
  560    HZ1  LYS  76           HZ1      LYS  76  11.676  -5.487   2.367
  561    HZ2  LYS  76           HZ2      LYS  76  12.809  -4.217   2.625
  562    HZ3  LYS  76           HZ3      LYS  76  13.238  -5.783   2.859
  563    H    ALA  77           HN       ALA  77  10.218  -3.120  -3.963
  564    HA   ALA  77           HA       ALA  77  12.737  -1.883  -3.718
  565    HB1  ALA  77           HB1      ALA  77  10.941  -2.001  -6.135
  566    HB2  ALA  77           HB2      ALA  77  12.075  -3.255  -5.637
  567    HB3  ALA  77           HB3      ALA  77  12.672  -1.668  -6.125
  568    H    LYS  78           HN       LYS  78   9.514  -0.562  -4.277
  569    HA   LYS  78           HA       LYS  78  10.445   2.144  -4.688
  570    HB2  LYS  78           HB2      LYS  78   7.725   1.165  -3.806
  571    HB3  LYS  78           HB1      LYS  78   8.085   2.799  -4.339
  572    HG2  LYS  78           HG2      LYS  78   8.218   0.314  -6.035
  573    HG3  LYS  78           HG1      LYS  78   6.855   1.423  -5.969
  574    HD2  LYS  78           HD2      LYS  78   8.332   3.217  -6.805
  575    HD3  LYS  78           HD1      LYS  78   9.644   2.041  -6.934
  576    HE2  LYS  78           HE2      LYS  78   8.336   0.710  -8.494
  577    HE3  LYS  78           HE1      LYS  78   6.978   1.817  -8.328
  578    HZ1  LYS  78           HZ1      LYS  78   9.624   2.462  -9.516
  579    HZ2  LYS  78           HZ2      LYS  78   8.362   3.558  -9.299
  580    HZ3  LYS  78           HZ3      LYS  78   8.159   2.262 -10.329
  581    H    LEU  79           HN       LEU  79   9.358   0.222  -1.936
  582    HA   LEU  79           HA       LEU  79   9.145   2.275  -0.072
  583    HB2  LEU  79           HB2      LEU  79   8.462  -0.213   0.281
  584    HB3  LEU  79           HB1      LEU  79  10.156  -0.488   0.530
  585    HG   LEU  79           HG       LEU  79  10.027   1.234   2.381
  586   HD11  LEU  79          HD11      LEU  79   7.867   2.246   2.011
  587   HD12  LEU  79          HD12      LEU  79   7.831   1.357   3.525
  588   HD13  LEU  79          HD13      LEU  79   7.098   0.663   2.092
  589   HD21  LEU  79          HD21      LEU  79   9.276  -0.472   3.996
  590   HD22  LEU  79          HD22      LEU  79  10.392  -1.111   2.787
  591   HD23  LEU  79          HD23      LEU  79   8.664  -1.426   2.646
  592    H    VAL  80           HN       VAL  80  11.824   0.112  -0.817
  593    HA   VAL  80           HA       VAL  80  13.540   1.160   1.109
  594    HB   VAL  80           HB       VAL  80  15.354  -0.004  -0.007
  595   HG11  VAL  80          HG11      VAL  80  12.810  -1.574   0.253
  596   HG12  VAL  80          HG12      VAL  80  13.955  -1.196   1.545
  597   HG13  VAL  80          HG13      VAL  80  14.436  -2.261   0.220
  598   HG21  VAL  80          HG21      VAL  80  14.819  -1.448  -1.982
  599   HG22  VAL  80          HG22      VAL  80  14.863   0.291  -2.291
  600   HG23  VAL  80          HG23      VAL  80  13.306  -0.519  -2.101
  601    H    LYS  81           HN       LYS  81  13.093   2.153  -2.216
  602    HA   LYS  81           HA       LYS  81  15.384   3.842  -2.151
  603    HB2  LYS  81           HB2      LYS  81  14.492   4.880  -4.229
  604    HB3  LYS  81           HB1      LYS  81  14.594   3.125  -4.307
  605    HG2  LYS  81           HG2      LYS  81  12.300   2.872  -4.147
  606    HG3  LYS  81           HG1      LYS  81  12.063   4.547  -3.653
  607    HD2  LYS  81           HD2      LYS  81  11.449   4.066  -6.025
  608    HD3  LYS  81           HD1      LYS  81  12.640   5.348  -5.828
  609    HE2  LYS  81           HE2      LYS  81  13.217   3.887  -7.673
  610    HE3  LYS  81           HE1      LYS  81  14.419   3.801  -6.389
  611    HZ1  LYS  81           HZ1      LYS  81  13.908   1.646  -7.296
  612    HZ2  LYS  81           HZ2      LYS  81  12.286   1.783  -6.901
  613    HZ3  LYS  81           HZ3      LYS  81  13.459   1.674  -5.682
  614    H    ILE  82           HN       ILE  82  12.015   4.288  -1.321
  615    HA   ILE  82           HA       ILE  82  12.539   7.083  -1.017
  616    HB   ILE  82           HB       ILE  82  10.180   7.406  -0.414
  617   HG12  ILE  82          HG12      ILE  82   8.599   5.353  -0.789
  618   HG13  ILE  82          HG11      ILE  82  10.021   4.382  -0.446
  619   HG21  ILE  82          HG21      ILE  82  10.778   7.401  -2.757
  620   HG22  ILE  82          HG22      ILE  82   9.163   6.731  -2.545
  621   HG23  ILE  82          HG23      ILE  82  10.525   5.660  -2.845
  622   HD11  ILE  82          HD11      ILE  82   8.722   6.364   1.410
  623   HD12  ILE  82          HD12      ILE  82  10.164   5.418   1.776
  624   HD13  ILE  82          HD13      ILE  82   8.618   4.606   1.514
  625    H    ALA  83           HN       ALA  83  12.406   4.306   1.003
  626    HA   ALA  83           HA       ALA  83  12.433   5.790   3.455
  627    HB1  ALA  83           HB1      ALA  83  12.829   3.637   4.531
  628    HB2  ALA  83           HB2      ALA  83  13.153   2.897   2.966
  629    HB3  ALA  83           HB3      ALA  83  11.538   3.496   3.335
  630    H    GLY  84           HN       GLY  84  14.894   4.130   1.483
  631    HA2  GLY  84           HA2      GLY  84  17.037   4.924   1.149
  632    HA3  GLY  84           HA1      GLY  84  16.827   6.004   2.516
  633    H    LEU  85           HN       LEU  85  16.161   4.158   4.499
  634    HA   LEU  85           HA       LEU  85  18.817   3.368   5.185
  635    HB2  LEU  85           HB2      LEU  85  18.050   2.804   7.361
  636    HB3  LEU  85           HB1      LEU  85  17.257   4.278   6.871
  637    HG   LEU  85           HG       LEU  85  15.929   1.555   6.834
  638   HD11  LEU  85          HD11      LEU  85  16.538   2.156   9.094
  639   HD12  LEU  85          HD12      LEU  85  14.791   2.274   8.874
  640   HD13  LEU  85          HD13      LEU  85  15.781   3.733   8.904
  641   HD21  LEU  85          HD21      LEU  85  14.776   4.343   6.644
  642   HD22  LEU  85          HD22      LEU  85  13.845   2.850   6.731
  643   HD23  LEU  85          HD23      LEU  85  14.873   3.166   5.334
  644    H    GLU  86           HN       GLU  86  16.678   1.688   3.344
  645    HA   GLU  86           HA       GLU  86  18.053  -0.798   3.935
  646    HB2  GLU  86           HB2      GLU  86  15.926  -0.910   5.233
  647    HB3  GLU  86           HB1      GLU  86  15.024  -0.577   3.764
  648    HG2  GLU  86           HG2      GLU  86  15.903  -2.692   2.800
  649    HG3  GLU  86           HG1      GLU  86  16.692  -3.019   4.337
  650    H    HIS  87           HN       HIS  87  18.070  -2.175   2.115
  651    HA   HIS  87           HA       HIS  87  16.688  -1.306  -0.292
  652    HB2  HIS  87           HB2      HIS  87  18.995  -0.403  -0.539
  653    HB3  HIS  87           HB1      HIS  87  19.643  -2.009  -0.238
  654    HD1  HIS  87           HD1      HIS  87  20.129  -3.350  -2.320
  655    HD2  HIS  87           HD2      HIS  87  17.308  -0.370  -2.983
  656    HE1  HIS  87           HE1      HIS  87  19.581  -3.436  -4.779
  657    H    HIS  88           HN       HIS  88  19.060  -3.798   0.607
  658    HA   HIS  88           HA       HIS  88  17.423  -5.889   1.147
  659    HB2  HIS  88           HB2      HIS  88  16.644  -5.625  -1.258
  660    HB3  HIS  88           HB1      HIS  88  18.278  -6.040  -1.773
  661    HD1  HIS  88           HD1      HIS  88  18.601  -8.494  -2.220
  662    HD2  HIS  88           HD2      HIS  88  15.464  -7.745   0.391
  663    HE1  HIS  88           HE1      HIS  88  17.551 -10.729  -1.730
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1   2.093   4.764   7.794
    2    H2   MET   1           HT2      MET   1   3.206   5.681   6.920
    3    H3   MET   1           HT3      MET   1   1.724   5.239   6.204
    4    HA   MET   1           HA       MET   1   1.647   7.518   6.868
    5    HB2  MET   1           HB2      MET   1  -0.429   6.288   6.941
    6    HB3  MET   1           HB1      MET   1  -0.015   5.609   8.507
    7    HG2  MET   1           HG2      MET   1  -0.264   7.753   9.555
    8    HG3  MET   1           HG1      MET   1  -0.516   8.536   7.999
    9    HE1  MET   1           HE1      MET   1  -1.992   5.017   9.033
   10    HE2  MET   1           HE2      MET   1  -3.499   5.497   9.812
   11    HE3  MET   1           HE3      MET   1  -1.955   5.904  10.557
   12    H    VAL   2           HN       VAL   2   1.947   5.461   9.789
   13    HA   VAL   2           HA       VAL   2   3.350   7.725  10.965
   14    HB   VAL   2           HB       VAL   2   1.256   7.554  12.157
   15   HG11  VAL   2          HG11      VAL   2   0.485   5.531  13.307
   16   HG12  VAL   2          HG12      VAL   2   1.834   4.633  12.609
   17   HG13  VAL   2          HG13      VAL   2   0.588   5.299  11.559
   18   HG21  VAL   2          HG21      VAL   2   1.984   7.076  14.457
   19   HG22  VAL   2          HG22      VAL   2   3.184   8.016  13.568
   20   HG23  VAL   2          HG23      VAL   2   3.431   6.289  13.825
   21    H    THR   3           HN       THR   3   5.346   7.236  10.636
   22    HA   THR   3           HA       THR   3   7.360   6.334  10.852
   23    HB   THR   3           HB       THR   3   6.120   4.246  12.679
   24    HG1  THR   3           HG1      THR   3   6.081   6.718  13.048
   25   HG21  THR   3          HG21      THR   3   8.982   5.234  12.433
   26   HG22  THR   3          HG22      THR   3   8.396   3.669  11.871
   27   HG23  THR   3          HG23      THR   3   8.402   4.040  13.596
   28    H    ALA   4           HN       ALA   4   4.795   4.068  10.117
   29    HA   ALA   4           HA       ALA   4   6.495   2.325   8.623
   30    HB1  ALA   4           HB1      ALA   4   3.484   2.581   8.610
   31    HB2  ALA   4           HB2      ALA   4   4.420   1.503   9.645
   32    HB3  ALA   4           HB3      ALA   4   4.409   1.258   7.897
   33    H    ALA   5           HN       ALA   5   6.973   2.424   6.510
   34    HA   ALA   5           HA       ALA   5   6.728   4.896   5.153
   35    HB1  ALA   5           HB1      ALA   5   8.685   3.445   4.944
   36    HB2  ALA   5           HB2      ALA   5   7.964   3.778   3.366
   37    HB3  ALA   5           HB3      ALA   5   7.694   2.223   4.153
   38    H    LEU   6           HN       LEU   6   4.732   2.151   5.258
   39    HA   LEU   6           HA       LEU   6   3.442   2.891   2.741
   40    HB2  LEU   6           HB2      LEU   6   3.528   0.289   4.214
   41    HB3  LEU   6           HB1      LEU   6   2.305   0.627   3.012
   42    HG   LEU   6           HG       LEU   6   4.089   0.873   1.327
   43   HD11  LEU   6          HD11      LEU   6   5.912   1.475   2.871
   44   HD12  LEU   6          HD12      LEU   6   6.320   0.168   1.776
   45   HD13  LEU   6          HD13      LEU   6   5.924  -0.191   3.464
   46   HD21  LEU   6          HD21      LEU   6   2.907  -1.203   1.567
   47   HD22  LEU   6          HD22      LEU   6   4.020  -1.721   2.834
   48   HD23  LEU   6          HD23      LEU   6   4.599  -1.510   1.182
   49    H    THR   7           HN       THR   7   1.414   3.416   2.680
   50    HA   THR   7           HA       THR   7  -0.246   3.047   5.047
   51    HB   THR   7           HB       THR   7  -0.406   5.277   2.994
   52    HG1  THR   7           HG1      THR   7   1.234   5.989   4.090
   53   HG21  THR   7          HG21      THR   7  -1.937   6.311   4.617
   54   HG22  THR   7          HG22      THR   7  -1.770   4.905   5.674
   55   HG23  THR   7          HG23      THR   7  -2.532   4.739   4.091
   56    H    ILE   8           HN       ILE   8  -1.594   1.441   4.500
   57    HA   ILE   8           HA       ILE   8  -2.203   1.080   1.671
   58    HB   ILE   8           HB       ILE   8  -1.968  -0.980   3.865
   59   HG12  ILE   8          HG12      ILE   8  -0.402  -0.516   1.330
   60   HG13  ILE   8          HG11      ILE   8   0.153  -0.203   2.968
   61   HG21  ILE   8          HG21      ILE   8  -3.818  -1.489   2.428
   62   HG22  ILE   8          HG22      ILE   8  -2.529  -2.679   2.208
   63   HG23  ILE   8          HG23      ILE   8  -2.806  -1.438   0.980
   64   HD11  ILE   8          HD11      ILE   8   1.086  -2.253   2.083
   65   HD12  ILE   8          HD12      ILE   8  -0.538  -2.888   1.816
   66   HD13  ILE   8          HD13      ILE   8   0.031  -2.579   3.457
   67    H    TYR   9           HN       TYR   9  -4.136   0.946   1.039
   68    HA   TYR   9           HA       TYR   9  -6.301   1.531   2.855
   69    HB2  TYR   9           HB2      TYR   9  -6.012   1.402  -0.122
   70    HB3  TYR   9           HB1      TYR   9  -7.509   1.898   0.614
   71    HD1  TYR   9           HD2      TYR   9  -7.475   4.046   2.034
   72    HD2  TYR   9           HD1      TYR   9  -4.214   2.917  -0.446
   73    HE1  TYR   9           HE2      TYR   9  -6.603   6.344   2.138
   74    HE2  TYR   9           HE1      TYR   9  -3.333   5.200  -0.345
   75    HH   TYR   9           HH       TYR   9  -4.210   7.473   0.080
   76    H    THR  10           HN       THR  10  -7.235  -0.246   3.805
   77    HA   THR  10           HA       THR  10  -7.843  -2.524   2.103
   78    HB   THR  10           HB       THR  10  -7.376  -3.937   4.219
   79    HG1  THR  10           HG1      THR  10  -6.903  -2.460   5.704
   80   HG21  THR  10          HG21      THR  10  -6.090  -4.268   2.216
   81   HG22  THR  10          HG22      THR  10  -4.959  -4.189   3.583
   82   HG23  THR  10          HG23      THR  10  -5.176  -2.800   2.523
   83    H    THR  11           HN       THR  11  -9.750  -3.573   2.550
   84    HA   THR  11           HA       THR  11 -11.247  -2.747   4.884
   85    HB   THR  11           HB       THR  11 -13.305  -3.058   3.437
   86    HG1  THR  11           HG1      THR  11 -12.477  -2.535   1.061
   87   HG21  THR  11          HG21      THR  11 -11.455  -0.816   2.594
   88   HG22  THR  11          HG22      THR  11 -12.522  -0.800   3.998
   89   HG23  THR  11          HG23      THR  11 -13.205  -0.847   2.373
   90    H    SER  12           HN       SER  12 -12.857  -4.497   5.392
   91    HA   SER  12           HA       SER  12 -11.670  -7.082   4.924
   92    HB2  SER  12           HB2      SER  12 -13.446  -7.852   6.527
   93    HB3  SER  12           HB1      SER  12 -12.370  -6.616   7.170
   94    HG   SER  12           HG       SER  12 -13.952  -5.061   6.772
   95    H    TRP  13           HN       TRP  13 -13.553  -5.248   3.098
   96    HA   TRP  13           HA       TRP  13 -15.752  -7.020   2.475
   97    HB2  TRP  13           HB2      TRP  13 -14.922  -4.523   0.991
   98    HB3  TRP  13           HB1      TRP  13 -16.491  -5.309   0.982
   99    HD1  TRP  13           HD1      TRP  13 -16.694  -5.491   4.284
  100    HE1  TRP  13           HE1      TRP  13 -17.240  -3.308   5.550
  101    HE3  TRP  13           HE3      TRP  13 -15.384  -2.084   0.692
  102    HZ2  TRP  13           HZ2      TRP  13 -17.155  -0.536   5.082
  103    HZ3  TRP  13           HZ3      TRP  13 -15.659   0.307   1.186
  104    HH2  TRP  13           HH2      TRP  13 -16.528   1.061   3.331
  105    H    CYS  14           HN       CYS  14 -12.712  -7.525   1.789
  106    HA   CYS  14           HA       CYS  14 -13.259  -8.555  -0.858
  107    HB2  CYS  14           HB2      CYS  14 -11.062  -7.584  -1.647
  108    HB3  CYS  14           HB1      CYS  14 -12.394  -6.451  -1.466
  109    H    GLY  15           HN       GLY  15 -11.349  -9.848  -1.624
  110    HA2  GLY  15           HA2      GLY  15 -10.069 -11.221   0.642
  111    HA3  GLY  15           HA1      GLY  15 -10.544 -12.011  -0.858
  112    H    TYR  16           HN       TYR  16  -9.603  -9.943  -2.643
  113    HA   TYR  16           HA       TYR  16  -6.945 -10.844  -2.914
  114    HB2  TYR  16           HB2      TYR  16  -6.736  -9.426  -4.876
  115    HB3  TYR  16           HB1      TYR  16  -8.332 -10.144  -4.867
  116    HD1  TYR  16           HD1      TYR  16  -9.598  -8.116  -2.912
  117    HD2  TYR  16           HD2      TYR  16  -7.133  -7.597  -6.329
  118    HE1  TYR  16           HE1      TYR  16 -10.609  -5.908  -3.307
  119    HE2  TYR  16           HE2      TYR  16  -8.135  -5.397  -6.718
  120    HH   TYR  16           HH       TYR  16 -10.268  -4.274  -6.190
  121    H    CYS  17           HN       CYS  17  -8.210  -8.235  -1.220
  122    HA   CYS  17           HA       CYS  17  -5.893  -6.614  -1.033
  123    HB2  CYS  17           HB2      CYS  17  -7.199  -5.821   1.053
  124    HB3  CYS  17           HB1      CYS  17  -7.915  -5.536  -0.546
  125    H    LEU  18           HN       LEU  18  -7.322  -9.183   0.941
  126    HA   LEU  18           HA       LEU  18  -5.512  -9.061   3.073
  127    HB2  LEU  18           HB2      LEU  18  -7.440 -11.086   2.099
  128    HB3  LEU  18           HB1      LEU  18  -6.284 -11.539   3.332
  129    HG   LEU  18           HG       LEU  18  -7.158  -9.663   4.746
  130   HD11  LEU  18          HD11      LEU  18  -9.340  -9.521   2.689
  131   HD12  LEU  18          HD12      LEU  18  -8.155  -8.265   3.052
  132   HD13  LEU  18          HD13      LEU  18  -9.343  -8.735   4.267
  133   HD21  LEU  18          HD21      LEU  18  -7.794 -11.917   5.092
  134   HD22  LEU  18          HD22      LEU  18  -9.108 -11.765   3.915
  135   HD23  LEU  18          HD23      LEU  18  -9.151 -10.838   5.426
  136    H    ARG  19           HN       ARG  19  -5.414 -10.659   0.018
  137    HA   ARG  19           HA       ARG  19  -3.358 -12.513   0.535
  138    HB2  ARG  19           HB2      ARG  19  -4.002 -11.108  -2.060
  139    HB3  ARG  19           HB1      ARG  19  -2.973 -12.523  -1.903
  140    HG2  ARG  19           HG2      ARG  19  -5.918 -12.398  -1.266
  141    HG3  ARG  19           HG1      ARG  19  -5.178 -13.141  -2.687
  142    HD2  ARG  19           HD2      ARG  19  -3.989 -14.706  -1.235
  143    HD3  ARG  19           HD1      ARG  19  -4.767 -13.983   0.170
  144    HE   ARG  19           HE       ARG  19  -6.773 -14.702  -1.556
  145   HH11  ARG  19          HH11      ARG  19  -4.203 -16.341   0.250
  146   HH12  ARG  19          HH12      ARG  19  -5.023 -17.807   0.419
  147   HH21  ARG  19          HH21      ARG  19  -7.940 -16.722  -1.339
  148   HH22  ARG  19          HH22      ARG  19  -7.234 -18.036  -0.526
  149    H    LEU  20           HN       LEU  20  -3.159  -9.258  -0.849
  150    HA   LEU  20           HA       LEU  20  -0.355  -9.241  -0.928
  151    HB2  LEU  20           HB2      LEU  20  -1.582  -7.717  -2.324
  152    HB3  LEU  20           HB1      LEU  20  -2.379  -7.006  -0.940
  153    HG   LEU  20           HG       LEU  20   0.012  -6.260  -0.261
  154   HD11  LEU  20          HD11      LEU  20   1.433  -7.372  -1.850
  155   HD12  LEU  20          HD12      LEU  20   1.425  -5.663  -2.218
  156   HD13  LEU  20          HD13      LEU  20   0.459  -6.754  -3.189
  157   HD21  LEU  20          HD21      LEU  20  -0.257  -4.181  -1.590
  158   HD22  LEU  20          HD22      LEU  20  -1.714  -4.717  -0.759
  159   HD23  LEU  20          HD23      LEU  20  -1.550  -4.992  -2.490
  160    H    LYS  21           HN       LYS  21  -2.740  -8.097   1.361
  161    HA   LYS  21           HA       LYS  21  -1.171  -6.620   3.108
  162    HB2  LYS  21           HB2      LYS  21  -3.709  -6.808   3.012
  163    HB3  LYS  21           HB1      LYS  21  -3.546  -8.311   3.903
  164    HG2  LYS  21           HG2      LYS  21  -2.482  -7.108   5.734
  165    HG3  LYS  21           HG1      LYS  21  -2.663  -5.602   4.838
  166    HD2  LYS  21           HD2      LYS  21  -5.128  -5.953   4.862
  167    HD3  LYS  21           HD1      LYS  21  -4.878  -7.370   5.880
  168    HE2  LYS  21           HE2      LYS  21  -3.694  -5.936   7.533
  169    HE3  LYS  21           HE1      LYS  21  -4.094  -4.535   6.548
  170    HZ1  LYS  21           HZ1      LYS  21  -6.018  -6.320   7.927
  171    HZ2  LYS  21           HZ2      LYS  21  -6.467  -5.052   6.922
  172    HZ3  LYS  21           HZ3      LYS  21  -5.610  -4.736   8.351
  173    H    THR  22           HN       THR  22  -2.045 -10.077   3.292
  174    HA   THR  22           HA       THR  22  -0.514 -10.577   5.608
  175    HB   THR  22           HB       THR  22  -0.810 -13.006   4.942
  176    HG1  THR  22           HG1      THR  22  -2.621 -12.041   3.017
  177   HG21  THR  22          HG21      THR  22  -3.288 -11.271   5.029
  178   HG22  THR  22          HG22      THR  22  -2.406 -11.876   6.429
  179   HG23  THR  22          HG23      THR  22  -3.241 -13.001   5.358
  180    H    ALA  23           HN       ALA  23   0.200 -10.723   2.187
  181    HA   ALA  23           HA       ALA  23   2.670 -12.113   2.291
  182    HB1  ALA  23           HB1      ALA  23   3.103 -11.146   0.100
  183    HB2  ALA  23           HB2      ALA  23   1.801  -9.978   0.337
  184    HB3  ALA  23           HB3      ALA  23   1.428 -11.692   0.190
  185    H    LEU  24           HN       LEU  24   1.957  -8.665   2.355
  186    HA   LEU  24           HA       LEU  24   4.642  -7.859   2.650
  187    HB2  LEU  24           HB2      LEU  24   2.133  -6.446   3.540
  188    HB3  LEU  24           HB1      LEU  24   3.711  -5.700   3.371
  189    HG   LEU  24           HG       LEU  24   2.031  -6.835   1.134
  190   HD11  LEU  24          HD11      LEU  24   1.188  -4.753   2.022
  191   HD12  LEU  24          HD12      LEU  24   1.851  -4.543   0.404
  192   HD13  LEU  24          HD13      LEU  24   2.773  -4.011   1.811
  193   HD21  LEU  24          HD21      LEU  24   4.400  -7.150   0.664
  194   HD22  LEU  24          HD22      LEU  24   4.701  -5.449   1.032
  195   HD23  LEU  24          HD23      LEU  24   3.717  -5.888  -0.360
  196    H    THR  25           HN       THR  25   2.165  -8.715   4.955
  197    HA   THR  25           HA       THR  25   3.454  -8.015   7.338
  198    HB   THR  25           HB       THR  25   1.622 -10.398   6.861
  199    HG1  THR  25           HG1      THR  25   0.660  -8.362   6.222
  200   HG21  THR  25          HG21      THR  25   2.763 -10.486   9.036
  201   HG22  THR  25          HG22      THR  25   1.046 -10.141   9.243
  202   HG23  THR  25          HG23      THR  25   2.229  -8.843   9.389
  203    H    ALA  26           HN       ALA  26   3.497 -11.070   5.507
  204    HA   ALA  26           HA       ALA  26   5.283 -12.419   7.228
  205    HB1  ALA  26           HB1      ALA  26   4.670 -12.981   4.336
  206    HB2  ALA  26           HB2      ALA  26   3.735 -13.571   5.711
  207    HB3  ALA  26           HB3      ALA  26   5.404 -14.097   5.486
  208    H    ASN  27           HN       ASN  27   5.746 -10.420   4.453
  209    HA   ASN  27           HA       ASN  27   8.532 -11.091   4.167
  210    HB2  ASN  27           HB2      ASN  27   6.620  -9.350   2.780
  211    HB3  ASN  27           HB1      ASN  27   8.350  -9.052   2.473
  212   HD21  ASN  27          HD21      ASN  27   5.614 -11.080   1.968
  213   HD22  ASN  27          HD22      ASN  27   6.345 -12.176   0.848
  214    H    ARG  28           HN       ARG  28   7.113  -9.349   6.451
  215    HA   ARG  28           HA       ARG  28   7.867  -7.972   8.072
  216    HB2  ARG  28           HB2      ARG  28  10.502  -8.288   6.656
  217    HB3  ARG  28           HB1      ARG  28  10.317  -7.300   8.093
  218    HG2  ARG  28           HG2      ARG  28   9.566  -9.274   9.337
  219    HG3  ARG  28           HG1      ARG  28   9.791 -10.255   7.884
  220    HD2  ARG  28           HD2      ARG  28  11.706 -10.390   9.445
  221    HD3  ARG  28           HD1      ARG  28  12.147  -9.764   7.856
  222    HE   ARG  28           HE       ARG  28  11.521  -7.643   9.609
  223   HH11  ARG  28          HH11      ARG  28  14.084 -10.014   9.035
  224   HH12  ARG  28          HH12      ARG  28  15.333  -9.017   9.618
  225   HH21  ARG  28          HH21      ARG  28  13.226  -6.260  10.359
  226   HH22  ARG  28          HH22      ARG  28  14.830  -6.818  10.411
  227    H    ILE  29           HN       ILE  29   6.787  -6.944   5.544
  228    HA   ILE  29           HA       ILE  29   8.053  -4.330   5.432
  229    HB   ILE  29           HB       ILE  29   5.808  -5.509   3.759
  230   HG12  ILE  29          HG12      ILE  29   8.731  -5.015   3.061
  231   HG13  ILE  29          HG11      ILE  29   8.005  -6.580   3.363
  232   HG21  ILE  29          HG21      ILE  29   5.619  -3.083   3.945
  233   HG22  ILE  29          HG22      ILE  29   6.113  -3.537   2.312
  234   HG23  ILE  29          HG23      ILE  29   7.300  -2.900   3.451
  235   HD11  ILE  29          HD11      ILE  29   7.302  -4.727   1.099
  236   HD12  ILE  29          HD12      ILE  29   6.627  -6.335   1.383
  237   HD13  ILE  29          HD13      ILE  29   8.335  -6.151   0.996
  238    H    ALA  30           HN       ALA  30   7.348  -2.861   6.813
  239    HA   ALA  30           HA       ALA  30   4.896  -3.191   8.262
  240    HB1  ALA  30           HB1      ALA  30   5.551  -1.173   9.444
  241    HB2  ALA  30           HB2      ALA  30   6.821  -0.888   8.251
  242    HB3  ALA  30           HB3      ALA  30   6.917  -2.288   9.324
  243    H    TYR  31           HN       TYR  31   3.080  -1.860   8.223
  244    HA   TYR  31           HA       TYR  31   2.797   0.215   6.280
  245    HB2  TYR  31           HB2      TYR  31   1.041  -0.902   4.969
  246    HB3  TYR  31           HB1      TYR  31   2.574  -1.746   4.813
  247    HD1  TYR  31           HD1      TYR  31   2.860  -3.985   5.778
  248    HD2  TYR  31           HD2      TYR  31  -0.849  -1.926   6.108
  249    HE1  TYR  31           HE1      TYR  31   1.759  -6.070   6.461
  250    HE2  TYR  31           HE2      TYR  31  -1.949  -4.002   6.795
  251    HH   TYR  31           HH       TYR  31  -0.162  -6.812   7.615
  252    H    ASP  32           HN       ASP  32   1.018   1.452   6.739
  253    HA   ASP  32           HA       ASP  32  -0.565   0.654   9.083
  254    HB2  ASP  32           HB2      ASP  32  -0.297   3.354   7.734
  255    HB3  ASP  32           HB1      ASP  32  -1.308   3.012   9.132
  256    H    GLU  33           HN       GLU  33  -2.705   0.243   8.833
  257    HA   GLU  33           HA       GLU  33  -3.702   0.385   6.094
  258    HB2  GLU  33           HB2      GLU  33  -5.466  -1.156   6.811
  259    HB3  GLU  33           HB1      GLU  33  -3.895  -1.766   7.244
  260    HG2  GLU  33           HG2      GLU  33  -4.191  -1.038   9.555
  261    HG3  GLU  33           HG1      GLU  33  -5.783  -0.413   9.145
  262    H    VAL  34           HN       VAL  34  -5.542   1.510   5.572
  263    HA   VAL  34           HA       VAL  34  -5.980   3.768   7.324
  264    HB   VAL  34           HB       VAL  34  -7.130   3.425   4.541
  265   HG11  VAL  34          HG11      VAL  34  -7.238   5.843   4.514
  266   HG12  VAL  34          HG12      VAL  34  -6.570   5.901   6.142
  267   HG13  VAL  34          HG13      VAL  34  -8.159   5.191   5.873
  268   HG21  VAL  34          HG21      VAL  34  -5.199   4.694   3.740
  269   HG22  VAL  34          HG22      VAL  34  -4.707   3.162   4.460
  270   HG23  VAL  34          HG23      VAL  34  -4.509   4.663   5.361
  271    H    ASP  35           HN       ASP  35  -7.860   4.507   8.037
  272    HA   ASP  35           HA       ASP  35  -9.689   2.704   9.169
  273    HB2  ASP  35           HB2      ASP  35  -8.828   4.863  10.136
  274    HB3  ASP  35           HB1      ASP  35  -9.903   5.708   9.040
  275    H    ILE  36           HN       ILE  36  -9.751   3.623   6.080
  276    HA   ILE  36           HA       ILE  36 -12.048   4.905   5.271
  277    HB   ILE  36           HB       ILE  36 -11.981   3.695   3.147
  278   HG12  ILE  36          HG12      ILE  36  -9.721   2.087   4.340
  279   HG13  ILE  36          HG11      ILE  36 -11.364   1.481   4.165
  280   HG21  ILE  36          HG21      ILE  36  -9.289   4.542   4.186
  281   HG22  ILE  36          HG22      ILE  36 -10.538   5.590   3.500
  282   HG23  ILE  36          HG23      ILE  36  -9.754   4.379   2.490
  283   HD11  ILE  36          HD11      ILE  36  -9.831   0.769   2.372
  284   HD12  ILE  36          HD12      ILE  36  -9.703   2.497   1.912
  285   HD13  ILE  36          HD13      ILE  36 -11.243   1.665   1.803
  286    H    GLU  37           HN       GLU  37 -12.044   1.631   6.495
  287    HA   GLU  37           HA       GLU  37 -14.433   0.771   5.235
  288    HB2  GLU  37           HB2      GLU  37 -12.745  -0.747   6.323
  289    HB3  GLU  37           HB1      GLU  37 -13.297  -0.157   7.883
  290    HG2  GLU  37           HG2      GLU  37 -15.481  -1.089   7.516
  291    HG3  GLU  37           HG1      GLU  37 -15.033  -1.573   5.884
  292    H    HIS  38           HN       HIS  38 -13.710   2.742   7.923
  293    HA   HIS  38           HA       HIS  38 -16.571   3.069   8.543
  294    HB2  HIS  38           HB2      HIS  38 -14.116   3.682  10.211
  295    HB3  HIS  38           HB1      HIS  38 -15.746   4.154  10.657
  296    HD1  HIS  38           HD1      HIS  38 -16.975   2.519  12.081
  297    HD2  HIS  38           HD2      HIS  38 -13.782   0.772  10.087
  298    HE1  HIS  38           HE1      HIS  38 -16.758   0.187  13.019
  299    H    ASN  39           HN       ASN  39 -13.482   4.725   8.078
  300    HA   ASN  39           HA       ASN  39 -14.526   7.360   8.143
  301    HB2  ASN  39           HB2      ASN  39 -12.171   6.820   8.607
  302    HB3  ASN  39           HB1      ASN  39 -11.954   6.414   6.915
  303   HD21  ASN  39          HD21      ASN  39 -10.565   7.974   6.376
  304   HD22  ASN  39          HD22      ASN  39 -10.768   9.656   6.551
  305    H    ARG  40           HN       ARG  40 -15.848   8.084   6.735
  306    HA   ARG  40           HA       ARG  40 -16.046   7.124   4.069
  307    HB2  ARG  40           HB2      ARG  40 -17.802   8.762   3.820
  308    HB3  ARG  40           HB1      ARG  40 -17.969   7.952   5.370
  309    HG2  ARG  40           HG2      ARG  40 -16.756   9.945   6.374
  310    HG3  ARG  40           HG1      ARG  40 -17.005  10.742   4.822
  311    HD2  ARG  40           HD2      ARG  40 -18.776  11.383   6.289
  312    HD3  ARG  40           HD1      ARG  40 -19.441  10.299   5.067
  313    HE   ARG  40           HE       ARG  40 -18.596   8.960   7.454
  314   HH11  ARG  40          HH11      ARG  40 -21.323  10.615   5.908
  315   HH12  ARG  40          HH12      ARG  40 -22.469   9.959   6.990
  316   HH21  ARG  40          HH21      ARG  40 -20.196   8.083   8.893
  317   HH22  ARG  40          HH22      ARG  40 -21.841   8.519   8.679
  318    H    ALA  41           HN       ALA  41 -14.220   9.656   5.589
  319    HA   ALA  41           HA       ALA  41 -14.049  11.261   3.279
  320    HB1  ALA  41           HB1      ALA  41 -12.204  11.482   5.660
  321    HB2  ALA  41           HB2      ALA  41 -13.796  12.201   5.550
  322    HB3  ALA  41           HB3      ALA  41 -12.535  12.697   4.429
  323    H    ALA  42           HN       ALA  42 -11.622   9.146   4.699
  324    HA   ALA  42           HA       ALA  42  -9.887   9.583   2.479
  325    HB1  ALA  42           HB1      ALA  42  -8.994   8.941   4.670
  326    HB2  ALA  42           HB2      ALA  42  -8.493   7.807   3.415
  327    HB3  ALA  42           HB3      ALA  42  -9.785   7.373   4.534
  328    H    ALA  43           HN       ALA  43 -12.572   7.545   3.038
  329    HA   ALA  43           HA       ALA  43 -11.983   5.429   1.301
  330    HB1  ALA  43           HB1      ALA  43 -14.373   4.969   1.360
  331    HB2  ALA  43           HB2      ALA  43 -14.670   6.571   2.043
  332    HB3  ALA  43           HB3      ALA  43 -13.771   5.373   2.970
  333    H    GLU  44           HN       GLU  44 -13.479   8.573   0.765
  334    HA   GLU  44           HA       GLU  44 -14.045   8.088  -1.985
  335    HB2  GLU  44           HB2      GLU  44 -13.882  10.644  -0.390
  336    HB3  GLU  44           HB1      GLU  44 -14.391  10.573  -2.071
  337    HG2  GLU  44           HG2      GLU  44 -15.744   9.028   0.114
  338    HG3  GLU  44           HG1      GLU  44 -16.234  10.649  -0.362
  339    H    PHE  45           HN       PHE  45 -11.334   9.290  -0.207
  340    HA   PHE  45           HA       PHE  45  -9.875  10.345  -2.396
  341    HB2  PHE  45           HB2      PHE  45  -9.333  10.972  -0.080
  342    HB3  PHE  45           HB1      PHE  45  -8.890   9.310   0.281
  343    HD1  PHE  45           HD1      PHE  45  -7.996  12.111  -1.997
  344    HD2  PHE  45           HD2      PHE  45  -6.664   8.687   0.141
  345    HE1  PHE  45           HE1      PHE  45  -5.680  12.614  -2.642
  346    HE2  PHE  45           HE2      PHE  45  -4.337   9.194  -0.499
  347    HZ   PHE  45           HZ       PHE  45  -3.847  11.156  -1.891
  348    H    VAL  46           HN       VAL  46 -10.188   7.169  -0.971
  349    HA   VAL  46           HA       VAL  46  -8.191   5.728  -2.265
  350    HB   VAL  46           HB       VAL  46 -11.026   4.858  -1.591
  351   HG11  VAL  46          HG11      VAL  46 -10.186   2.557  -1.691
  352   HG12  VAL  46          HG12      VAL  46  -8.633   3.162  -2.280
  353   HG13  VAL  46          HG13      VAL  46 -10.083   3.358  -3.260
  354   HG21  VAL  46          HG21      VAL  46  -9.692   5.576   0.319
  355   HG22  VAL  46          HG22      VAL  46  -8.439   4.421  -0.136
  356   HG23  VAL  46          HG23      VAL  46 -10.031   3.844   0.355
  357    H    GLY  47           HN       GLY  47 -11.550   6.228  -3.288
  358    HA2  GLY  47           HA2      GLY  47 -11.339   4.998  -5.791
  359    HA3  GLY  47           HA1      GLY  47 -12.541   6.204  -5.354
  360    H    SER  48           HN       SER  48 -10.609   8.223  -4.765
  361    HA   SER  48           HA       SER  48 -10.412   9.432  -7.301
  362    HB2  SER  48           HB2      SER  48  -9.047  10.197  -4.722
  363    HB3  SER  48           HB1      SER  48  -9.268  11.236  -6.130
  364    HG   SER  48           HG       SER  48 -11.372  10.098  -4.549
  365    H    VAL  49           HN       VAL  49  -7.939   7.861  -5.235
  366    HA   VAL  49           HA       VAL  49  -5.896   8.489  -7.176
  367    HB   VAL  49           HB       VAL  49  -4.307   7.254  -5.750
  368   HG11  VAL  49          HG11      VAL  49  -6.035   9.215  -4.255
  369   HG12  VAL  49          HG12      VAL  49  -4.681   9.598  -5.319
  370   HG13  VAL  49          HG13      VAL  49  -4.398   8.745  -3.803
  371   HG21  VAL  49          HG21      VAL  49  -5.788   5.519  -4.868
  372   HG22  VAL  49          HG22      VAL  49  -6.689   6.732  -3.960
  373   HG23  VAL  49          HG23      VAL  49  -5.006   6.394  -3.549
  374    H    ASN  50           HN       ASN  50  -8.041   5.939  -6.655
  375    HA   ASN  50           HA       ASN  50  -6.596   3.999  -8.209
  376    HB2  ASN  50           HB2      ASN  50  -9.525   4.168  -7.463
  377    HB3  ASN  50           HB1      ASN  50  -8.799   2.816  -8.311
  378   HD21  ASN  50          HD21      ASN  50  -6.351   2.739  -6.704
  379   HD22  ASN  50          HD22      ASN  50  -6.836   2.156  -5.171
  380    H    GLY  51           HN       GLY  51  -9.379   6.127  -8.739
  381    HA2  GLY  51           HA2      GLY  51  -8.908   7.279 -11.046
  382    HA3  GLY  51           HA1      GLY  51  -9.299   5.649 -11.593
  383    H    GLY  52           HN       GLY  52 -11.328   5.102 -11.795
  384    HA2  GLY  52           HA2      GLY  52 -13.374   7.032 -10.929
  385    HA3  GLY  52           HA1      GLY  52 -13.567   5.851 -12.223
  386    H    ASN  53           HN       ASN  53 -12.477   3.673 -10.766
  387    HA   ASN  53           HA       ASN  53 -14.777   3.071  -9.028
  388    HB2  ASN  53           HB2      ASN  53 -12.858   1.205 -10.458
  389    HB3  ASN  53           HB1      ASN  53 -14.206   0.702  -9.453
  390   HD21  ASN  53          HD21      ASN  53 -16.284   0.839 -10.279
  391   HD22  ASN  53          HD22      ASN  53 -16.583   1.100 -11.949
  392    H    ARG  54           HN       ARG  54 -14.357   2.138  -6.973
  393    HA   ARG  54           HA       ARG  54 -11.743   2.725  -5.915
  394    HB2  ARG  54           HB2      ARG  54 -14.094   1.324  -4.619
  395    HB3  ARG  54           HB1      ARG  54 -12.584   1.697  -3.823
  396    HG2  ARG  54           HG2      ARG  54 -13.049   4.101  -4.140
  397    HG3  ARG  54           HG1      ARG  54 -14.626   3.667  -4.823
  398    HD2  ARG  54           HD2      ARG  54 -15.182   2.469  -2.754
  399    HD3  ARG  54           HD1      ARG  54 -13.624   2.929  -2.070
  400    HE   ARG  54           HE       ARG  54 -14.890   5.243  -2.815
  401   HH11  ARG  54          HH11      ARG  54 -15.504   2.574  -0.571
  402   HH12  ARG  54          HH12      ARG  54 -16.346   3.514   0.571
  403   HH21  ARG  54          HH21      ARG  54 -16.031   6.580  -1.220
  404   HH22  ARG  54          HH22      ARG  54 -16.612   5.844   0.205
  405    H    THR  55           HN       THR  55 -10.192   1.344  -5.563
  406    HA   THR  55           HA       THR  55 -10.636  -1.512  -6.074
  407    HB   THR  55           HB       THR  55  -8.021   0.027  -6.313
  408    HG1  THR  55           HG1      THR  55  -9.928   0.657  -7.739
  409   HG21  THR  55          HG21      THR  55  -7.918  -2.443  -6.150
  410   HG22  THR  55          HG22      THR  55  -7.403  -1.881  -7.740
  411   HG23  THR  55          HG23      THR  55  -9.009  -2.572  -7.527
  412    H    VAL  56           HN       VAL  56  -9.405  -2.814  -4.382
  413    HA   VAL  56           HA       VAL  56  -9.273  -1.089  -2.090
  414    HB   VAL  56           HB       VAL  56  -8.888  -4.057  -1.915
  415   HG11  VAL  56          HG11      VAL  56  -9.127  -3.651   0.501
  416   HG12  VAL  56          HG12      VAL  56  -9.484  -1.959   0.165
  417   HG13  VAL  56          HG13      VAL  56  -7.874  -2.547  -0.124
  418   HG21  VAL  56          HG21      VAL  56 -11.097  -3.357  -2.692
  419   HG22  VAL  56          HG22      VAL  56 -11.125  -2.269  -1.272
  420   HG23  VAL  56          HG23      VAL  56 -11.082  -4.036  -1.035
  421    HA   PRO  57           HA       PRO  57  -5.604  -2.648  -1.084
  422    HB2  PRO  57           HB2      PRO  57  -3.683  -4.237  -2.266
  423    HB3  PRO  57           HB1      PRO  57  -5.017  -4.787  -1.260
  424    HG2  PRO  57           HG2      PRO  57  -4.824  -4.793  -4.226
  425    HG3  PRO  57           HG1      PRO  57  -5.724  -5.883  -3.161
  426    HD2  PRO  57           HD2      PRO  57  -6.757  -3.716  -4.607
  427    HD3  PRO  57           HD1      PRO  57  -7.576  -4.647  -3.353
  428    H    THR  58           HN       THR  58  -4.977  -0.562  -1.476
  429    HA   THR  58           HA       THR  58  -3.278   0.201  -3.713
  430    HB   THR  58           HB       THR  58  -5.348   1.737  -2.146
  431    HG1  THR  58           HG1      THR  58  -6.397   0.280  -3.345
  432   HG21  THR  58          HG21      THR  58  -3.613   3.202  -3.161
  433   HG22  THR  58          HG22      THR  58  -5.186   3.386  -3.968
  434   HG23  THR  58          HG23      THR  58  -3.926   2.427  -4.722
  435    H    VAL  59           HN       VAL  59  -1.405   1.092  -3.057
  436    HA   VAL  59           HA       VAL  59  -1.087   1.606  -0.196
  437    HB   VAL  59           HB       VAL  59   0.176  -0.388  -0.775
  438   HG11  VAL  59          HG11      VAL  59   0.323  -0.153  -3.117
  439   HG12  VAL  59          HG12      VAL  59   1.953  -0.354  -2.449
  440   HG13  VAL  59          HG13      VAL  59   1.367   1.249  -2.944
  441   HG21  VAL  59          HG21      VAL  59   1.268   1.123   0.810
  442   HG22  VAL  59          HG22      VAL  59   2.040   1.972  -0.528
  443   HG23  VAL  59          HG23      VAL  59   2.459   0.292  -0.191
  444    H    LYS  60           HN       LYS  60  -0.393   3.486   0.388
  445    HA   LYS  60           HA       LYS  60   0.610   5.356  -1.631
  446    HB2  LYS  60           HB2      LYS  60  -1.424   6.028  -0.355
  447    HB3  LYS  60           HB1      LYS  60  -0.512   5.869   1.137
  448    HG2  LYS  60           HG2      LYS  60   0.970   7.673   0.365
  449    HG3  LYS  60           HG1      LYS  60  -0.026   7.837  -1.085
  450    HD2  LYS  60           HD2      LYS  60  -1.995   8.227   0.401
  451    HD3  LYS  60           HD1      LYS  60  -0.891   8.246   1.773
  452    HE2  LYS  60           HE2      LYS  60  -0.832  10.103  -0.587
  453    HE3  LYS  60           HE1      LYS  60  -1.430  10.497   1.023
  454    HZ1  LYS  60           HZ1      LYS  60   1.388   9.824   0.316
  455    HZ2  LYS  60           HZ2      LYS  60   0.822  10.121   1.874
  456    HZ3  LYS  60           HZ3      LYS  60   0.775  11.336   0.714
  457    H    PHE  61           HN       PHE  61   2.727   5.534  -1.601
  458    HA   PHE  61           HA       PHE  61   4.235   4.631   0.710
  459    HB2  PHE  61           HB2      PHE  61   5.075   5.479  -2.062
  460    HB3  PHE  61           HB1      PHE  61   6.230   5.125  -0.789
  461    HD1  PHE  61           HD2      PHE  61   3.744   3.703  -3.076
  462    HD2  PHE  61           HD1      PHE  61   6.629   2.877  -0.066
  463    HE1  PHE  61           HE2      PHE  61   3.678   1.301  -3.657
  464    HE2  PHE  61           HE1      PHE  61   6.561   0.487  -0.655
  465    HZ   PHE  61           HZ       PHE  61   5.082  -0.289  -2.456
  466    H    ALA  62           HN       ALA  62   5.839   5.898   1.701
  467    HA   ALA  62           HA       ALA  62   5.109   8.490   2.426
  468    HB1  ALA  62           HB1      ALA  62   6.521   7.024   3.795
  469    HB2  ALA  62           HB2      ALA  62   7.267   8.602   3.548
  470    HB3  ALA  62           HB3      ALA  62   7.831   7.207   2.629
  471    H    ASP  63           HN       ASP  63   6.890   7.386  -0.266
  472    HA   ASP  63           HA       ASP  63   8.295   9.807  -0.879
  473    HB2  ASP  63           HB2      ASP  63   8.946   7.532  -1.723
  474    HB3  ASP  63           HB1      ASP  63   7.527   7.554  -2.757
  475    H    GLY  64           HN       GLY  64   5.028   8.863  -1.134
  476    HA2  GLY  64           HA2      GLY  64   3.433  10.608  -1.535
  477    HA3  GLY  64           HA1      GLY  64   4.489  11.229  -2.790
  478    H    SER  65           HN       SER  65   4.911   8.318  -3.587
  479    HA   SER  65           HA       SER  65   3.057   8.300  -5.718
  480    HB2  SER  65           HB2      SER  65   4.801   6.053  -4.745
  481    HB3  SER  65           HB1      SER  65   4.190   6.313  -6.377
  482    HG   SER  65           HG       SER  65   5.424   8.228  -6.447
  483    H    THR  66           HN       THR  66   1.149   7.140  -5.966
  484    HA   THR  66           HA       THR  66   0.428   5.285  -3.832
  485    HB   THR  66           HB       THR  66  -1.919   5.669  -4.724
  486    HG1  THR  66           HG1      THR  66  -1.684   6.555  -6.647
  487   HG21  THR  66          HG21      THR  66  -2.222   7.849  -3.605
  488   HG22  THR  66          HG22      THR  66  -0.474   8.091  -3.624
  489   HG23  THR  66          HG23      THR  66  -1.174   6.777  -2.678
  490    H    LEU  67           HN       LEU  67  -0.042   3.239  -4.455
  491    HA   LEU  67           HA       LEU  67  -0.010   2.639  -7.319
  492    HB2  LEU  67           HB2      LEU  67   1.575   1.309  -5.141
  493    HB3  LEU  67           HB1      LEU  67   1.091   0.395  -6.545
  494    HG   LEU  67           HG       LEU  67   2.316   2.065  -7.943
  495   HD11  LEU  67          HD11      LEU  67   3.435   3.097  -5.347
  496   HD12  LEU  67          HD12      LEU  67   2.467   3.959  -6.526
  497   HD13  LEU  67          HD13      LEU  67   4.079   3.412  -6.955
  498   HD21  LEU  67          HD21      LEU  67   4.540   1.138  -7.456
  499   HD22  LEU  67          HD22      LEU  67   3.264  -0.068  -7.544
  500   HD23  LEU  67          HD23      LEU  67   3.896   0.416  -5.981
  501    H    THR  68           HN       THR  68  -1.696   1.620  -7.954
  502    HA   THR  68           HA       THR  68  -3.431   0.333  -6.005
  503    HB   THR  68           HB       THR  68  -3.876   1.113  -8.901
  504    HG1  THR  68           HG1      THR  68  -3.691   2.797  -7.190
  505   HG21  THR  68          HG21      THR  68  -6.255   0.655  -8.455
  506   HG22  THR  68          HG22      THR  68  -5.833   0.098  -6.835
  507   HG23  THR  68          HG23      THR  68  -5.270  -0.793  -8.248
  508    H    ASN  69           HN       ASN  69  -3.262  -1.812  -5.777
  509    HA   ASN  69           HA       ASN  69  -2.808  -3.960  -6.053
  510    HB2  ASN  69           HB2      ASN  69  -3.786  -3.368  -8.836
  511    HB3  ASN  69           HB1      ASN  69  -3.300  -4.985  -8.358
  512   HD21  ASN  69          HD21      ASN  69  -5.360  -5.766  -8.716
  513   HD22  ASN  69          HD22      ASN  69  -6.674  -5.420  -7.670
  514    HA   PRO  70           HA       PRO  70   1.364  -4.014  -7.915
  515    HB2  PRO  70           HB2      PRO  70   2.923  -3.410  -5.886
  516    HB3  PRO  70           HB1      PRO  70   2.017  -2.107  -6.670
  517    HG2  PRO  70           HG2      PRO  70   1.395  -3.581  -4.142
  518    HG3  PRO  70           HG1      PRO  70   1.337  -1.828  -4.437
  519    HD2  PRO  70           HD2      PRO  70  -0.871  -3.533  -4.551
  520    HD3  PRO  70           HD1      PRO  70  -0.756  -1.958  -5.363
  521    H    SER  71           HN       SER  71   3.048  -5.663  -7.376
  522    HA   SER  71           HA       SER  71   2.024  -7.823  -5.725
  523    HB2  SER  71           HB2      SER  71   4.597  -7.754  -7.314
  524    HB3  SER  71           HB1      SER  71   3.686  -9.169  -6.785
  525    HG   SER  71           HG       SER  71   3.118  -7.308  -8.781
  526    H    ALA  72           HN       ALA  72   3.392  -8.774  -4.069
  527    HA   ALA  72           HA       ALA  72   4.347  -6.931  -2.215
  528    HB1  ALA  72           HB1      ALA  72   5.145  -8.855  -0.945
  529    HB2  ALA  72           HB2      ALA  72   4.984  -9.878  -2.371
  530    HB3  ALA  72           HB3      ALA  72   3.551  -9.176  -1.627
  531    H    ASP  73           HN       ASP  73   6.065  -8.790  -4.631
  532    HA   ASP  73           HA       ASP  73   8.674  -8.152  -3.718
  533    HB2  ASP  73           HB2      ASP  73   8.162 -10.046  -5.263
  534    HB3  ASP  73           HB1      ASP  73   7.873  -8.867  -6.539
  535    H    GLU  74           HN       GLU  74   6.455  -6.616  -5.926
  536    HA   GLU  74           HA       GLU  74   8.241  -4.677  -6.977
  537    HB2  GLU  74           HB2      GLU  74   5.227  -4.595  -6.696
  538    HB3  GLU  74           HB1      GLU  74   6.180  -3.471  -7.646
  539    HG2  GLU  74           HG2      GLU  74   6.878  -5.268  -9.120
  540    HG3  GLU  74           HG1      GLU  74   5.964  -6.425  -8.157
  541    H    VAL  75           HN       VAL  75   6.122  -4.842  -4.225
  542    HA   VAL  75           HA       VAL  75   6.425  -2.187  -3.328
  543    HB   VAL  75           HB       VAL  75   5.742  -4.704  -1.766
  544   HG11  VAL  75          HG11      VAL  75   5.365  -1.813  -0.993
  545   HG12  VAL  75          HG12      VAL  75   6.504  -2.947  -0.267
  546   HG13  VAL  75          HG13      VAL  75   4.769  -3.210  -0.098
  547   HG21  VAL  75          HG21      VAL  75   3.972  -2.587  -2.974
  548   HG22  VAL  75          HG22      VAL  75   3.427  -3.943  -1.987
  549   HG23  VAL  75          HG23      VAL  75   4.174  -4.238  -3.558
  550    H    LYS  76           HN       LYS  76   8.087  -5.195  -2.464
  551    HA   LYS  76           HA       LYS  76   9.856  -4.262  -0.563
  552    HB2  LYS  76           HB2      LYS  76   9.695  -6.588  -0.874
  553    HB3  LYS  76           HB1      LYS  76  10.084  -6.482  -2.586
  554    HG2  LYS  76           HG2      LYS  76  12.389  -5.876  -2.015
  555    HG3  LYS  76           HG1      LYS  76  11.983  -5.963  -0.300
  556    HD2  LYS  76           HD2      LYS  76  11.549  -8.309  -0.454
  557    HD3  LYS  76           HD1      LYS  76  11.687  -8.278  -2.209
  558    HE2  LYS  76           HE2      LYS  76  13.928  -7.606  -0.310
  559    HE3  LYS  76           HE1      LYS  76  13.697  -9.185  -1.065
  560    HZ1  LYS  76           HZ1      LYS  76  15.299  -7.825  -2.292
  561    HZ2  LYS  76           HZ2      LYS  76  14.135  -6.638  -2.572
  562    HZ3  LYS  76           HZ3      LYS  76  13.949  -8.166  -3.224
  563    H    ALA  77           HN       ALA  77  10.233  -4.217  -4.064
  564    HA   ALA  77           HA       ALA  77  12.879  -3.150  -4.095
  565    HB1  ALA  77           HB1      ALA  77  12.488  -2.738  -6.465
  566    HB2  ALA  77           HB2      ALA  77  10.757  -2.997  -6.243
  567    HB3  ALA  77           HB3      ALA  77  11.884  -4.334  -6.020
  568    H    LYS  78           HN       LYS  78   9.828  -1.688  -3.558
  569    HA   LYS  78           HA       LYS  78  10.884   0.955  -4.070
  570    HB2  LYS  78           HB2      LYS  78   8.245   0.082  -2.878
  571    HB3  LYS  78           HB1      LYS  78   8.694   1.752  -3.179
  572    HG2  LYS  78           HG2      LYS  78   8.462  -0.371  -5.300
  573    HG3  LYS  78           HG1      LYS  78   7.206   0.804  -4.907
  574    HD2  LYS  78           HD2      LYS  78   8.705   2.630  -5.536
  575    HD3  LYS  78           HD1      LYS  78   9.992   1.474  -5.865
  576    HE2  LYS  78           HE2      LYS  78   8.876   2.234  -7.926
  577    HE3  LYS  78           HE1      LYS  78   8.710   0.498  -7.677
  578    HZ1  LYS  78           HZ1      LYS  78   6.488   0.885  -6.846
  579    HZ2  LYS  78           HZ2      LYS  78   6.664   1.443  -8.408
  580    HZ3  LYS  78           HZ3      LYS  78   6.638   2.552  -7.116
  581    H    LEU  79           HN       LEU  79  10.169  -1.100  -1.285
  582    HA   LEU  79           HA       LEU  79  10.640   0.808   0.718
  583    HB2  LEU  79           HB2      LEU  79  10.910  -2.174   0.725
  584    HB3  LEU  79           HB1      LEU  79  11.573  -1.276   2.062
  585    HG   LEU  79           HG       LEU  79   9.368  -2.231   2.588
  586   HD11  LEU  79          HD11      LEU  79  10.110  -0.162   3.677
  587   HD12  LEU  79          HD12      LEU  79   8.391  -0.463   3.622
  588   HD13  LEU  79          HD13      LEU  79   9.066   0.752   2.562
  589   HD21  LEU  79          HD21      LEU  79   8.459  -2.147   0.309
  590   HD22  LEU  79          HD22      LEU  79   8.300  -0.395   0.472
  591   HD23  LEU  79          HD23      LEU  79   7.377  -1.482   1.524
  592    H    VAL  80           HN       VAL  80  12.907  -1.197  -0.967
  593    HA   VAL  80           HA       VAL  80  15.120  -0.464   0.577
  594    HB   VAL  80           HB       VAL  80  16.511  -1.329  -1.334
  595   HG11  VAL  80          HG11      VAL  80  14.141  -3.021  -0.585
  596   HG12  VAL  80          HG12      VAL  80  15.659  -2.886   0.309
  597   HG13  VAL  80          HG13      VAL  80  15.639  -3.620  -1.292
  598   HG21  VAL  80          HG21      VAL  80  15.168  -0.545  -3.185
  599   HG22  VAL  80          HG22      VAL  80  13.850  -1.595  -2.691
  600   HG23  VAL  80          HG23      VAL  80  15.360  -2.298  -3.274
  601    H    LYS  81           HN       LYS  81  13.706   1.024  -2.272
  602    HA   LYS  81           HA       LYS  81  15.779   2.991  -2.329
  603    HB2  LYS  81           HB2      LYS  81  14.732   3.907  -4.348
  604    HB3  LYS  81           HB1      LYS  81  15.002   2.173  -4.466
  605    HG2  LYS  81           HG2      LYS  81  12.696   1.743  -4.067
  606    HG3  LYS  81           HG1      LYS  81  12.371   3.465  -3.866
  607    HD2  LYS  81           HD2      LYS  81  13.389   2.135  -6.389
  608    HD3  LYS  81           HD1      LYS  81  11.736   2.685  -6.117
  609    HE2  LYS  81           HE2      LYS  81  12.557   4.993  -5.882
  610    HE3  LYS  81           HE1      LYS  81  14.202   4.441  -6.201
  611    HZ1  LYS  81           HZ1      LYS  81  11.901   4.295  -8.048
  612    HZ2  LYS  81           HZ2      LYS  81  13.428   3.671  -8.371
  613    HZ3  LYS  81           HZ3      LYS  81  13.227   5.335  -8.179
  614    H    ILE  82           HN       ILE  82  12.276   3.154  -1.664
  615    HA   ILE  82           HA       ILE  82  12.430   5.967  -1.451
  616    HB   ILE  82           HB       ILE  82  10.073   6.002  -0.722
  617   HG12  ILE  82          HG12      ILE  82   8.753   3.801  -0.952
  618   HG13  ILE  82          HG11      ILE  82  10.288   2.974  -0.790
  619   HG21  ILE  82          HG21      ILE  82  10.607   6.045  -3.062
  620   HG22  ILE  82          HG22      ILE  82   9.115   5.145  -2.798
  621   HG23  ILE  82          HG23      ILE  82  10.614   4.281  -3.124
  622   HD11  ILE  82          HD11      ILE  82  10.545   3.931   1.453
  623   HD12  ILE  82          HD12      ILE  82   9.062   2.987   1.299
  624   HD13  ILE  82          HD13      ILE  82   8.990   4.748   1.273
  625    H    ALA  83           HN       ALA  83  13.136   3.619   0.783
  626    HA   ALA  83           HA       ALA  83  12.620   5.244   3.102
  627    HB1  ALA  83           HB1      ALA  83  12.609   2.798   3.261
  628    HB2  ALA  83           HB2      ALA  83  13.827   3.506   4.329
  629    HB3  ALA  83           HB3      ALA  83  14.310   2.774   2.801
  630    H    GLY  84           HN       GLY  84  14.918   5.235   0.663
  631    HA2  GLY  84           HA2      GLY  84  16.916   6.278   0.368
  632    HA3  GLY  84           HA1      GLY  84  16.527   7.231   1.800
  633    H    LEU  85           HN       LEU  85  17.312   3.881   1.091
  634    HA   LEU  85           HA       LEU  85  19.331   4.043   3.211
  635    HB2  LEU  85           HB2      LEU  85  17.089   3.065   3.992
  636    HB3  LEU  85           HB1      LEU  85  17.423   1.709   2.948
  637    HG   LEU  85           HG       LEU  85  17.880   1.202   5.302
  638   HD11  LEU  85          HD11      LEU  85  20.395   1.261   3.662
  639   HD12  LEU  85          HD12      LEU  85  19.190  -0.027   3.697
  640   HD13  LEU  85          HD13      LEU  85  20.154   0.327   5.135
  641   HD21  LEU  85          HD21      LEU  85  19.956   3.375   5.143
  642   HD22  LEU  85          HD22      LEU  85  19.724   2.268   6.496
  643   HD23  LEU  85          HD23      LEU  85  18.461   3.422   6.075
  644    H    GLU  86           HN       GLU  86  17.990   1.541   1.041
  645    HA   GLU  86           HA       GLU  86  20.693   0.662   0.495
  646    HB2  GLU  86           HB2      GLU  86  18.805  -0.851   1.213
  647    HB3  GLU  86           HB1      GLU  86  18.049  -0.541  -0.332
  648    HG2  GLU  86           HG2      GLU  86  19.818  -1.635  -1.504
  649    HG3  GLU  86           HG1      GLU  86  20.785  -1.757  -0.035
  650    H    HIS  87           HN       HIS  87  18.826   2.929  -0.659
  651    HA   HIS  87           HA       HIS  87  20.300   3.351  -3.014
  652    HB2  HIS  87           HB2      HIS  87  18.564   1.743  -3.912
  653    HB3  HIS  87           HB1      HIS  87  17.314   2.819  -3.338
  654    HD1  HIS  87           HD1      HIS  87  16.801   4.945  -4.784
  655    HD2  HIS  87           HD2      HIS  87  19.926   2.604  -6.213
  656    HE1  HIS  87           HE1      HIS  87  17.289   5.776  -7.091
  657    H    HIS  88           HN       HIS  88  20.406   5.516  -3.180
  658    HA   HIS  88           HA       HIS  88  18.424   7.096  -1.722
  659    HB2  HIS  88           HB2      HIS  88  21.367   7.638  -2.187
  660    HB3  HIS  88           HB1      HIS  88  20.244   8.881  -1.657
  661    HD1  HIS  88           HD1      HIS  88  19.534   8.841   0.826
  662    HD2  HIS  88           HD2      HIS  88  22.015   5.700  -0.260
  663    HE1  HIS  88           HE1      HIS  88  20.283   7.781   2.969
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1   0.716   6.498  14.295
    2    H2   MET   1           HT2      MET   1  -0.407   7.001  13.162
    3    H3   MET   1           HT3      MET   1  -0.424   7.699  14.690
    4    HA   MET   1           HA       MET   1   0.559   9.156  13.033
    5    HB2  MET   1           HB2      MET   1   2.768   7.934  14.729
    6    HB3  MET   1           HB1      MET   1   2.745   9.547  14.058
    7    HG2  MET   1           HG2      MET   1   0.958   8.486  16.230
    8    HG3  MET   1           HG1      MET   1   2.283   9.631  16.414
    9    HE1  MET   1           HE1      MET   1  -0.644  10.077  17.560
   10    HE2  MET   1           HE2      MET   1  -0.918  11.771  17.154
   11    HE3  MET   1           HE3      MET   1   0.656  11.252  17.756
   12    H    VAL   2           HN       VAL   2   2.790   9.343  11.765
   13    HA   VAL   2           HA       VAL   2   2.691   7.154   9.926
   14    HB   VAL   2           HB       VAL   2   4.585   9.531   9.896
   15   HG11  VAL   2          HG11      VAL   2   4.881   9.017   7.513
   16   HG12  VAL   2          HG12      VAL   2   3.864   7.588   7.698
   17   HG13  VAL   2          HG13      VAL   2   5.413   7.680   8.535
   18   HG21  VAL   2          HG21      VAL   2   2.252  10.247   9.784
   19   HG22  VAL   2          HG22      VAL   2   1.963   9.135   8.448
   20   HG23  VAL   2          HG23      VAL   2   3.059  10.501   8.237
   21    H    THR   3           HN       THR   3   3.294   5.479  11.214
   22    HA   THR   3           HA       THR   3   6.141   5.274  11.873
   23    HB   THR   3           HB       THR   3   4.616   4.892  13.773
   24    HG1  THR   3           HG1      THR   3   6.049   2.676  12.775
   25   HG21  THR   3          HG21      THR   3   3.075   2.966  13.805
   26   HG22  THR   3          HG22      THR   3   3.483   2.621  12.124
   27   HG23  THR   3          HG23      THR   3   2.644   4.116  12.539
   28    H    ALA   4           HN       ALA   4   4.301   4.769   9.348
   29    HA   ALA   4           HA       ALA   4   5.650   2.323   8.580
   30    HB1  ALA   4           HB1      ALA   4   3.362   1.700   9.162
   31    HB2  ALA   4           HB2      ALA   4   3.620   1.596   7.416
   32    HB3  ALA   4           HB3      ALA   4   2.741   2.964   8.097
   33    H    ALA   5           HN       ALA   5   6.317   2.358   6.503
   34    HA   ALA   5           HA       ALA   5   6.449   4.963   5.273
   35    HB1  ALA   5           HB1      ALA   5   7.668   2.330   4.510
   36    HB2  ALA   5           HB2      ALA   5   8.438   3.587   5.482
   37    HB3  ALA   5           HB3      ALA   5   8.049   3.890   3.783
   38    H    LEU   6           HN       LEU   6   4.470   2.270   5.023
   39    HA   LEU   6           HA       LEU   6   3.430   3.270   2.512
   40    HB2  LEU   6           HB2      LEU   6   2.740   0.915   1.924
   41    HB3  LEU   6           HB1      LEU   6   4.404   1.315   1.652
   42    HG   LEU   6           HG       LEU   6   3.509  -0.178   4.105
   43   HD11  LEU   6          HD11      LEU   6   4.064  -2.235   2.848
   44   HD12  LEU   6          HD12      LEU   6   4.320  -1.270   1.398
   45   HD13  LEU   6          HD13      LEU   6   2.712  -1.386   2.107
   46   HD21  LEU   6          HD21      LEU   6   5.812  -1.001   4.043
   47   HD22  LEU   6          HD22      LEU   6   5.774   0.765   4.101
   48   HD23  LEU   6          HD23      LEU   6   6.102  -0.061   2.579
   49    H    THR   7           HN       THR   7   1.485   3.785   2.559
   50    HA   THR   7           HA       THR   7  -0.226   2.901   4.752
   51    HB   THR   7           HB       THR   7  -0.682   5.150   2.776
   52    HG1  THR   7           HG1      THR   7   1.171   4.901   4.757
   53   HG21  THR   7          HG21      THR   7  -1.608   4.684   5.615
   54   HG22  THR   7          HG22      THR   7  -2.588   4.455   4.165
   55   HG23  THR   7          HG23      THR   7  -2.029   6.067   4.606
   56    H    ILE   8           HN       ILE   8  -1.585   1.265   4.157
   57    HA   ILE   8           HA       ILE   8  -2.204   0.912   1.307
   58    HB   ILE   8           HB       ILE   8  -2.358  -1.133   3.556
   59   HG12  ILE   8          HG12      ILE   8  -0.425  -0.899   1.241
   60   HG13  ILE   8          HG11      ILE   8  -0.046  -0.644   2.941
   61   HG21  ILE   8          HG21      ILE   8  -2.846  -2.786   1.830
   62   HG22  ILE   8          HG22      ILE   8  -2.833  -1.533   0.591
   63   HG23  ILE   8          HG23      ILE   8  -4.067  -1.513   1.860
   64   HD11  ILE   8          HD11      ILE   8   0.731  -2.818   2.186
   65   HD12  ILE   8          HD12      ILE   8  -0.905  -3.247   1.687
   66   HD13  ILE   8          HD13      ILE   8  -0.540  -3.010   3.391
   67    H    TYR   9           HN       TYR   9  -4.232   0.954   0.672
   68    HA   TYR   9           HA       TYR   9  -6.251   1.680   2.618
   69    HB2  TYR   9           HB2      TYR   9  -6.256   1.596  -0.405
   70    HB3  TYR   9           HB1      TYR   9  -7.593   2.197   0.563
   71    HD1  TYR   9           HD2      TYR   9  -7.165   4.231   2.060
   72    HD2  TYR   9           HD1      TYR   9  -4.439   3.012  -0.967
   73    HE1  TYR   9           HE2      TYR   9  -6.110   6.450   2.114
   74    HE2  TYR   9           HE1      TYR   9  -3.376   5.221  -0.908
   75    HH   TYR   9           HH       TYR   9  -3.962   7.512  -0.264
   76    H    THR  10           HN       THR  10  -7.497   0.079   3.525
   77    HA   THR  10           HA       THR  10  -7.964  -2.336   1.939
   78    HB   THR  10           HB       THR  10  -7.932  -3.553   4.154
   79    HG1  THR  10           HG1      THR  10  -6.980  -2.546   5.889
   80   HG21  THR  10          HG21      THR  10  -5.494  -3.778   4.214
   81   HG22  THR  10          HG22      THR  10  -5.328  -2.282   3.299
   82   HG23  THR  10          HG23      THR  10  -6.059  -3.699   2.542
   83    H    THR  11           HN       THR  11  -9.648  -3.696   3.519
   84    HA   THR  11           HA       THR  11 -11.727  -2.121   4.650
   85    HB   THR  11           HB       THR  11 -12.306  -3.868   2.142
   86    HG1  THR  11           HG1      THR  11 -11.482  -1.350   2.408
   87   HG21  THR  11          HG21      THR  11 -14.096  -1.947   3.645
   88   HG22  THR  11          HG22      THR  11 -14.081  -3.684   3.889
   89   HG23  THR  11          HG23      THR  11 -14.542  -3.021   2.310
   90    H    SER  12           HN       SER  12 -12.869  -3.559   6.155
   91    HA   SER  12           HA       SER  12 -11.603  -5.891   7.015
   92    HB2  SER  12           HB2      SER  12 -14.572  -5.285   7.316
   93    HB3  SER  12           HB1      SER  12 -13.614  -6.356   8.325
   94    HG   SER  12           HG       SER  12 -13.247  -3.542   8.059
   95    H    TRP  13           HN       TRP  13 -14.523  -5.588   5.007
   96    HA   TRP  13           HA       TRP  13 -14.265  -8.226   3.851
   97    HB2  TRP  13           HB2      TRP  13 -16.359  -7.551   3.211
   98    HB3  TRP  13           HB1      TRP  13 -16.053  -5.862   3.532
   99    HD1  TRP  13           HD1      TRP  13 -14.728  -8.313   0.886
  100    HE1  TRP  13           HE1      TRP  13 -14.812  -7.255  -1.304
  101    HE3  TRP  13           HE3      TRP  13 -17.017  -3.996   2.284
  102    HZ2  TRP  13           HZ2      TRP  13 -15.890  -4.828  -2.491
  103    HZ3  TRP  13           HZ3      TRP  13 -17.586  -2.361   0.547
  104    HH2  TRP  13           HH2      TRP  13 -17.038  -2.768  -1.795
  105    H    CYS  14           HN       CYS  14 -12.670  -8.942   2.953
  106    HA   CYS  14           HA       CYS  14 -11.201  -7.336   1.076
  107    HB2  CYS  14           HB2      CYS  14 -10.094  -6.701   3.109
  108    HB3  CYS  14           HB1      CYS  14  -9.958  -8.387   3.642
  109    H    GLY  15           HN       GLY  15 -10.902  -8.625  -0.588
  110    HA2  GLY  15           HA2      GLY  15 -10.630 -11.501  -0.066
  111    HA3  GLY  15           HA1      GLY  15 -11.356 -10.828  -1.527
  112    H    TYR  16           HN       TYR  16  -9.881  -9.310  -2.721
  113    HA   TYR  16           HA       TYR  16  -7.595 -10.823  -3.489
  114    HB2  TYR  16           HB2      TYR  16  -9.022  -9.708  -5.128
  115    HB3  TYR  16           HB1      TYR  16  -8.647  -8.148  -4.418
  116    HD1  TYR  16           HD1      TYR  16  -7.251 -10.972  -6.313
  117    HD2  TYR  16           HD2      TYR  16  -6.695  -6.976  -5.021
  118    HE1  TYR  16           HE1      TYR  16  -5.363 -10.740  -7.859
  119    HE2  TYR  16           HE2      TYR  16  -4.804  -6.732  -6.558
  120    HH   TYR  16           HH       TYR  16  -3.197  -8.123  -7.751
  121    H    CYS  17           HN       CYS  17  -8.153  -7.964  -1.588
  122    HA   CYS  17           HA       CYS  17  -5.564  -6.901  -1.622
  123    HB2  CYS  17           HB2      CYS  17  -6.468  -6.052   0.774
  124    HB3  CYS  17           HB1      CYS  17  -7.049  -5.352  -0.755
  125    H    LEU  18           HN       LEU  18  -6.910  -9.564   0.150
  126    HA   LEU  18           HA       LEU  18  -5.158  -9.726   2.346
  127    HB2  LEU  18           HB2      LEU  18  -7.401 -10.895   1.967
  128    HB3  LEU  18           HB1      LEU  18  -6.548 -12.024   0.951
  129    HG   LEU  18           HG       LEU  18  -7.091 -12.923   3.183
  130   HD11  LEU  18          HD11      LEU  18  -5.221 -13.909   2.042
  131   HD12  LEU  18          HD12      LEU  18  -4.927 -13.859   3.779
  132   HD13  LEU  18          HD13      LEU  18  -4.136 -12.692   2.716
  133   HD21  LEU  18          HD21      LEU  18  -5.907 -12.133   5.164
  134   HD22  LEU  18          HD22      LEU  18  -6.948 -10.885   4.482
  135   HD23  LEU  18          HD23      LEU  18  -5.204 -10.820   4.223
  136    H    ARG  19           HN       ARG  19  -4.987 -10.876  -0.926
  137    HA   ARG  19           HA       ARG  19  -2.956 -12.748  -0.984
  138    HB2  ARG  19           HB2      ARG  19  -4.349 -12.147  -2.886
  139    HB3  ARG  19           HB1      ARG  19  -3.600 -10.566  -2.962
  140    HG2  ARG  19           HG2      ARG  19  -1.455 -11.638  -3.518
  141    HG3  ARG  19           HG1      ARG  19  -2.266 -13.205  -3.530
  142    HD2  ARG  19           HD2      ARG  19  -3.793 -12.345  -5.282
  143    HD3  ARG  19           HD1      ARG  19  -2.875 -10.843  -5.302
  144    HE   ARG  19           HE       ARG  19  -1.325 -13.223  -5.719
  145   HH11  ARG  19          HH11      ARG  19  -3.100 -10.576  -7.340
  146   HH12  ARG  19          HH12      ARG  19  -2.418 -10.888  -8.843
  147   HH21  ARG  19          HH21      ARG  19  -0.412 -13.608  -7.811
  148   HH22  ARG  19          HH22      ARG  19  -0.880 -12.637  -9.134
  149    H    LEU  20           HN       LEU  20  -2.724  -9.261  -1.145
  150    HA   LEU  20           HA       LEU  20   0.140  -9.284  -1.379
  151    HB2  LEU  20           HB2      LEU  20  -1.168  -7.636  -2.579
  152    HB3  LEU  20           HB1      LEU  20  -1.886  -7.079  -1.089
  153    HG   LEU  20           HG       LEU  20   0.571  -6.472  -0.467
  154   HD11  LEU  20          HD11      LEU  20   0.765  -6.616  -3.466
  155   HD12  LEU  20          HD12      LEU  20   1.878  -7.332  -2.275
  156   HD13  LEU  20          HD13      LEU  20   1.777  -5.606  -2.474
  157   HD21  LEU  20          HD21      LEU  20  -1.138  -4.854  -0.577
  158   HD22  LEU  20          HD22      LEU  20  -1.233  -4.968  -2.315
  159   HD23  LEU  20          HD23      LEU  20   0.198  -4.237  -1.558
  160    H    LYS  21           HN       LYS  21  -2.330  -8.437   0.937
  161    HA   LYS  21           HA       LYS  21  -0.933  -7.132   2.902
  162    HB2  LYS  21           HB2      LYS  21  -3.335  -7.192   2.835
  163    HB3  LYS  21           HB1      LYS  21  -3.337  -8.931   3.062
  164    HG2  LYS  21           HG2      LYS  21  -2.464  -8.641   5.312
  165    HG3  LYS  21           HG1      LYS  21  -2.422  -6.904   5.068
  166    HD2  LYS  21           HD2      LYS  21  -4.788  -6.766   4.892
  167    HD3  LYS  21           HD1      LYS  21  -4.945  -8.518   4.827
  168    HE2  LYS  21           HE2      LYS  21  -5.538  -7.621   7.054
  169    HE3  LYS  21           HE1      LYS  21  -4.171  -8.725   7.114
  170    HZ1  LYS  21           HZ1      LYS  21  -3.731  -6.882   8.482
  171    HZ2  LYS  21           HZ2      LYS  21  -4.103  -5.753   7.332
  172    HZ3  LYS  21           HZ3      LYS  21  -2.701  -6.714   7.166
  173    H    THR  22           HN       THR  22  -1.531 -10.653   2.694
  174    HA   THR  22           HA       THR  22  -0.060 -11.073   5.078
  175    HB   THR  22           HB       THR  22  -1.885 -12.625   4.465
  176    HG1  THR  22           HG1      THR  22  -0.160 -13.276   5.779
  177   HG21  THR  22          HG21      THR  22  -1.565 -12.707   2.036
  178   HG22  THR  22          HG22      THR  22  -1.525 -14.338   2.712
  179   HG23  THR  22          HG23      THR  22  -0.023 -13.533   2.258
  180    H    ALA  23           HN       ALA  23   0.790 -10.937   1.740
  181    HA   ALA  23           HA       ALA  23   3.271 -12.372   1.844
  182    HB1  ALA  23           HB1      ALA  23   2.398 -10.183  -0.028
  183    HB2  ALA  23           HB2      ALA  23   2.064 -11.902  -0.263
  184    HB3  ALA  23           HB3      ALA  23   3.730 -11.307  -0.294
  185    H    LEU  24           HN       LEU  24   2.390  -9.011   2.195
  186    HA   LEU  24           HA       LEU  24   5.023  -8.034   2.425
  187    HB2  LEU  24           HB2      LEU  24   2.478  -6.941   3.567
  188    HB3  LEU  24           HB1      LEU  24   3.967  -6.029   3.402
  189    HG   LEU  24           HG       LEU  24   2.135  -7.024   1.236
  190   HD11  LEU  24          HD11      LEU  24   1.432  -5.019   2.346
  191   HD12  LEU  24          HD12      LEU  24   1.960  -4.657   0.703
  192   HD13  LEU  24          HD13      LEU  24   3.008  -4.282   2.071
  193   HD21  LEU  24          HD21      LEU  24   4.418  -7.367   0.472
  194   HD22  LEU  24          HD22      LEU  24   4.842  -5.720   0.935
  195   HD23  LEU  24          HD23      LEU  24   3.692  -6.000  -0.373
  196    H    THR  25           HN       THR  25   2.651  -9.042   4.794
  197    HA   THR  25           HA       THR  25   4.051  -8.428   7.106
  198    HB   THR  25           HB       THR  25   2.066 -10.672   6.655
  199    HG1  THR  25           HG1      THR  25   0.936  -8.883   6.120
  200   HG21  THR  25          HG21      THR  25   3.228 -10.846   8.813
  201   HG22  THR  25          HG22      THR  25   1.550 -10.361   9.058
  202   HG23  THR  25          HG23      THR  25   2.839  -9.165   9.171
  203    H    ALA  26           HN       ALA  26   4.042 -11.414   5.148
  204    HA   ALA  26           HA       ALA  26   5.797 -12.824   6.893
  205    HB1  ALA  26           HB1      ALA  26   5.070 -13.412   4.026
  206    HB2  ALA  26           HB2      ALA  26   4.200 -13.984   5.453
  207    HB3  ALA  26           HB3      ALA  26   5.848 -14.527   5.150
  208    H    ASN  27           HN       ASN  27   6.345 -10.371   4.729
  209    HA   ASN  27           HA       ASN  27   9.114 -11.199   4.248
  210    HB2  ASN  27           HB2      ASN  27   7.190  -9.613   2.645
  211    HB3  ASN  27           HB1      ASN  27   8.910  -9.197   2.498
  212   HD21  ASN  27          HD21      ASN  27   6.402 -11.453   1.821
  213   HD22  ASN  27          HD22      ASN  27   7.337 -12.490   0.795
  214    H    ARG  28           HN       ARG  28   7.728  -9.740   6.562
  215    HA   ARG  28           HA       ARG  28   8.365  -8.307   8.192
  216    HB2  ARG  28           HB2      ARG  28  10.918  -7.958   6.616
  217    HB3  ARG  28           HB1      ARG  28  10.655  -7.401   8.259
  218    HG2  ARG  28           HG2      ARG  28  10.321  -9.758   8.929
  219    HG3  ARG  28           HG1      ARG  28  10.749 -10.241   7.288
  220    HD2  ARG  28           HD2      ARG  28  12.493  -8.720   9.223
  221    HD3  ARG  28           HD1      ARG  28  12.650 -10.414   8.780
  222    HE   ARG  28           HE       ARG  28  12.801  -8.762   6.485
  223   HH11  ARG  28          HH11      ARG  28  14.676  -9.769   9.315
  224   HH12  ARG  28          HH12      ARG  28  16.190  -9.557   8.572
  225   HH21  ARG  28          HH21      ARG  28  14.925  -8.475   5.442
  226   HH22  ARG  28          HH22      ARG  28  16.329  -8.827   6.328
  227    H    ILE  29           HN       ILE  29   7.158  -7.359   5.573
  228    HA   ILE  29           HA       ILE  29   8.006  -4.586   5.621
  229    HB   ILE  29           HB       ILE  29   5.952  -5.974   3.875
  230   HG12  ILE  29          HG12      ILE  29   8.794  -5.100   3.200
  231   HG13  ILE  29          HG11      ILE  29   8.271  -6.756   3.456
  232   HG21  ILE  29          HG21      ILE  29   5.487  -3.603   4.176
  233   HG22  ILE  29          HG22      ILE  29   6.024  -3.907   2.516
  234   HG23  ILE  29          HG23      ILE  29   7.131  -3.199   3.700
  235   HD11  ILE  29          HD11      ILE  29   7.326  -4.937   1.257
  236   HD12  ILE  29          HD12      ILE  29   6.854  -6.623   1.490
  237   HD13  ILE  29          HD13      ILE  29   8.527  -6.218   1.102
  238    H    ALA  30           HN       ALA  30   7.052  -3.243   6.970
  239    HA   ALA  30           HA       ALA  30   4.491  -3.977   8.139
  240    HB1  ALA  30           HB1      ALA  30   4.979  -2.211   9.746
  241    HB2  ALA  30           HB2      ALA  30   6.435  -1.804   8.830
  242    HB3  ALA  30           HB3      ALA  30   6.311  -3.373   9.636
  243    H    TYR  31           HN       TYR  31   2.711  -2.754   7.873
  244    HA   TYR  31           HA       TYR  31   2.908  -0.397   6.176
  245    HB2  TYR  31           HB2      TYR  31   0.921  -1.242   4.895
  246    HB3  TYR  31           HB1      TYR  31   2.399  -2.153   4.617
  247    HD1  TYR  31           HD2      TYR  31  -0.949  -2.233   6.136
  248    HD2  TYR  31           HD1      TYR  31   2.607  -4.439   5.366
  249    HE1  TYR  31           HE2      TYR  31  -2.097  -4.307   6.774
  250    HE2  TYR  31           HE1      TYR  31   1.463  -6.512   6.003
  251    HH   TYR  31           HH       TYR  31  -0.369  -7.175   7.335
  252    H    ASP  32           HN       ASP  32   0.743   0.718   6.138
  253    HA   ASP  32           HA       ASP  32  -0.731   0.200   8.615
  254    HB2  ASP  32           HB2      ASP  32   0.706   2.236   8.837
  255    HB3  ASP  32           HB1      ASP  32  -0.162   2.949   7.478
  256    H    GLU  33           HN       GLU  33  -2.740  -0.315   8.171
  257    HA   GLU  33           HA       GLU  33  -3.718   0.386   5.533
  258    HB2  GLU  33           HB2      GLU  33  -5.407  -1.348   5.872
  259    HB3  GLU  33           HB1      GLU  33  -3.775  -1.963   6.042
  260    HG2  GLU  33           HG2      GLU  33  -4.032  -1.917   8.472
  261    HG3  GLU  33           HG1      GLU  33  -5.687  -1.335   8.271
  262    H    VAL  34           HN       VAL  34  -5.477   1.526   5.172
  263    HA   VAL  34           HA       VAL  34  -6.100   3.415   7.266
  264    HB   VAL  34           HB       VAL  34  -7.041   3.532   4.406
  265   HG11  VAL  34          HG11      VAL  34  -8.248   4.998   5.884
  266   HG12  VAL  34          HG12      VAL  34  -7.220   5.927   4.793
  267   HG13  VAL  34          HG13      VAL  34  -6.739   5.695   6.480
  268   HG21  VAL  34          HG21      VAL  34  -5.118   4.982   3.996
  269   HG22  VAL  34          HG22      VAL  34  -4.628   3.351   4.461
  270   HG23  VAL  34          HG23      VAL  34  -4.540   4.669   5.632
  271    H    ASP  35           HN       ASP  35  -7.861   3.890   8.136
  272    HA   ASP  35           HA       ASP  35  -9.980   2.216   8.715
  273    HB2  ASP  35           HB2      ASP  35  -9.008   4.092  10.090
  274    HB3  ASP  35           HB1      ASP  35  -9.922   5.211   9.094
  275    H    ILE  36           HN       ILE  36  -9.763   3.491   5.759
  276    HA   ILE  36           HA       ILE  36 -11.745   5.300   5.114
  277    HB   ILE  36           HB       ILE  36 -11.820   4.448   2.822
  278   HG12  ILE  36          HG12      ILE  36  -9.865   2.347   3.646
  279   HG13  ILE  36          HG11      ILE  36 -11.597   2.012   3.624
  280   HG21  ILE  36          HG21      ILE  36  -9.056   4.588   3.996
  281   HG22  ILE  36          HG22      ILE  36 -10.046   5.952   3.465
  282   HG23  ILE  36          HG23      ILE  36  -9.459   4.783   2.293
  283   HD11  ILE  36          HD11      ILE  36 -10.437   1.290   1.561
  284   HD12  ILE  36          HD12      ILE  36 -10.038   3.004   1.251
  285   HD13  ILE  36          HD13      ILE  36 -11.704   2.473   1.277
  286    H    GLU  37           HN       GLU  37 -12.504   1.982   5.865
  287    HA   GLU  37           HA       GLU  37 -14.985   2.077   4.460
  288    HB2  GLU  37           HB2      GLU  37 -15.521  -0.011   5.580
  289    HB3  GLU  37           HB1      GLU  37 -13.878  -0.002   4.939
  290    HG2  GLU  37           HG2      GLU  37 -12.971   0.320   7.122
  291    HG3  GLU  37           HG1      GLU  37 -14.598   0.473   7.797
  292    H    HIS  38           HN       HIS  38 -13.864   3.144   7.484
  293    HA   HIS  38           HA       HIS  38 -16.574   3.898   8.340
  294    HB2  HIS  38           HB2      HIS  38 -13.931   3.930   9.829
  295    HB3  HIS  38           HB1      HIS  38 -15.437   4.527  10.491
  296    HD1  HIS  38           HD1      HIS  38 -16.930   2.801  11.620
  297    HD2  HIS  38           HD2      HIS  38 -13.749   1.119   9.550
  298    HE1  HIS  38           HE1      HIS  38 -16.856   0.373  12.304
  299    H    ASN  39           HN       ASN  39 -13.274   5.063   7.859
  300    HA   ASN  39           HA       ASN  39 -13.936   7.843   8.212
  301    HB2  ASN  39           HB2      ASN  39 -11.675   6.862   8.702
  302    HB3  ASN  39           HB1      ASN  39 -11.435   6.694   6.969
  303   HD21  ASN  39          HD21      ASN  39 -10.008   8.185   6.422
  304   HD22  ASN  39          HD22      ASN  39  -9.939   9.813   6.945
  305    H    ARG  40           HN       ARG  40 -15.338   8.555   6.703
  306    HA   ARG  40           HA       ARG  40 -15.206   7.846   3.973
  307    HB2  ARG  40           HB2      ARG  40 -16.809   9.708   3.569
  308    HB3  ARG  40           HB1      ARG  40 -17.318   8.590   4.824
  309    HG2  ARG  40           HG2      ARG  40 -16.749  10.149   6.536
  310    HG3  ARG  40           HG1      ARG  40 -15.975  11.225   5.371
  311    HD2  ARG  40           HD2      ARG  40 -18.897  10.496   5.346
  312    HD3  ARG  40           HD1      ARG  40 -18.230  11.949   6.092
  313    HE   ARG  40           HE       ARG  40 -17.321  11.914   3.466
  314   HH11  ARG  40          HH11      ARG  40 -20.493  11.986   4.992
  315   HH12  ARG  40          HH12      ARG  40 -21.173  13.064   3.866
  316   HH21  ARG  40          HH21      ARG  40 -18.196  13.393   1.950
  317   HH22  ARG  40          HH22      ARG  40 -19.830  13.888   2.066
  318    H    ALA  41           HN       ALA  41 -13.696  10.360   5.812
  319    HA   ALA  41           HA       ALA  41 -13.108  12.134   3.772
  320    HB1  ALA  41           HB1      ALA  41 -11.447  11.676   6.242
  321    HB2  ALA  41           HB2      ALA  41 -12.876  12.691   6.123
  322    HB3  ALA  41           HB3      ALA  41 -11.428  13.105   5.209
  323    H    ALA  42           HN       ALA  42 -11.181   9.396   4.804
  324    HA   ALA  42           HA       ALA  42  -9.290   9.952   2.681
  325    HB1  ALA  42           HB1      ALA  42  -8.443   9.068   4.798
  326    HB2  ALA  42           HB2      ALA  42  -8.082   7.965   3.468
  327    HB3  ALA  42           HB3      ALA  42  -9.402   7.608   4.581
  328    H    ALA  43           HN       ALA  43 -12.121   8.069   3.165
  329    HA   ALA  43           HA       ALA  43 -11.711   6.088   1.189
  330    HB1  ALA  43           HB1      ALA  43 -14.100   5.705   1.328
  331    HB2  ALA  43           HB2      ALA  43 -14.317   7.261   2.128
  332    HB3  ALA  43           HB3      ALA  43 -13.444   5.969   2.951
  333    H    GLU  44           HN       GLU  44 -13.155   9.274   1.152
  334    HA   GLU  44           HA       GLU  44 -13.957   9.316  -1.539
  335    HB2  GLU  44           HB2      GLU  44 -13.268  11.526   0.397
  336    HB3  GLU  44           HB1      GLU  44 -13.950  11.809  -1.201
  337    HG2  GLU  44           HG2      GLU  44 -15.954  10.656  -0.637
  338    HG3  GLU  44           HG1      GLU  44 -15.271  10.104   0.889
  339    H    PHE  45           HN       PHE  45 -10.875   9.722  -0.045
  340    HA   PHE  45           HA       PHE  45  -9.589  10.974  -2.286
  341    HB2  PHE  45           HB2      PHE  45  -8.656  11.185   0.004
  342    HB3  PHE  45           HB1      PHE  45  -8.408   9.450   0.058
  343    HD1  PHE  45           HD1      PHE  45  -7.384  12.511  -1.771
  344    HD2  PHE  45           HD2      PHE  45  -6.382   8.520  -0.674
  345    HE1  PHE  45           HE1      PHE  45  -5.117  12.831  -2.675
  346    HE2  PHE  45           HE2      PHE  45  -4.105   8.849  -1.588
  347    HZ   PHE  45           HZ       PHE  45  -3.486  10.998  -2.587
  348    H    VAL  46           HN       VAL  46 -10.072   7.723  -1.094
  349    HA   VAL  46           HA       VAL  46  -8.440   6.385  -2.973
  350    HB   VAL  46           HB       VAL  46 -10.909   5.276  -1.608
  351   HG11  VAL  46          HG11      VAL  46  -9.831   3.092  -1.919
  352   HG12  VAL  46          HG12      VAL  46  -8.486   3.873  -2.748
  353   HG13  VAL  46          HG13      VAL  46 -10.090   3.897  -3.471
  354   HG21  VAL  46          HG21      VAL  46  -9.389   6.177   0.042
  355   HG22  VAL  46          HG22      VAL  46  -8.042   5.311  -0.696
  356   HG23  VAL  46          HG23      VAL  46  -9.344   4.416   0.084
  357    H    GLY  47           HN       GLY  47 -11.864   7.251  -2.937
  358    HA2  GLY  47           HA2      GLY  47 -12.519   6.059  -5.432
  359    HA3  GLY  47           HA1      GLY  47 -13.444   7.308  -4.606
  360    H    SER  48           HN       SER  48 -10.969   9.017  -4.590
  361    HA   SER  48           HA       SER  48 -11.438  10.259  -7.128
  362    HB2  SER  48           HB2      SER  48 -11.175  11.563  -5.006
  363    HB3  SER  48           HB1      SER  48  -9.492  11.047  -4.939
  364    HG   SER  48           HG       SER  48  -9.121  12.719  -6.107
  365    H    VAL  49           HN       VAL  49  -8.741   8.567  -5.518
  366    HA   VAL  49           HA       VAL  49  -7.042   8.946  -7.796
  367    HB   VAL  49           HB       VAL  49  -6.055   8.766  -5.520
  368   HG11  VAL  49          HG11      VAL  49  -5.804   6.616  -4.398
  369   HG12  VAL  49          HG12      VAL  49  -6.854   5.876  -5.610
  370   HG13  VAL  49          HG13      VAL  49  -7.488   7.128  -4.540
  371   HG21  VAL  49          HG21      VAL  49  -4.612   8.325  -7.411
  372   HG22  VAL  49          HG22      VAL  49  -5.096   6.629  -7.416
  373   HG23  VAL  49          HG23      VAL  49  -4.175   7.280  -6.059
  374    H    ASN  50           HN       ASN  50  -9.073   6.331  -6.613
  375    HA   ASN  50           HA       ASN  50  -8.493   4.893  -9.075
  376    HB2  ASN  50           HB2      ASN  50  -9.772   3.919  -6.498
  377    HB3  ASN  50           HB1      ASN  50  -9.692   2.957  -7.969
  378   HD21  ASN  50          HD21      ASN  50  -8.548   2.403  -5.337
  379   HD22  ASN  50          HD22      ASN  50  -6.859   2.233  -5.582
  380    H    GLY  51           HN       GLY  51  -9.699   5.940 -10.463
  381    HA2  GLY  51           HA2      GLY  51 -12.378   6.813  -9.833
  382    HA3  GLY  51           HA1      GLY  51 -11.540   7.030 -11.361
  383    H    GLY  52           HN       GLY  52 -14.265   6.031 -10.600
  384    HA2  GLY  52           HA2      GLY  52 -15.653   4.720 -11.933
  385    HA3  GLY  52           HA1      GLY  52 -14.246   3.803 -12.466
  386    H    ASN  53           HN       ASN  53 -13.115   2.729 -10.496
  387    HA   ASN  53           HA       ASN  53 -15.189   1.450  -8.846
  388    HB2  ASN  53           HB2      ASN  53 -14.159  -0.713  -9.128
  389    HB3  ASN  53           HB1      ASN  53 -14.427  -0.055 -10.734
  390   HD21  ASN  53          HD21      ASN  53 -12.642   0.626 -11.936
  391   HD22  ASN  53          HD22      ASN  53 -11.031   0.148 -11.557
  392    H    ARG  54           HN       ARG  54 -14.533   0.962  -6.754
  393    HA   ARG  54           HA       ARG  54 -12.121   2.343  -5.974
  394    HB2  ARG  54           HB2      ARG  54 -14.170   2.660  -4.591
  395    HB3  ARG  54           HB1      ARG  54 -14.173   0.939  -4.230
  396    HG2  ARG  54           HG2      ARG  54 -11.947   1.203  -3.175
  397    HG3  ARG  54           HG1      ARG  54 -12.075   2.941  -3.440
  398    HD2  ARG  54           HD2      ARG  54 -12.706   2.341  -1.157
  399    HD3  ARG  54           HD1      ARG  54 -14.070   3.016  -2.042
  400    HE   ARG  54           HE       ARG  54 -15.020   0.888  -2.206
  401   HH11  ARG  54          HH11      ARG  54 -12.088   0.811  -0.179
  402   HH12  ARG  54          HH12      ARG  54 -12.564  -0.600   0.664
  403   HH21  ARG  54          HH21      ARG  54 -15.621  -1.027  -1.029
  404   HH22  ARG  54          HH22      ARG  54 -14.591  -1.639   0.189
  405    H    THR  55           HN       THR  55 -10.589   1.024  -6.877
  406    HA   THR  55           HA       THR  55 -10.328  -1.739  -6.467
  407    HB   THR  55           HB       THR  55  -7.978   0.140  -6.708
  408    HG1  THR  55           HG1      THR  55 -10.126  -0.246  -8.537
  409   HG21  THR  55          HG21      THR  55  -8.722  -2.472  -8.050
  410   HG22  THR  55          HG22      THR  55  -7.625  -2.301  -6.682
  411   HG23  THR  55          HG23      THR  55  -7.198  -1.611  -8.249
  412    H    VAL  56           HN       VAL  56  -9.489  -2.836  -4.598
  413    HA   VAL  56           HA       VAL  56  -9.259  -1.120  -2.339
  414    HB   VAL  56           HB       VAL  56  -8.745  -4.084  -2.203
  415   HG11  VAL  56          HG11      VAL  56  -9.001  -3.752   0.210
  416   HG12  VAL  56          HG12      VAL  56  -9.395  -2.056  -0.078
  417   HG13  VAL  56          HG13      VAL  56  -7.778  -2.607  -0.398
  418   HG21  VAL  56          HG21      VAL  56 -11.077  -2.430  -1.527
  419   HG22  VAL  56          HG22      VAL  56 -10.906  -4.191  -1.275
  420   HG23  VAL  56          HG23      VAL  56 -10.997  -3.509  -2.940
  421    HA   PRO  57           HA       PRO  57  -5.470  -2.688  -1.455
  422    HB2  PRO  57           HB2      PRO  57  -3.575  -4.191  -2.772
  423    HB3  PRO  57           HB1      PRO  57  -4.901  -4.827  -1.798
  424    HG2  PRO  57           HG2      PRO  57  -4.756  -4.495  -4.760
  425    HG3  PRO  57           HG1      PRO  57  -5.510  -5.786  -3.806
  426    HD2  PRO  57           HD2      PRO  57  -6.862  -3.644  -4.946
  427    HD3  PRO  57           HD1      PRO  57  -7.422  -4.697  -3.616
  428    H    THR  58           HN       THR  58  -5.054  -0.516  -1.913
  429    HA   THR  58           HA       THR  58  -3.306   0.348  -4.071
  430    HB   THR  58           HB       THR  58  -5.462   1.768  -2.470
  431    HG1  THR  58           HG1      THR  58  -6.425   0.326  -3.784
  432   HG21  THR  58          HG21      THR  58  -5.282   3.516  -4.181
  433   HG22  THR  58          HG22      THR  58  -4.019   2.606  -4.991
  434   HG23  THR  58          HG23      THR  58  -3.709   3.309  -3.391
  435    H    VAL  59           HN       VAL  59  -1.366   1.057  -3.308
  436    HA   VAL  59           HA       VAL  59  -1.221   1.684  -0.458
  437    HB   VAL  59           HB       VAL  59  -0.073  -0.435  -0.924
  438   HG11  VAL  59          HG11      VAL  59   1.515   1.130  -2.881
  439   HG12  VAL  59          HG12      VAL  59   0.414  -0.198  -3.226
  440   HG13  VAL  59          HG13      VAL  59   1.919  -0.501  -2.337
  441   HG21  VAL  59          HG21      VAL  59   2.137   0.086  -0.028
  442   HG22  VAL  59          HG22      VAL  59   0.870   0.991   0.806
  443   HG23  VAL  59          HG23      VAL  59   1.879   1.791  -0.398
  444    H    LYS  60           HN       LYS  60  -0.279   3.473   0.150
  445    HA   LYS  60           HA       LYS  60   0.882   5.249  -1.877
  446    HB2  LYS  60           HB2      LYS  60  -1.139   6.179  -0.838
  447    HB3  LYS  60           HB1      LYS  60  -0.484   5.855   0.761
  448    HG2  LYS  60           HG2      LYS  60   1.230   7.537   0.377
  449    HG3  LYS  60           HG1      LYS  60   0.598   7.813  -1.249
  450    HD2  LYS  60           HD2      LYS  60  -1.553   8.482  -0.312
  451    HD3  LYS  60           HD1      LYS  60  -0.948   8.195   1.316
  452    HE2  LYS  60           HE2      LYS  60   0.163  10.159  -0.650
  453    HE3  LYS  60           HE1      LYS  60  -0.943  10.570   0.661
  454    HZ1  LYS  60           HZ1      LYS  60   1.360  11.055   1.294
  455    HZ2  LYS  60           HZ2      LYS  60   1.833   9.489   0.984
  456    HZ3  LYS  60           HZ3      LYS  60   0.789   9.800   2.256
  457    H    PHE  61           HN       PHE  61   3.007   5.406  -1.720
  458    HA   PHE  61           HA       PHE  61   4.322   4.651   0.787
  459    HB2  PHE  61           HB2      PHE  61   5.451   5.121  -1.989
  460    HB3  PHE  61           HB1      PHE  61   6.448   4.836  -0.576
  461    HD1  PHE  61           HD1      PHE  61   4.054   3.342  -2.926
  462    HD2  PHE  61           HD2      PHE  61   6.693   2.641   0.361
  463    HE1  PHE  61           HE1      PHE  61   3.886   0.906  -3.298
  464    HE2  PHE  61           HE2      PHE  61   6.498   0.237  -0.002
  465    HZ   PHE  61           HZ       PHE  61   5.097  -0.633  -1.850
  466    H    ALA  62           HN       ALA  62   6.209   5.988   1.417
  467    HA   ALA  62           HA       ALA  62   5.534   8.671   1.880
  468    HB1  ALA  62           HB1      ALA  62   7.054   7.380   3.319
  469    HB2  ALA  62           HB2      ALA  62   7.782   8.902   2.805
  470    HB3  ALA  62           HB3      ALA  62   8.265   7.390   2.040
  471    H    ASP  63           HN       ASP  63   6.745   7.251  -0.874
  472    HA   ASP  63           HA       ASP  63   8.279   9.412  -1.981
  473    HB2  ASP  63           HB2      ASP  63   8.561   7.096  -2.754
  474    HB3  ASP  63           HB1      ASP  63   6.899   7.063  -3.314
  475    H    GLY  64           HN       GLY  64   4.947   8.762  -1.567
  476    HA2  GLY  64           HA2      GLY  64   3.256  10.327  -1.829
  477    HA3  GLY  64           HA1      GLY  64   4.226  11.204  -3.011
  478    H    SER  65           HN       SER  65   4.689   8.360  -4.082
  479    HA   SER  65           HA       SER  65   2.594   8.506  -6.026
  480    HB2  SER  65           HB2      SER  65   4.823   6.497  -5.717
  481    HB3  SER  65           HB1      SER  65   3.872   6.809  -7.171
  482    HG   SER  65           HG       SER  65   6.047   8.075  -6.207
  483    H    THR  66           HN       THR  66   1.143   6.800  -6.440
  484    HA   THR  66           HA       THR  66   0.717   5.011  -4.189
  485    HB   THR  66           HB       THR  66  -1.663   4.979  -5.326
  486    HG1  THR  66           HG1      THR  66  -1.613   6.271  -6.988
  487   HG21  THR  66          HG21      THR  66  -1.242   5.777  -3.049
  488   HG22  THR  66          HG22      THR  66  -2.375   6.851  -3.871
  489   HG23  THR  66          HG23      THR  66  -0.688   7.327  -3.677
  490    H    LEU  67           HN       LEU  67   0.465   2.922  -4.634
  491    HA   LEU  67           HA       LEU  67   0.882   2.108  -7.410
  492    HB2  LEU  67           HB2      LEU  67   2.838   1.902  -5.745
  493    HB3  LEU  67           HB1      LEU  67   1.896   0.653  -4.968
  494    HG   LEU  67           HG       LEU  67   1.996  -0.676  -7.053
  495   HD11  LEU  67          HD11      LEU  67   3.845   1.533  -7.953
  496   HD12  LEU  67          HD12      LEU  67   2.334   1.043  -8.740
  497   HD13  LEU  67          HD13      LEU  67   3.711  -0.038  -8.714
  498   HD21  LEU  67          HD21      LEU  67   4.653   0.176  -5.909
  499   HD22  LEU  67          HD22      LEU  67   4.356  -1.295  -6.829
  500   HD23  LEU  67          HD23      LEU  67   3.590  -1.076  -5.257
  501    H    THR  68           HN       THR  68  -0.803   0.882  -8.119
  502    HA   THR  68           HA       THR  68  -2.684  -0.109  -6.092
  503    HB   THR  68           HB       THR  68  -3.265   0.453  -9.002
  504    HG1  THR  68           HG1      THR  68  -2.424   2.201  -7.511
  505   HG21  THR  68          HG21      THR  68  -5.017   0.329  -6.533
  506   HG22  THR  68          HG22      THR  68  -4.901  -0.932  -7.761
  507   HG23  THR  68          HG23      THR  68  -5.574   0.643  -8.176
  508    H    ASN  69           HN       ASN  69  -2.945  -2.245  -5.934
  509    HA   ASN  69           HA       ASN  69  -2.680  -4.465  -6.224
  510    HB2  ASN  69           HB2      ASN  69  -3.359  -3.721  -9.093
  511    HB3  ASN  69           HB1      ASN  69  -3.244  -5.380  -8.529
  512   HD21  ASN  69          HD21      ASN  69  -5.428  -5.708  -9.131
  513   HD22  ASN  69          HD22      ASN  69  -6.717  -5.099  -8.157
  514    HA   PRO  70           HA       PRO  70   1.599  -4.329  -8.051
  515    HB2  PRO  70           HB2      PRO  70   3.131  -3.966  -5.942
  516    HB3  PRO  70           HB1      PRO  70   2.284  -2.601  -6.680
  517    HG2  PRO  70           HG2      PRO  70   1.599  -4.141  -4.209
  518    HG3  PRO  70           HG1      PRO  70   1.519  -2.394  -4.490
  519    HD2  PRO  70           HD2      PRO  70  -0.646  -4.129  -4.668
  520    HD3  PRO  70           HD1      PRO  70  -0.535  -2.522  -5.416
  521    H    SER  71           HN       SER  71   3.475  -5.691  -7.456
  522    HA   SER  71           HA       SER  71   2.699  -8.291  -6.371
  523    HB2  SER  71           HB2      SER  71   5.366  -7.537  -7.579
  524    HB3  SER  71           HB1      SER  71   4.566  -9.108  -7.561
  525    HG   SER  71           HG       SER  71   3.726  -6.813  -8.976
  526    H    ALA  72           HN       ALA  72   4.425  -9.292  -4.850
  527    HA   ALA  72           HA       ALA  72   4.819  -7.593  -2.632
  528    HB1  ALA  72           HB1      ALA  72   5.999  -9.484  -1.630
  529    HB2  ALA  72           HB2      ALA  72   6.091 -10.276  -3.201
  530    HB3  ALA  72           HB3      ALA  72   4.524 -10.028  -2.429
  531    H    ASP  73           HN       ASP  73   6.956  -8.726  -5.164
  532    HA   ASP  73           HA       ASP  73   9.364  -7.715  -4.105
  533    HB2  ASP  73           HB2      ASP  73  10.376  -8.074  -6.269
  534    HB3  ASP  73           HB1      ASP  73   9.286  -9.404  -5.938
  535    H    GLU  74           HN       GLU  74   6.869  -6.198  -6.007
  536    HA   GLU  74           HA       GLU  74   8.366  -3.901  -6.744
  537    HB2  GLU  74           HB2      GLU  74   5.374  -4.260  -6.513
  538    HB3  GLU  74           HB1      GLU  74   6.169  -2.890  -7.272
  539    HG2  GLU  74           HG2      GLU  74   7.144  -4.369  -8.944
  540    HG3  GLU  74           HG1      GLU  74   6.364  -5.754  -8.184
  541    H    VAL  75           HN       VAL  75   6.290  -4.692  -4.058
  542    HA   VAL  75           HA       VAL  75   6.301  -2.126  -2.883
  543    HB   VAL  75           HB       VAL  75   5.881  -4.840  -1.595
  544   HG11  VAL  75          HG11      VAL  75   6.466  -3.151   0.084
  545   HG12  VAL  75          HG12      VAL  75   4.774  -3.627   0.225
  546   HG13  VAL  75          HG13      VAL  75   5.193  -2.093  -0.519
  547   HG21  VAL  75          HG21      VAL  75   3.493  -4.283  -1.768
  548   HG22  VAL  75          HG22      VAL  75   4.274  -4.372  -3.348
  549   HG23  VAL  75          HG23      VAL  75   3.915  -2.802  -2.631
  550    H    LYS  76           HN       LYS  76   8.276  -5.005  -2.394
  551    HA   LYS  76           HA       LYS  76   9.916  -4.007  -0.368
  552    HB2  LYS  76           HB2      LYS  76   9.850  -6.348  -0.828
  553    HB3  LYS  76           HB1      LYS  76  10.438  -6.119  -2.473
  554    HG2  LYS  76           HG2      LYS  76  12.591  -5.408  -1.591
  555    HG3  LYS  76           HG1      LYS  76  11.999  -5.614   0.065
  556    HD2  LYS  76           HD2      LYS  76  11.653  -8.006  -0.396
  557    HD3  LYS  76           HD1      LYS  76  12.268  -7.771  -2.033
  558    HE2  LYS  76           HE2      LYS  76  14.422  -7.051  -1.117
  559    HE3  LYS  76           HE1      LYS  76  13.809  -7.280   0.519
  560    HZ1  LYS  76           HZ1      LYS  76  14.142  -9.403  -1.529
  561    HZ2  LYS  76           HZ2      LYS  76  13.557  -9.654   0.031
  562    HZ3  LYS  76           HZ3      LYS  76  15.143  -9.149  -0.208
  563    H    ALA  77           HN       ALA  77  10.328  -3.853  -3.892
  564    HA   ALA  77           HA       ALA  77  12.848  -2.560  -3.837
  565    HB1  ALA  77           HB1      ALA  77  11.966  -3.718  -5.828
  566    HB2  ALA  77           HB2      ALA  77  12.445  -2.058  -6.189
  567    HB3  ALA  77           HB3      ALA  77  10.739  -2.464  -5.994
  568    H    LYS  78           HN       LYS  78   9.558  -1.275  -3.826
  569    HA   LYS  78           HA       LYS  78  10.417   1.439  -3.970
  570    HB2  LYS  78           HB2      LYS  78   7.827   0.101  -3.373
  571    HB3  LYS  78           HB1      LYS  78   8.031   1.740  -2.798
  572    HG2  LYS  78           HG2      LYS  78   6.894   1.751  -4.927
  573    HG3  LYS  78           HG1      LYS  78   8.477   2.485  -5.088
  574    HD2  LYS  78           HD2      LYS  78   9.339   0.420  -6.090
  575    HD3  LYS  78           HD1      LYS  78   7.750  -0.331  -5.911
  576    HE2  LYS  78           HE2      LYS  78   6.767   1.333  -7.381
  577    HE3  LYS  78           HE1      LYS  78   8.313   2.165  -7.503
  578    HZ1  LYS  78           HZ1      LYS  78   8.010   0.893  -9.432
  579    HZ2  LYS  78           HZ2      LYS  78   7.592  -0.497  -8.606
  580    HZ3  LYS  78           HZ3      LYS  78   9.193   0.079  -8.540
  581    H    LEU  79           HN       LEU  79   9.805  -0.782  -1.354
  582    HA   LEU  79           HA       LEU  79   9.832   1.033   0.736
  583    HB2  LEU  79           HB2      LEU  79   9.191  -1.470   0.858
  584    HB3  LEU  79           HB1      LEU  79  10.889  -1.777   0.838
  585    HG   LEU  79           HG       LEU  79  11.162  -0.580   2.959
  586   HD11  LEU  79          HD11      LEU  79   8.174  -0.313   2.847
  587   HD12  LEU  79          HD12      LEU  79   9.382   0.960   3.151
  588   HD13  LEU  79          HD13      LEU  79   9.087  -0.284   4.337
  589   HD21  LEU  79          HD21      LEU  79  10.943  -2.991   2.952
  590   HD22  LEU  79          HD22      LEU  79   9.184  -2.843   2.979
  591   HD23  LEU  79          HD23      LEU  79  10.132  -2.308   4.365
  592    H    VAL  80           HN       VAL  80  12.442  -0.832  -0.710
  593    HA   VAL  80           HA       VAL  80  14.423   0.089   1.064
  594    HB   VAL  80           HB       VAL  80  16.098  -0.863  -0.506
  595   HG11  VAL  80          HG11      VAL  80  15.352  -3.177  -0.379
  596   HG12  VAL  80          HG12      VAL  80  13.730  -2.607   0.048
  597   HG13  VAL  80          HG13      VAL  80  15.089  -2.292   1.123
  598   HG21  VAL  80          HG21      VAL  80  13.710  -1.350  -2.212
  599   HG22  VAL  80          HG22      VAL  80  15.309  -2.072  -2.491
  600   HG23  VAL  80          HG23      VAL  80  15.084  -0.323  -2.618
  601    H    LYS  81           HN       LYS  81  13.240   1.446  -1.943
  602    HA   LYS  81           HA       LYS  81  15.442   3.295  -2.094
  603    HB2  LYS  81           HB2      LYS  81  14.229   4.443  -3.916
  604    HB3  LYS  81           HB1      LYS  81  14.405   2.725  -4.216
  605    HG2  LYS  81           HG2      LYS  81  12.165   2.300  -3.791
  606    HG3  LYS  81           HG1      LYS  81  11.909   3.864  -3.027
  607    HD2  LYS  81           HD2      LYS  81  12.600   3.510  -5.945
  608    HD3  LYS  81           HD1      LYS  81  10.947   3.636  -5.347
  609    HE2  LYS  81           HE2      LYS  81  11.516   5.852  -4.382
  610    HE3  LYS  81           HE1      LYS  81  13.125   5.718  -5.085
  611    HZ1  LYS  81           HZ1      LYS  81  11.642   7.039  -6.440
  612    HZ2  LYS  81           HZ2      LYS  81  10.586   5.752  -6.636
  613    HZ3  LYS  81           HZ3      LYS  81  12.152   5.683  -7.269
  614    H    ILE  82           HN       ILE  82  12.123   3.478  -0.901
  615    HA   ILE  82           HA       ILE  82  12.433   6.267  -0.462
  616    HB   ILE  82           HB       ILE  82  10.234   6.234   0.697
  617   HG12  ILE  82          HG12      ILE  82   8.826   4.111   0.432
  618   HG13  ILE  82          HG11      ILE  82  10.329   3.252   0.155
  619   HG21  ILE  82          HG21      ILE  82   8.899   5.674  -1.262
  620   HG22  ILE  82          HG22      ILE  82  10.295   4.860  -1.967
  621   HG23  ILE  82          HG23      ILE  82  10.346   6.602  -1.665
  622   HD11  ILE  82          HD11      ILE  82  11.073   3.833   2.390
  623   HD12  ILE  82          HD12      ILE  82   9.518   2.993   2.426
  624   HD13  ILE  82          HD13      ILE  82   9.586   4.744   2.647
  625    H    ALA  83           HN       ALA  83  13.427   3.604   1.231
  626    HA   ALA  83           HA       ALA  83  13.486   4.779   3.825
  627    HB1  ALA  83           HB1      ALA  83  15.009   2.937   4.388
  628    HB2  ALA  83           HB2      ALA  83  15.140   2.523   2.679
  629    HB3  ALA  83           HB3      ALA  83  13.595   2.349   3.513
  630    H    GLY  84           HN       GLY  84  15.418   4.985   0.957
  631    HA2  GLY  84           HA2      GLY  84  17.346   6.097   0.419
  632    HA3  GLY  84           HA1      GLY  84  16.961   7.160   1.771
  633    H    LEU  85           HN       LEU  85  17.849   3.804   1.509
  634    HA   LEU  85           HA       LEU  85  20.266   4.186   3.083
  635    HB2  LEU  85           HB2      LEU  85  18.545   4.117   4.803
  636    HB3  LEU  85           HB1      LEU  85  17.903   2.635   4.137
  637    HG   LEU  85           HG       LEU  85  20.046   1.506   4.744
  638   HD11  LEU  85          HD11      LEU  85  20.612   4.085   6.187
  639   HD12  LEU  85          HD12      LEU  85  21.502   3.436   4.811
  640   HD13  LEU  85          HD13      LEU  85  21.526   2.585   6.356
  641   HD21  LEU  85          HD21      LEU  85  18.521   2.802   7.000
  642   HD22  LEU  85          HD22      LEU  85  19.535   1.363   7.129
  643   HD23  LEU  85          HD23      LEU  85  18.071   1.324   6.148
  644    H    GLU  86           HN       GLU  86  17.901   1.807   1.951
  645    HA   GLU  86           HA       GLU  86  20.014  -0.116   1.436
  646    HB2  GLU  86           HB2      GLU  86  17.009  -0.302   1.289
  647    HB3  GLU  86           HB1      GLU  86  18.125  -1.664   1.130
  648    HG2  GLU  86           HG2      GLU  86  18.887  -1.375   3.377
  649    HG3  GLU  86           HG1      GLU  86  17.973   0.117   3.540
  650    H    HIS  87           HN       HIS  87  18.444   2.308  -0.104
  651    HA   HIS  87           HA       HIS  87  19.641   1.846  -2.596
  652    HB2  HIS  87           HB2      HIS  87  17.593   0.413  -2.839
  653    HB3  HIS  87           HB1      HIS  87  16.585   1.798  -2.455
  654    HD1  HIS  87           HD1      HIS  87  16.926   3.886  -4.442
  655    HD2  HIS  87           HD2      HIS  87  17.976  -0.033  -5.390
  656    HE1  HIS  87           HE1      HIS  87  16.899   3.741  -6.917
  657    H    HIS  88           HN       HIS  88  19.754   3.853  -3.576
  658    HA   HIS  88           HA       HIS  88  18.371   6.046  -2.227
  659    HB2  HIS  88           HB2      HIS  88  21.191   6.029  -3.380
  660    HB3  HIS  88           HB1      HIS  88  20.355   7.469  -2.823
  661    HD1  HIS  88           HD1      HIS  88  20.397   7.933  -0.293
  662    HD2  HIS  88           HD2      HIS  88  22.049   4.263  -1.334
  663    HE1  HIS  88           HE1      HIS  88  21.543   7.084   1.766
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1   1.966   6.803   6.861
    2    H2   MET   1           HT2      MET   1   2.929   5.473   6.475
    3    H3   MET   1           HT3      MET   1   1.896   6.142   5.325
    4    HA   MET   1           HA       MET   1   4.222   6.766   4.982
    5    HB2  MET   1           HB2      MET   1   2.250   8.968   5.610
    6    HB3  MET   1           HB1      MET   1   3.812   9.260   4.867
    7    HG2  MET   1           HG2      MET   1   3.203   7.884   2.967
    8    HG3  MET   1           HG1      MET   1   1.664   7.490   3.718
    9    HE1  MET   1           HE1      MET   1   2.745  11.784   2.354
   10    HE2  MET   1           HE2      MET   1   3.877  10.439   2.246
   11    HE3  MET   1           HE3      MET   1   3.388  11.061   3.823
   12    H    VAL   2           HN       VAL   2   3.943   6.193   8.043
   13    HA   VAL   2           HA       VAL   2   5.933   8.191   8.721
   14    HB   VAL   2           HB       VAL   2   5.401   7.661  11.224
   15   HG11  VAL   2          HG11      VAL   2   4.896   9.786  10.135
   16   HG12  VAL   2          HG12      VAL   2   3.598   9.323  11.234
   17   HG13  VAL   2          HG13      VAL   2   3.402   9.110   9.493
   18   HG21  VAL   2          HG21      VAL   2   3.114   6.954  11.684
   19   HG22  VAL   2          HG22      VAL   2   3.927   5.692  10.749
   20   HG23  VAL   2          HG23      VAL   2   2.801   6.796   9.961
   21    H    THR   3           HN       THR   3   5.637   5.435  10.879
   22    HA   THR   3           HA       THR   3   8.279   4.647  10.156
   23    HB   THR   3           HB       THR   3   7.725   2.796  11.851
   24    HG1  THR   3           HG1      THR   3   5.784   2.708  12.545
   25   HG21  THR   3          HG21      THR   3   7.904   4.346  13.751
   26   HG22  THR   3          HG22      THR   3   7.453   5.686  12.697
   27   HG23  THR   3          HG23      THR   3   8.972   4.829  12.434
   28    H    ALA   4           HN       ALA   4   5.017   3.583   9.753
   29    HA   ALA   4           HA       ALA   4   5.790   1.532   7.865
   30    HB1  ALA   4           HB1      ALA   4   3.102   2.503   8.860
   31    HB2  ALA   4           HB2      ALA   4   3.932   1.030   9.369
   32    HB3  ALA   4           HB3      ALA   4   3.323   1.177   7.720
   33    H    ALA   5           HN       ALA   5   6.497   2.474   6.104
   34    HA   ALA   5           HA       ALA   5   5.765   5.071   5.263
   35    HB1  ALA   5           HB1      ALA   5   7.199   4.659   3.345
   36    HB2  ALA   5           HB2      ALA   5   7.230   2.939   3.730
   37    HB3  ALA   5           HB3      ALA   5   7.972   4.102   4.830
   38    H    LEU   6           HN       LEU   6   5.229   1.934   3.727
   39    HA   LEU   6           HA       LEU   6   3.446   3.024   1.828
   40    HB2  LEU   6           HB2      LEU   6   2.828   0.651   1.301
   41    HB3  LEU   6           HB1      LEU   6   4.504   1.026   1.064
   42    HG   LEU   6           HG       LEU   6   3.611  -0.252   3.578
   43   HD11  LEU   6          HD11      LEU   6   4.227  -1.572   0.917
   44   HD12  LEU   6          HD12      LEU   6   2.653  -1.578   1.716
   45   HD13  LEU   6          HD13      LEU   6   4.018  -2.439   2.433
   46   HD21  LEU   6          HD21      LEU   6   5.947   0.512   3.413
   47   HD22  LEU   6          HD22      LEU   6   6.115  -0.415   1.927
   48   HD23  LEU   6          HD23      LEU   6   5.855  -1.246   3.449
   49    H    THR   7           HN       THR   7   1.514   3.542   2.000
   50    HA   THR   7           HA       THR   7  -0.023   2.710   4.325
   51    HB   THR   7           HB       THR   7  -0.364   5.015   2.396
   52    HG1  THR   7           HG1      THR   7   1.543   4.706   3.848
   53   HG21  THR   7          HG21      THR   7  -2.412   4.414   3.592
   54   HG22  THR   7          HG22      THR   7  -1.795   5.954   4.189
   55   HG23  THR   7          HG23      THR   7  -1.560   4.478   5.137
   56    H    ILE   8           HN       ILE   8  -1.391   1.100   3.857
   57    HA   ILE   8           HA       ILE   8  -2.195   0.650   1.069
   58    HB   ILE   8           HB       ILE   8  -2.133  -1.270   3.409
   59   HG12  ILE   8          HG12      ILE   8  -0.403  -1.110   0.935
   60   HG13  ILE   8          HG11      ILE   8   0.094  -0.702   2.577
   61   HG21  ILE   8          HG21      ILE   8  -2.830  -1.821   0.518
   62   HG22  ILE   8          HG22      ILE   8  -3.948  -1.789   1.880
   63   HG23  ILE   8          HG23      ILE   8  -2.694  -3.030   1.807
   64   HD11  ILE   8          HD11      ILE   8  -0.737  -3.423   1.599
   65   HD12  ILE   8          HD12      ILE   8  -0.249  -3.027   3.243
   66   HD13  ILE   8          HD13      ILE   8   0.907  -2.880   1.919
   67    H    TYR   9           HN       TYR   9  -4.252   0.533   0.538
   68    HA   TYR   9           HA       TYR   9  -6.209   1.341   2.513
   69    HB2  TYR   9           HB2      TYR   9  -6.303   1.097  -0.493
   70    HB3  TYR   9           HB1      TYR   9  -7.652   1.677   0.464
   71    HD1  TYR   9           HD2      TYR   9  -4.264   2.448  -0.745
   72    HD2  TYR   9           HD1      TYR   9  -7.597   3.930   1.432
   73    HE1  TYR   9           HE2      TYR   9  -3.325   4.694  -0.863
   74    HE2  TYR   9           HE1      TYR   9  -6.652   6.202   1.321
   75    HH   TYR   9           HH       TYR   9  -4.469   7.282   0.999
   76    H    THR  10           HN       THR  10  -7.530  -0.143   3.503
   77    HA   THR  10           HA       THR  10  -8.045  -2.693   2.158
   78    HB   THR  10           HB       THR  10  -7.792  -3.761   4.430
   79    HG1  THR  10           HG1      THR  10  -6.800  -2.609   6.044
   80   HG21  THR  10          HG21      THR  10  -5.349  -3.996   4.268
   81   HG22  THR  10          HG22      THR  10  -5.279  -2.564   3.242
   82   HG23  THR  10          HG23      THR  10  -6.078  -4.023   2.657
   83    H    THR  11           HN       THR  11  -9.681  -3.966   3.593
   84    HA   THR  11           HA       THR  11 -11.487  -2.392   5.183
   85    HB   THR  11           HB       THR  11 -12.574  -4.175   2.951
   86    HG1  THR  11           HG1      THR  11 -11.515  -1.634   2.797
   87   HG21  THR  11          HG21      THR  11 -13.756  -1.902   4.552
   88   HG22  THR  11          HG22      THR  11 -14.078  -3.620   4.797
   89   HG23  THR  11          HG23      THR  11 -14.593  -2.821   3.306
   90    H    SER  12           HN       SER  12 -12.728  -4.003   6.559
   91    HA   SER  12           HA       SER  12 -11.150  -6.264   7.185
   92    HB2  SER  12           HB2      SER  12 -13.999  -5.640   7.996
   93    HB3  SER  12           HB1      SER  12 -12.871  -6.714   8.829
   94    HG   SER  12           HG       SER  12 -13.004  -3.955   8.717
   95    H    TRP  13           HN       TRP  13 -14.280  -5.800   5.562
   96    HA   TRP  13           HA       TRP  13 -14.208  -8.557   4.768
   97    HB2  TRP  13           HB2      TRP  13 -16.412  -8.151   3.705
   98    HB3  TRP  13           HB1      TRP  13 -16.406  -7.818   5.432
   99    HD1  TRP  13           HD1      TRP  13 -16.897  -6.255   2.051
  100    HE1  TRP  13           HE1      TRP  13 -17.844  -3.941   2.293
  101    HE3  TRP  13           HE3      TRP  13 -16.438  -5.781   7.111
  102    HZ2  TRP  13           HZ2      TRP  13 -18.377  -2.073   4.399
  103    HZ3  TRP  13           HZ3      TRP  13 -17.204  -3.690   8.165
  104    HH2  TRP  13           HH2      TRP  13 -18.152  -1.883   6.838
  105    H    CYS  14           HN       CYS  14 -12.700  -8.931   3.425
  106    HA   CYS  14           HA       CYS  14 -12.903  -7.975   0.767
  107    HB2  CYS  14           HB2      CYS  14 -11.754  -6.045   1.689
  108    HB3  CYS  14           HB1      CYS  14 -10.628  -7.073   2.553
  109    H    GLY  15           HN       GLY  15 -11.590  -9.278  -0.597
  110    HA2  GLY  15           HA2      GLY  15 -10.322 -11.528   0.812
  111    HA3  GLY  15           HA1      GLY  15 -11.189 -11.700  -0.707
  112    H    TYR  16           HN       TYR  16 -10.270  -9.838  -2.307
  113    HA   TYR  16           HA       TYR  16  -7.782 -10.950  -2.984
  114    HB2  TYR  16           HB2      TYR  16  -7.828  -9.696  -5.020
  115    HB3  TYR  16           HB1      TYR  16  -9.440 -10.286  -4.688
  116    HD1  TYR  16           HD2      TYR  16 -10.886  -8.393  -3.246
  117    HD2  TYR  16           HD1      TYR  16  -7.684  -7.649  -5.940
  118    HE1  TYR  16           HE2      TYR  16 -11.747  -6.121  -3.640
  119    HE2  TYR  16           HE1      TYR  16  -8.532  -5.393  -6.330
  120    HH   TYR  16           HH       TYR  16 -10.653  -4.257  -6.215
  121    H    CYS  17           HN       CYS  17  -8.389  -8.260  -1.015
  122    HA   CYS  17           HA       CYS  17  -5.900  -6.970  -1.579
  123    HB2  CYS  17           HB2      CYS  17  -6.373  -5.737   0.576
  124    HB3  CYS  17           HB1      CYS  17  -7.667  -5.603  -0.629
  125    H    LEU  18           HN       LEU  18  -7.010  -9.602   0.355
  126    HA   LEU  18           HA       LEU  18  -5.100  -9.540   2.430
  127    HB2  LEU  18           HB2      LEU  18  -7.306 -10.648   2.498
  128    HB3  LEU  18           HB1      LEU  18  -6.685 -11.866   1.409
  129    HG   LEU  18           HG       LEU  18  -5.066 -12.588   3.101
  130   HD11  LEU  18          HD11      LEU  18  -5.200 -11.680   5.385
  131   HD12  LEU  18          HD12      LEU  18  -6.360 -10.471   4.835
  132   HD13  LEU  18          HD13      LEU  18  -4.700 -10.441   4.237
  133   HD21  LEU  18          HD21      LEU  18  -7.842 -12.298   4.128
  134   HD22  LEU  18          HD22      LEU  18  -6.655 -13.506   4.670
  135   HD23  LEU  18          HD23      LEU  18  -7.290 -13.546   3.011
  136    H    ARG  19           HN       ARG  19  -5.066 -10.621  -0.796
  137    HA   ARG  19           HA       ARG  19  -3.088 -12.610  -0.786
  138    HB2  ARG  19           HB2      ARG  19  -4.642 -12.005  -2.674
  139    HB3  ARG  19           HB1      ARG  19  -3.705 -10.559  -2.934
  140    HG2  ARG  19           HG2      ARG  19  -2.556 -13.333  -3.202
  141    HG3  ARG  19           HG1      ARG  19  -3.312 -12.476  -4.537
  142    HD2  ARG  19           HD2      ARG  19  -0.878 -11.588  -2.987
  143    HD3  ARG  19           HD1      ARG  19  -0.873 -12.294  -4.602
  144    HE   ARG  19           HE       ARG  19  -2.523 -10.063  -4.677
  145   HH11  ARG  19          HH11      ARG  19   0.894 -10.764  -4.133
  146   HH12  ARG  19          HH12      ARG  19   1.455  -9.282  -4.734
  147   HH21  ARG  19          HH21      ARG  19  -1.762  -7.993  -5.519
  148   HH22  ARG  19          HH22      ARG  19  -0.097  -7.657  -5.528
  149    H    LEU  20           HN       LEU  20  -2.750  -9.165  -1.644
  150    HA   LEU  20           HA       LEU  20   0.030  -9.167  -1.613
  151    HB2  LEU  20           HB2      LEU  20  -1.206  -7.509  -2.809
  152    HB3  LEU  20           HB1      LEU  20  -2.007  -6.974  -1.352
  153    HG   LEU  20           HG       LEU  20   0.389  -6.306  -0.613
  154   HD11  LEU  20          HD11      LEU  20   1.798  -7.181  -2.322
  155   HD12  LEU  20          HD12      LEU  20   1.725  -5.447  -2.553
  156   HD13  LEU  20          HD13      LEU  20   0.771  -6.495  -3.578
  157   HD21  LEU  20          HD21      LEU  20  -1.357  -4.725  -0.857
  158   HD22  LEU  20          HD22      LEU  20  -1.311  -4.839  -2.598
  159   HD23  LEU  20          HD23      LEU  20   0.031  -4.069  -1.736
  160    H    LYS  21           HN       LYS  21  -2.384  -8.275   0.741
  161    HA   LYS  21           HA       LYS  21  -0.856  -7.071   2.699
  162    HB2  LYS  21           HB2      LYS  21  -3.249  -6.948   2.704
  163    HB3  LYS  21           HB1      LYS  21  -3.376  -8.688   2.869
  164    HG2  LYS  21           HG2      LYS  21  -2.541  -8.578   5.112
  165    HG3  LYS  21           HG1      LYS  21  -2.252  -6.846   4.951
  166    HD2  LYS  21           HD2      LYS  21  -4.585  -6.387   4.780
  167    HD3  LYS  21           HD1      LYS  21  -4.972  -8.092   4.616
  168    HE2  LYS  21           HE2      LYS  21  -5.474  -7.276   6.873
  169    HE3  LYS  21           HE1      LYS  21  -4.235  -8.523   6.893
  170    HZ1  LYS  21           HZ1      LYS  21  -3.610  -6.843   8.360
  171    HZ2  LYS  21           HZ2      LYS  21  -3.889  -5.597   7.307
  172    HZ3  LYS  21           HZ3      LYS  21  -2.562  -6.659   7.054
  173    H    THR  22           HN       THR  22  -1.616 -10.560   2.409
  174    HA   THR  22           HA       THR  22  -0.161 -11.181   4.763
  175    HB   THR  22           HB       THR  22  -0.321 -13.576   3.893
  176    HG1  THR  22           HG1      THR  22  -2.141 -12.435   2.035
  177   HG21  THR  22          HG21      THR  22  -2.732 -13.714   4.380
  178   HG22  THR  22          HG22      THR  22  -2.859 -11.964   4.207
  179   HG23  THR  22          HG23      THR  22  -1.898 -12.655   5.517
  180    H    ALA  23           HN       ALA  23   0.640 -11.081   1.374
  181    HA   ALA  23           HA       ALA  23   3.212 -12.302   1.425
  182    HB1  ALA  23           HB1      ALA  23   3.566 -11.164  -0.692
  183    HB2  ALA  23           HB2      ALA  23   2.204 -10.091  -0.367
  184    HB3  ALA  23           HB3      ALA  23   1.921 -11.807  -0.645
  185    H    LEU  24           HN       LEU  24   2.254  -8.936   1.783
  186    HA   LEU  24           HA       LEU  24   4.902  -8.011   2.116
  187    HB2  LEU  24           HB2      LEU  24   2.339  -6.788   3.092
  188    HB3  LEU  24           HB1      LEU  24   3.885  -5.972   3.020
  189    HG   LEU  24           HG       LEU  24   2.273  -6.958   0.676
  190   HD11  LEU  24          HD11      LEU  24   1.383  -4.988   1.712
  191   HD12  LEU  24          HD12      LEU  24   2.112  -4.584   0.153
  192   HD13  LEU  24          HD13      LEU  24   2.962  -4.212   1.648
  193   HD21  LEU  24          HD21      LEU  24   4.646  -7.207   0.207
  194   HD22  LEU  24          HD22      LEU  24   4.931  -5.549   0.739
  195   HD23  LEU  24          HD23      LEU  24   3.972  -5.858  -0.711
  196    H    THR  25           HN       THR  25   2.473  -9.096   4.399
  197    HA   THR  25           HA       THR  25   3.929  -8.474   6.712
  198    HB   THR  25           HB       THR  25   1.933 -10.742   6.348
  199    HG1  THR  25           HG1      THR  25   0.818  -8.903   5.755
  200   HG21  THR  25          HG21      THR  25   1.500 -10.400   8.731
  201   HG22  THR  25          HG22      THR  25   2.703  -9.111   8.772
  202   HG23  THR  25          HG23      THR  25   3.204 -10.774   8.465
  203    H    ALA  26           HN       ALA  26   3.899 -11.320   4.588
  204    HA   ALA  26           HA       ALA  26   5.670 -12.893   6.173
  205    HB1  ALA  26           HB1      ALA  26   5.835 -14.338   4.218
  206    HB2  ALA  26           HB2      ALA  26   5.051 -13.106   3.231
  207    HB3  ALA  26           HB3      ALA  26   4.156 -13.898   4.527
  208    H    ASN  27           HN       ASN  27   6.074 -10.462   3.799
  209    HA   ASN  27           HA       ASN  27   8.903 -10.970   3.464
  210    HB2  ASN  27           HB2      ASN  27   6.895  -9.205   2.250
  211    HB3  ASN  27           HB1      ASN  27   8.571  -8.605   2.189
  212   HD21  ASN  27          HD21      ASN  27   7.285 -11.908   1.905
  213   HD22  ASN  27          HD22      ASN  27   7.787 -12.137   0.270
  214    H    ARG  28           HN       ARG  28   7.193  -9.734   5.890
  215    HA   ARG  28           HA       ARG  28   7.588  -8.470   7.714
  216    HB2  ARG  28           HB2      ARG  28   9.787  -9.757   7.575
  217    HB3  ARG  28           HB1      ARG  28  10.468  -8.339   6.801
  218    HG2  ARG  28           HG2      ARG  28   9.929  -7.010   8.810
  219    HG3  ARG  28           HG1      ARG  28   9.349  -8.483   9.593
  220    HD2  ARG  28           HD2      ARG  28  12.138  -7.961   8.589
  221    HD3  ARG  28           HD1      ARG  28  11.618  -7.985  10.273
  222    HE   ARG  28           HE       ARG  28  10.985 -10.398   8.957
  223   HH11  ARG  28          HH11      ARG  28  13.672  -8.656  10.473
  224   HH12  ARG  28          HH12      ARG  28  14.581 -10.051  10.815
  225   HH21  ARG  28          HH21      ARG  28  12.228 -12.306   9.373
  226   HH22  ARG  28          HH22      ARG  28  13.737 -12.206  10.145
  227    H    ILE  29           HN       ILE  29   6.851  -7.210   5.252
  228    HA   ILE  29           HA       ILE  29   8.251  -4.694   5.257
  229    HB   ILE  29           HB       ILE  29   5.989  -5.747   3.534
  230   HG12  ILE  29          HG12      ILE  29   8.888  -5.138   2.922
  231   HG13  ILE  29          HG11      ILE  29   8.212  -6.743   3.163
  232   HG21  ILE  29          HG21      ILE  29   6.302  -3.722   2.159
  233   HG22  ILE  29          HG22      ILE  29   7.415  -3.096   3.384
  234   HG23  ILE  29          HG23      ILE  29   5.718  -3.359   3.784
  235   HD11  ILE  29          HD11      ILE  29   6.845  -6.454   1.161
  236   HD12  ILE  29          HD12      ILE  29   8.560  -6.256   0.808
  237   HD13  ILE  29          HD13      ILE  29   7.514  -4.839   0.926
  238    H    ALA  30           HN       ALA  30   7.730  -3.176   6.596
  239    HA   ALA  30           HA       ALA  30   5.409  -3.325   8.238
  240    HB1  ALA  30           HB1      ALA  30   7.448  -1.118   8.009
  241    HB2  ALA  30           HB2      ALA  30   7.556  -2.505   9.094
  242    HB3  ALA  30           HB3      ALA  30   6.273  -1.309   9.309
  243    H    TYR  31           HN       TYR  31   3.553  -3.005   7.199
  244    HA   TYR  31           HA       TYR  31   3.216  -0.467   5.757
  245    HB2  TYR  31           HB2      TYR  31   1.365  -1.494   4.555
  246    HB3  TYR  31           HB1      TYR  31   2.814  -2.465   4.355
  247    HD1  TYR  31           HD1      TYR  31  -0.532  -2.319   5.878
  248    HD2  TYR  31           HD2      TYR  31   2.928  -4.715   5.263
  249    HE1  TYR  31           HE1      TYR  31  -1.783  -4.299   6.612
  250    HE2  TYR  31           HE2      TYR  31   1.691  -6.698   6.001
  251    HH   TYR  31           HH       TYR  31  -0.201  -7.306   7.238
  252    H    ASP  32           HN       ASP  32   1.106   0.494   5.922
  253    HA   ASP  32           HA       ASP  32  -0.302  -0.077   8.427
  254    HB2  ASP  32           HB2      ASP  32   1.028   1.921   8.822
  255    HB3  ASP  32           HB1      ASP  32   0.467   2.634   7.313
  256    H    GLU  33           HN       GLU  33  -2.441  -0.260   8.115
  257    HA   GLU  33           HA       GLU  33  -3.367   0.297   5.419
  258    HB2  GLU  33           HB2      GLU  33  -5.225  -1.249   5.938
  259    HB3  GLU  33           HB1      GLU  33  -3.641  -1.989   6.003
  260    HG2  GLU  33           HG2      GLU  33  -3.697  -1.882   8.439
  261    HG3  GLU  33           HG1      GLU  33  -5.295  -1.136   8.362
  262    H    VAL  34           HN       VAL  34  -5.167   1.432   5.013
  263    HA   VAL  34           HA       VAL  34  -5.543   3.610   6.834
  264    HB   VAL  34           HB       VAL  34  -6.967   3.263   4.190
  265   HG11  VAL  34          HG11      VAL  34  -7.832   5.022   5.583
  266   HG12  VAL  34          HG12      VAL  34  -7.041   5.659   4.144
  267   HG13  VAL  34          HG13      VAL  34  -6.222   5.740   5.706
  268   HG21  VAL  34          HG21      VAL  34  -5.130   4.509   3.175
  269   HG22  VAL  34          HG22      VAL  34  -4.576   2.969   3.840
  270   HG23  VAL  34          HG23      VAL  34  -4.264   4.471   4.710
  271    H    ASP  35           HN       ASP  35  -7.343   4.377   7.697
  272    HA   ASP  35           HA       ASP  35  -9.202   2.653   8.913
  273    HB2  ASP  35           HB2      ASP  35  -9.105   5.664   8.849
  274    HB3  ASP  35           HB1      ASP  35 -10.226   4.734   9.826
  275    H    ILE  36           HN       ILE  36  -9.403   3.548   5.821
  276    HA   ILE  36           HA       ILE  36 -11.618   5.071   5.251
  277    HB   ILE  36           HB       ILE  36 -11.837   3.979   3.083
  278   HG12  ILE  36          HG12      ILE  36  -9.705   2.067   3.965
  279   HG13  ILE  36          HG11      ILE  36 -11.420   1.647   4.031
  280   HG21  ILE  36          HG21      ILE  36  -8.971   4.323   3.936
  281   HG22  ILE  36          HG22      ILE  36 -10.068   5.619   3.468
  282   HG23  ILE  36          HG23      ILE  36  -9.587   4.403   2.283
  283   HD11  ILE  36          HD11      ILE  36 -10.294   0.805   2.012
  284   HD12  ILE  36          HD12      ILE  36  -9.951   2.497   1.555
  285   HD13  ILE  36          HD13      ILE  36 -11.607   1.927   1.655
  286    H    GLU  37           HN       GLU  37 -11.873   1.798   6.420
  287    HA   GLU  37           HA       GLU  37 -14.496   1.246   5.499
  288    HB2  GLU  37           HB2      GLU  37 -12.890  -0.424   6.304
  289    HB3  GLU  37           HB1      GLU  37 -12.986   0.274   7.911
  290    HG2  GLU  37           HG2      GLU  37 -15.350  -0.369   7.999
  291    HG3  GLU  37           HG1      GLU  37 -15.167  -1.135   6.419
  292    H    HIS  38           HN       HIS  38 -13.139   2.960   8.179
  293    HA   HIS  38           HA       HIS  38 -15.767   3.523   9.383
  294    HB2  HIS  38           HB2      HIS  38 -12.967   4.048  10.436
  295    HB3  HIS  38           HB1      HIS  38 -14.449   4.448  11.280
  296    HD1  HIS  38           HD1      HIS  38 -15.229   2.697  12.935
  297    HD2  HIS  38           HD2      HIS  38 -12.611   1.159  10.092
  298    HE1  HIS  38           HE1      HIS  38 -14.658   0.368  13.692
  299    H    ASN  39           HN       ASN  39 -12.809   4.998   8.195
  300    HA   ASN  39           HA       ASN  39 -13.783   7.723   8.524
  301    HB2  ASN  39           HB2      ASN  39 -11.460   7.230   9.027
  302    HB3  ASN  39           HB1      ASN  39 -11.206   6.645   7.388
  303   HD21  ASN  39          HD21      ASN  39  -9.800   8.065   6.650
  304   HD22  ASN  39          HD22      ASN  39  -9.916   9.758   6.634
  305    H    ARG  40           HN       ARG  40 -15.089   8.554   7.009
  306    HA   ARG  40           HA       ARG  40 -15.128   7.552   4.345
  307    HB2  ARG  40           HB2      ARG  40 -16.742   9.281   3.802
  308    HB3  ARG  40           HB1      ARG  40 -17.157   8.556   5.344
  309    HG2  ARG  40           HG2      ARG  40 -16.369  10.473   6.536
  310    HG3  ARG  40           HG1      ARG  40 -15.671  11.165   5.072
  311    HD2  ARG  40           HD2      ARG  40 -18.611  10.678   5.563
  312    HD3  ARG  40           HD1      ARG  40 -17.796  12.232   5.714
  313    HE   ARG  40           HE       ARG  40 -17.232  11.400   3.159
  314   HH11  ARG  40          HH11      ARG  40 -20.223  12.062   4.949
  315   HH12  ARG  40          HH12      ARG  40 -21.105  12.477   3.542
  316   HH21  ARG  40          HH21      ARG  40 -18.468  11.951   1.264
  317   HH22  ARG  40          HH22      ARG  40 -20.110  12.428   1.447
  318    H    ALA  41           HN       ALA  41 -13.384  10.127   5.924
  319    HA   ALA  41           HA       ALA  41 -12.983  11.681   3.651
  320    HB1  ALA  41           HB1      ALA  41 -11.200  12.858   4.902
  321    HB2  ALA  41           HB2      ALA  41 -11.392  11.693   6.232
  322    HB3  ALA  41           HB3      ALA  41 -12.715  12.717   5.752
  323    H    ALA  42           HN       ALA  42 -11.013   9.088   4.834
  324    HA   ALA  42           HA       ALA  42  -9.225   9.503   2.584
  325    HB1  ALA  42           HB1      ALA  42  -8.273   8.779   4.720
  326    HB2  ALA  42           HB2      ALA  42  -7.959   7.604   3.439
  327    HB3  ALA  42           HB3      ALA  42  -9.217   7.293   4.635
  328    H    ALA  43           HN       ALA  43 -12.054   7.723   3.316
  329    HA   ALA  43           HA       ALA  43 -11.708   5.544   1.534
  330    HB1  ALA  43           HB1      ALA  43 -13.306   5.580   3.407
  331    HB2  ALA  43           HB2      ALA  43 -14.069   5.134   1.875
  332    HB3  ALA  43           HB3      ALA  43 -14.274   6.764   2.533
  333    H    GLU  44           HN       GLU  44 -13.151   8.698   1.272
  334    HA   GLU  44           HA       GLU  44 -14.034   8.322  -1.397
  335    HB2  GLU  44           HB2      GLU  44 -13.664  10.835   0.235
  336    HB3  GLU  44           HB1      GLU  44 -14.515  10.734  -1.307
  337    HG2  GLU  44           HG2      GLU  44 -16.143   9.221  -0.347
  338    HG3  GLU  44           HG1      GLU  44 -15.275   9.218   1.180
  339    H    PHE  45           HN       PHE  45 -11.064   9.187   0.067
  340    HA   PHE  45           HA       PHE  45  -9.909  10.470  -2.186
  341    HB2  PHE  45           HB2      PHE  45  -8.899  10.773   0.032
  342    HB3  PHE  45           HB1      PHE  45  -8.548   9.047   0.125
  343    HD1  PHE  45           HD1      PHE  45  -7.817  12.085  -1.856
  344    HD2  PHE  45           HD2      PHE  45  -6.515   8.214  -0.681
  345    HE1  PHE  45           HE1      PHE  45  -5.666  12.480  -2.968
  346    HE2  PHE  45           HE2      PHE  45  -4.352   8.602  -1.791
  347    HZ   PHE  45           HZ       PHE  45  -3.928  10.733  -2.939
  348    H    VAL  46           HN       VAL  46 -10.287   7.156  -1.167
  349    HA   VAL  46           HA       VAL  46  -8.552   5.877  -2.966
  350    HB   VAL  46           HB       VAL  46 -11.271   4.848  -2.081
  351   HG11  VAL  46          HG11      VAL  46  -8.825   3.346  -3.015
  352   HG12  VAL  46          HG12      VAL  46 -10.320   3.564  -3.921
  353   HG13  VAL  46          HG13      VAL  46 -10.321   2.612  -2.433
  354   HG21  VAL  46          HG21      VAL  46 -10.091   3.720  -0.258
  355   HG22  VAL  46          HG22      VAL  46  -9.930   5.474  -0.144
  356   HG23  VAL  46          HG23      VAL  46  -8.589   4.502  -0.751
  357    H    GLY  47           HN       GLY  47 -11.894   6.964  -3.296
  358    HA2  GLY  47           HA2      GLY  47 -12.290   6.048  -5.947
  359    HA3  GLY  47           HA1      GLY  47 -13.231   7.290  -5.123
  360    H    SER  48           HN       SER  48 -11.046   8.998  -4.574
  361    HA   SER  48           HA       SER  48 -10.980  10.501  -6.944
  362    HB2  SER  48           HB2      SER  48 -10.864  11.475  -4.658
  363    HB3  SER  48           HB1      SER  48  -9.269  10.769  -4.445
  364    HG   SER  48           HG       SER  48  -9.630  13.092  -5.199
  365    H    VAL  49           HN       VAL  49  -8.457   8.561  -5.307
  366    HA   VAL  49           HA       VAL  49  -6.533   9.180  -7.329
  367    HB   VAL  49           HB       VAL  49  -5.933   8.849  -4.934
  368   HG11  VAL  49          HG11      VAL  49  -6.342   5.921  -5.449
  369   HG12  VAL  49          HG12      VAL  49  -7.259   6.953  -4.354
  370   HG13  VAL  49          HG13      VAL  49  -5.555   6.622  -4.035
  371   HG21  VAL  49          HG21      VAL  49  -4.423   7.128  -6.895
  372   HG22  VAL  49          HG22      VAL  49  -3.808   7.664  -5.335
  373   HG23  VAL  49          HG23      VAL  49  -4.176   8.846  -6.586
  374    H    ASN  50           HN       ASN  50  -8.731   6.482  -6.860
  375    HA   ASN  50           HA       ASN  50  -7.399   5.100  -9.080
  376    HB2  ASN  50           HB2      ASN  50  -9.430   4.140  -7.079
  377    HB3  ASN  50           HB1      ASN  50  -9.130   3.252  -8.564
  378   HD21  ASN  50          HD21      ASN  50  -8.716   2.480  -5.801
  379   HD22  ASN  50          HD22      ASN  50  -7.062   2.030  -5.652
  380    H    GLY  51           HN       GLY  51  -9.629   7.387  -8.838
  381    HA2  GLY  51           HA2      GLY  51 -10.879   8.352 -10.509
  382    HA3  GLY  51           HA1      GLY  51 -10.299   7.101 -11.592
  383    H    GLY  52           HN       GLY  52 -12.426   7.268  -8.758
  384    HA2  GLY  52           HA2      GLY  52 -14.741   6.946  -8.726
  385    HA3  GLY  52           HA1      GLY  52 -14.666   6.379 -10.389
  386    H    ASN  53           HN       ASN  53 -12.824   4.406 -10.174
  387    HA   ASN  53           HA       ASN  53 -14.433   2.294  -9.050
  388    HB2  ASN  53           HB2      ASN  53 -11.673   2.116 -10.303
  389    HB3  ASN  53           HB1      ASN  53 -12.761   0.771  -9.997
  390   HD21  ASN  53          HD21      ASN  53 -11.946   3.374 -12.117
  391   HD22  ASN  53          HD22      ASN  53 -13.094   3.019 -13.339
  392    H    ARG  54           HN       ARG  54 -14.244   1.577  -6.979
  393    HA   ARG  54           HA       ARG  54 -11.826   2.365  -5.609
  394    HB2  ARG  54           HB2      ARG  54 -14.451   1.422  -4.482
  395    HB3  ARG  54           HB1      ARG  54 -13.006   1.597  -3.501
  396    HG2  ARG  54           HG2      ARG  54 -12.909   3.988  -4.171
  397    HG3  ARG  54           HG1      ARG  54 -14.456   3.768  -4.995
  398    HD2  ARG  54           HD2      ARG  54 -13.958   3.260  -2.064
  399    HD3  ARG  54           HD1      ARG  54 -14.686   4.721  -2.713
  400    HE   ARG  54           HE       ARG  54 -16.332   2.917  -3.706
  401   HH11  ARG  54          HH11      ARG  54 -15.023   3.079  -0.412
  402   HH12  ARG  54          HH12      ARG  54 -16.402   2.384   0.310
  403   HH21  ARG  54          HH21      ARG  54 -18.168   1.979  -2.735
  404   HH22  ARG  54          HH22      ARG  54 -18.239   1.721  -1.049
  405    H    THR  55           HN       THR  55 -10.556   0.906  -6.726
  406    HA   THR  55           HA       THR  55 -10.637  -1.862  -6.233
  407    HB   THR  55           HB       THR  55  -8.142  -0.238  -6.691
  408    HG1  THR  55           HG1      THR  55  -9.025  -0.371  -9.039
  409   HG21  THR  55          HG21      THR  55  -9.273  -2.755  -7.947
  410   HG22  THR  55          HG22      THR  55  -8.099  -2.726  -6.633
  411   HG23  THR  55          HG23      THR  55  -7.663  -2.090  -8.228
  412    H    VAL  56           HN       VAL  56  -9.962  -2.879  -4.294
  413    HA   VAL  56           HA       VAL  56  -9.512  -1.127  -2.117
  414    HB   VAL  56           HB       VAL  56  -9.126  -4.110  -1.915
  415   HG11  VAL  56          HG11      VAL  56  -9.347  -3.719   0.484
  416   HG12  VAL  56          HG12      VAL  56  -9.655  -2.010   0.168
  417   HG13  VAL  56          HG13      VAL  56  -8.073  -2.654  -0.158
  418   HG21  VAL  56          HG21      VAL  56 -11.370  -2.334  -1.266
  419   HG22  VAL  56          HG22      VAL  56 -11.267  -4.090  -0.953
  420   HG23  VAL  56          HG23      VAL  56 -11.356  -3.466  -2.641
  421    HA   PRO  57           HA       PRO  57  -5.772  -2.842  -1.257
  422    HB2  PRO  57           HB2      PRO  57  -4.013  -4.541  -2.532
  423    HB3  PRO  57           HB1      PRO  57  -5.398  -5.019  -1.554
  424    HG2  PRO  57           HG2      PRO  57  -5.201  -4.793  -4.518
  425    HG3  PRO  57           HG1      PRO  57  -6.078  -5.985  -3.544
  426    HD2  PRO  57           HD2      PRO  57  -7.181  -3.724  -4.741
  427    HD3  PRO  57           HD1      PRO  57  -7.896  -4.731  -3.450
  428    H    THR  58           HN       THR  58  -5.369  -0.681  -1.956
  429    HA   THR  58           HA       THR  58  -3.605  -0.059  -4.167
  430    HB   THR  58           HB       THR  58  -5.664   1.504  -2.589
  431    HG1  THR  58           HG1      THR  58  -6.877   0.380  -3.915
  432   HG21  THR  58          HG21      THR  58  -4.119   2.286  -5.072
  433   HG22  THR  58          HG22      THR  58  -3.897   3.022  -3.472
  434   HG23  THR  58          HG23      THR  58  -5.423   3.217  -4.357
  435    H    VAL  59           HN       VAL  59  -1.729   1.106  -3.673
  436    HA   VAL  59           HA       VAL  59  -1.208   1.490  -0.828
  437    HB   VAL  59           HB       VAL  59   0.010  -0.515  -1.604
  438   HG11  VAL  59          HG11      VAL  59   1.306   1.290  -3.584
  439   HG12  VAL  59          HG12      VAL  59   0.206  -0.042  -3.931
  440   HG13  VAL  59          HG13      VAL  59   1.801  -0.368  -3.238
  441   HG21  VAL  59          HG21      VAL  59   1.032   0.846   0.131
  442   HG22  VAL  59          HG22      VAL  59   1.839   1.821  -1.096
  443   HG23  VAL  59          HG23      VAL  59   2.266   0.122  -0.904
  444    H    LYS  60           HN       LYS  60  -0.454   3.325  -0.247
  445    HA   LYS  60           HA       LYS  60   0.365   5.318  -2.233
  446    HB2  LYS  60           HB2      LYS  60  -1.635   5.993  -0.951
  447    HB3  LYS  60           HB1      LYS  60  -0.825   5.553   0.540
  448    HG2  LYS  60           HG2      LYS  60   0.622   7.443   0.260
  449    HG3  LYS  60           HG1      LYS  60  -0.124   7.800  -1.307
  450    HD2  LYS  60           HD2      LYS  60  -2.294   8.026  -0.243
  451    HD3  LYS  60           HD1      LYS  60  -1.576   7.646   1.318
  452    HE2  LYS  60           HE2      LYS  60  -1.963   9.974   1.048
  453    HE3  LYS  60           HE1      LYS  60  -0.228   9.623   1.191
  454    HZ1  LYS  60           HZ1      LYS  60  -0.708  11.277  -0.524
  455    HZ2  LYS  60           HZ2      LYS  60  -1.663  10.199  -1.371
  456    HZ3  LYS  60           HZ3      LYS  60  -0.012   9.915  -1.186
  457    H    PHE  61           HN       PHE  61   2.495   5.680  -2.257
  458    HA   PHE  61           HA       PHE  61   4.064   4.934   0.058
  459    HB2  PHE  61           HB2      PHE  61   4.842   5.560  -2.791
  460    HB3  PHE  61           HB1      PHE  61   6.018   5.299  -1.506
  461    HD1  PHE  61           HD1      PHE  61   6.060   3.087  -0.330
  462    HD2  PHE  61           HD2      PHE  61   3.819   3.713  -3.899
  463    HE1  PHE  61           HE1      PHE  61   5.978   0.684  -0.681
  464    HE2  PHE  61           HE2      PHE  61   3.721   1.249  -4.256
  465    HZ   PHE  61           HZ       PHE  61   4.805  -0.248  -2.657
  466    H    ALA  62           HN       ALA  62   6.078   6.459   0.315
  467    HA   ALA  62           HA       ALA  62   4.939   8.807   1.442
  468    HB1  ALA  62           HB1      ALA  62   6.694   7.526   2.537
  469    HB2  ALA  62           HB2      ALA  62   7.137   9.225   2.338
  470    HB3  ALA  62           HB3      ALA  62   7.827   8.001   1.272
  471    H    ASP  63           HN       ASP  63   6.520   8.222  -1.578
  472    HA   ASP  63           HA       ASP  63   7.467  10.962  -1.837
  473    HB2  ASP  63           HB2      ASP  63   8.585  10.223  -3.810
  474    HB3  ASP  63           HB1      ASP  63   8.816   8.973  -2.590
  475    H    GLY  64           HN       GLY  64   4.640   9.300  -2.401
  476    HA2  GLY  64           HA2      GLY  64   2.750  10.595  -3.216
  477    HA3  GLY  64           HA1      GLY  64   3.838  11.300  -4.401
  478    H    SER  65           HN       SER  65   4.824   8.213  -4.421
  479    HA   SER  65           HA       SER  65   3.347   7.643  -6.788
  480    HB2  SER  65           HB2      SER  65   5.267   5.912  -5.214
  481    HB3  SER  65           HB1      SER  65   4.680   5.570  -6.837
  482    HG   SER  65           HG       SER  65   6.432   7.595  -5.950
  483    H    THR  66           HN       THR  66   1.472   6.601  -6.930
  484    HA   THR  66           HA       THR  66   0.669   4.925  -4.685
  485    HB   THR  66           HB       THR  66  -1.701   5.392  -5.560
  486    HG1  THR  66           HG1      THR  66  -2.000   7.042  -6.934
  487   HG21  THR  66          HG21      THR  66  -0.892   6.398  -3.483
  488   HG22  THR  66          HG22      THR  66  -1.882   7.552  -4.374
  489   HG23  THR  66          HG23      THR  66  -0.126   7.698  -4.394
  490    H    LEU  67           HN       LEU  67  -0.021   2.922  -5.175
  491    HA   LEU  67           HA       LEU  67  -0.017   2.103  -7.985
  492    HB2  LEU  67           HB2      LEU  67   1.560   0.954  -5.720
  493    HB3  LEU  67           HB1      LEU  67   0.975  -0.112  -6.974
  494    HG   LEU  67           HG       LEU  67   2.251   1.246  -8.622
  495   HD11  LEU  67          HD11      LEU  67   3.457   2.667  -6.258
  496   HD12  LEU  67          HD12      LEU  67   2.484   3.336  -7.553
  497   HD13  LEU  67          HD13      LEU  67   4.067   2.674  -7.912
  498   HD21  LEU  67          HD21      LEU  67   3.085  -0.826  -7.836
  499   HD22  LEU  67          HD22      LEU  67   3.804  -0.061  -6.425
  500   HD23  LEU  67          HD23      LEU  67   4.409   0.311  -8.060
  501    H    THR  68           HN       THR  68  -1.392   0.424  -8.451
  502    HA   THR  68           HA       THR  68  -3.283  -0.191  -6.300
  503    HB   THR  68           HB       THR  68  -3.850  -0.195  -9.264
  504    HG1  THR  68           HG1      THR  68  -4.895   1.886  -7.788
  505   HG21  THR  68          HG21      THR  68  -5.630  -0.023  -6.828
  506   HG22  THR  68          HG22      THR  68  -5.392  -1.454  -7.829
  507   HG23  THR  68          HG23      THR  68  -6.180  -0.027  -8.503
  508    H    ASN  69           HN       ASN  69  -2.953  -2.214  -5.637
  509    HA   ASN  69           HA       ASN  69  -2.358  -4.385  -5.517
  510    HB2  ASN  69           HB2      ASN  69  -4.657  -4.445  -6.472
  511    HB3  ASN  69           HB1      ASN  69  -3.946  -4.568  -8.075
  512   HD21  ASN  69          HD21      ASN  69  -4.926  -6.523  -8.455
  513   HD22  ASN  69          HD22      ASN  69  -4.407  -7.981  -7.695
  514    HA   PRO  70           HA       PRO  70   1.070  -4.793  -8.522
  515    HB2  PRO  70           HB2      PRO  70   3.093  -3.791  -7.133
  516    HB3  PRO  70           HB1      PRO  70   1.919  -2.714  -7.898
  517    HG2  PRO  70           HG2      PRO  70   2.249  -3.406  -5.032
  518    HG3  PRO  70           HG1      PRO  70   1.630  -1.915  -5.760
  519    HD2  PRO  70           HD2      PRO  70   0.138  -4.141  -4.735
  520    HD3  PRO  70           HD1      PRO  70  -0.501  -2.670  -5.499
  521    H    SER  71           HN       SER  71   3.322  -5.886  -8.009
  522    HA   SER  71           HA       SER  71   2.843  -8.218  -6.408
  523    HB2  SER  71           HB2      SER  71   4.081  -8.314  -8.590
  524    HB3  SER  71           HB1      SER  71   5.356  -7.345  -7.822
  525    HG   SER  71           HG       SER  71   5.660  -9.630  -7.942
  526    H    ALA  72           HN       ALA  72   4.189  -8.862  -4.690
  527    HA   ALA  72           HA       ALA  72   4.722  -6.947  -2.710
  528    HB1  ALA  72           HB1      ALA  72   5.660  -9.760  -3.041
  529    HB2  ALA  72           HB2      ALA  72   4.150  -9.266  -2.277
  530    HB3  ALA  72           HB3      ALA  72   5.708  -8.861  -1.517
  531    H    ASP  73           HN       ASP  73   6.693  -8.580  -5.100
  532    HA   ASP  73           HA       ASP  73   9.243  -7.808  -4.176
  533    HB2  ASP  73           HB2      ASP  73   9.009  -9.562  -5.843
  534    HB3  ASP  73           HB1      ASP  73   8.314  -8.411  -6.988
  535    H    GLU  74           HN       GLU  74   7.010  -6.380  -6.465
  536    HA   GLU  74           HA       GLU  74   8.490  -4.161  -7.220
  537    HB2  GLU  74           HB2      GLU  74   5.532  -4.596  -6.997
  538    HB3  GLU  74           HB1      GLU  74   6.206  -3.079  -7.559
  539    HG2  GLU  74           HG2      GLU  74   6.739  -5.751  -8.831
  540    HG3  GLU  74           HG1      GLU  74   5.561  -4.568  -9.410
  541    H    VAL  75           HN       VAL  75   6.218  -4.604  -4.592
  542    HA   VAL  75           HA       VAL  75   6.267  -2.026  -3.596
  543    HB   VAL  75           HB       VAL  75   5.777  -4.622  -2.109
  544   HG11  VAL  75          HG11      VAL  75   6.380  -2.851  -0.528
  545   HG12  VAL  75          HG12      VAL  75   4.675  -3.274  -0.400
  546   HG13  VAL  75          HG13      VAL  75   5.153  -1.796  -1.238
  547   HG21  VAL  75          HG21      VAL  75   3.420  -3.994  -2.359
  548   HG22  VAL  75          HG22      VAL  75   4.220  -4.214  -3.917
  549   HG23  VAL  75          HG23      VAL  75   3.903  -2.589  -3.306
  550    H    LYS  76           HN       LYS  76   8.376  -4.772  -2.805
  551    HA   LYS  76           HA       LYS  76   9.742  -3.463  -0.721
  552    HB2  LYS  76           HB2      LYS  76   9.873  -5.881  -0.934
  553    HB3  LYS  76           HB1      LYS  76  10.704  -5.727  -2.474
  554    HG2  LYS  76           HG2      LYS  76  12.625  -4.729  -1.373
  555    HG3  LYS  76           HG1      LYS  76  11.789  -4.774   0.175
  556    HD2  LYS  76           HD2      LYS  76  11.760  -7.193   0.126
  557    HD3  LYS  76           HD1      LYS  76  12.469  -7.193  -1.487
  558    HE2  LYS  76           HE2      LYS  76  14.170  -7.668   0.202
  559    HE3  LYS  76           HE1      LYS  76  14.489  -6.150  -0.625
  560    HZ1  LYS  76           HZ1      LYS  76  13.575  -4.970   1.359
  561    HZ2  LYS  76           HZ2      LYS  76  14.887  -5.932   1.703
  562    HZ3  LYS  76           HZ3      LYS  76  13.361  -6.470   2.109
  563    H    ALA  77           HN       ALA  77  10.561  -3.657  -4.175
  564    HA   ALA  77           HA       ALA  77  12.980  -2.159  -3.802
  565    HB1  ALA  77           HB1      ALA  77  13.127  -2.107  -6.226
  566    HB2  ALA  77           HB2      ALA  77  11.465  -2.697  -6.335
  567    HB3  ALA  77           HB3      ALA  77  12.726  -3.729  -5.652
  568    H    LYS  78           HN       LYS  78   9.688  -1.293  -4.299
  569    HA   LYS  78           HA       LYS  78  10.366   1.426  -4.977
  570    HB2  LYS  78           HB2      LYS  78   7.720   0.301  -4.035
  571    HB3  LYS  78           HB1      LYS  78   7.972   1.911  -4.685
  572    HG2  LYS  78           HG2      LYS  78   8.386  -0.660  -6.192
  573    HG3  LYS  78           HG1      LYS  78   6.955   0.355  -6.281
  574    HD2  LYS  78           HD2      LYS  78   8.347   2.184  -7.193
  575    HD3  LYS  78           HD1      LYS  78   9.758   1.121  -7.115
  576    HE2  LYS  78           HE2      LYS  78   7.254   0.544  -8.706
  577    HE3  LYS  78           HE1      LYS  78   8.731   1.218  -9.385
  578    HZ1  LYS  78           HZ1      LYS  78   8.434  -1.279  -9.629
  579    HZ2  LYS  78           HZ2      LYS  78   8.735  -1.422  -7.983
  580    HZ3  LYS  78           HZ3      LYS  78   9.884  -0.769  -8.995
  581    H    LEU  79           HN       LEU  79   9.544  -0.445  -2.149
  582    HA   LEU  79           HA       LEU  79   9.125   1.534  -0.308
  583    HB2  LEU  79           HB2      LEU  79   8.763  -0.882   0.187
  584    HB3  LEU  79           HB1      LEU  79  10.470  -1.126   0.055
  585    HG   LEU  79           HG       LEU  79  10.883   0.167   2.041
  586   HD11  LEU  79          HD11      LEU  79   7.909   0.530   2.186
  587   HD12  LEU  79          HD12      LEU  79   9.175   1.783   2.191
  588   HD13  LEU  79          HD13      LEU  79   8.986   0.706   3.555
  589   HD21  LEU  79          HD21      LEU  79   9.922  -1.412   3.665
  590   HD22  LEU  79          HD22      LEU  79  10.596  -2.215   2.244
  591   HD23  LEU  79          HD23      LEU  79   8.852  -2.015   2.397
  592    H    VAL  80           HN       VAL  80  12.131  -0.060  -1.232
  593    HA   VAL  80           HA       VAL  80  13.776   1.273   0.570
  594    HB   VAL  80           HB       VAL  80  15.699   0.532  -0.745
  595   HG11  VAL  80          HG11      VAL  80  13.557  -1.558  -0.568
  596   HG12  VAL  80          HG12      VAL  80  14.644  -1.062   0.726
  597   HG13  VAL  80          HG13      VAL  80  15.286  -1.870  -0.706
  598   HG21  VAL  80          HG21      VAL  80  13.682  -0.253  -2.833
  599   HG22  VAL  80          HG22      VAL  80  15.376  -0.751  -2.840
  600   HG23  VAL  80          HG23      VAL  80  14.955   0.955  -2.995
  601    H    LYS  81           HN       LYS  81  12.678   2.288  -2.578
  602    HA   LYS  81           HA       LYS  81  14.549   4.463  -2.601
  603    HB2  LYS  81           HB2      LYS  81  13.570   5.183  -4.701
  604    HB3  LYS  81           HB1      LYS  81  13.916   3.464  -4.763
  605    HG2  LYS  81           HG2      LYS  81  11.512   3.038  -4.312
  606    HG3  LYS  81           HG1      LYS  81  11.231   4.773  -4.405
  607    HD2  LYS  81           HD2      LYS  81  12.357   3.072  -6.627
  608    HD3  LYS  81           HD1      LYS  81  10.687   3.614  -6.514
  609    HE2  LYS  81           HE2      LYS  81  13.094   5.436  -6.701
  610    HE3  LYS  81           HE1      LYS  81  12.077   4.973  -8.054
  611    HZ1  LYS  81           HZ1      LYS  81  11.493   7.128  -7.188
  612    HZ2  LYS  81           HZ2      LYS  81  11.113   6.476  -5.668
  613    HZ3  LYS  81           HZ3      LYS  81  10.223   6.045  -7.029
  614    H    ILE  82           HN       ILE  82  11.138   4.026  -1.857
  615    HA   ILE  82           HA       ILE  82  10.721   6.847  -1.716
  616    HB   ILE  82           HB       ILE  82   8.418   6.391  -1.015
  617   HG12  ILE  82          HG12      ILE  82   7.727   3.855  -1.234
  618   HG13  ILE  82          HG11      ILE  82   9.392   3.568  -0.771
  619   HG21  ILE  82          HG21      ILE  82   8.946   6.411  -3.348
  620   HG22  ILE  82          HG22      ILE  82   7.680   5.226  -3.025
  621   HG23  ILE  82          HG23      ILE  82   9.336   4.692  -3.304
  622   HD11  ILE  82          HD11      ILE  82   7.898   3.437   1.143
  623   HD12  ILE  82          HD12      ILE  82   7.363   5.093   0.849
  624   HD13  ILE  82          HD13      ILE  82   9.035   4.774   1.315
  625    H    ALA  83           HN       ALA  83  11.437   4.374   0.610
  626    HA   ALA  83           HA       ALA  83  10.854   6.024   2.866
  627    HB1  ALA  83           HB1      ALA  83  10.882   3.571   3.060
  628    HB2  ALA  83           HB2      ALA  83  12.048   4.306   4.163
  629    HB3  ALA  83           HB3      ALA  83  12.599   3.560   2.664
  630    H    GLY  84           HN       GLY  84  13.711   5.140   1.027
  631    HA2  GLY  84           HA2      GLY  84  15.533   6.481   0.547
  632    HA3  GLY  84           HA1      GLY  84  14.909   7.676   1.677
  633    H    LEU  85           HN       LEU  85  14.719   6.367   3.930
  634    HA   LEU  85           HA       LEU  85  17.463   6.069   4.692
  635    HB2  LEU  85           HB2      LEU  85  16.538   6.001   7.025
  636    HB3  LEU  85           HB1      LEU  85  16.261   7.471   6.129
  637    HG   LEU  85           HG       LEU  85  13.898   6.627   5.694
  638   HD11  LEU  85          HD11      LEU  85  14.197   4.272   6.164
  639   HD12  LEU  85          HD12      LEU  85  12.968   4.972   7.219
  640   HD13  LEU  85          HD13      LEU  85  14.584   4.639   7.845
  641   HD21  LEU  85          HD21      LEU  85  13.095   7.295   7.907
  642   HD22  LEU  85          HD22      LEU  85  14.370   8.354   7.305
  643   HD23  LEU  85          HD23      LEU  85  14.738   7.144   8.536
  644    H    GLU  86           HN       GLU  86  18.069   4.489   6.266
  645    HA   GLU  86           HA       GLU  86  18.562   2.467   6.995
  646    HB2  GLU  86           HB2      GLU  86  16.159   2.751   7.833
  647    HB3  GLU  86           HB1      GLU  86  15.703   1.623   6.559
  648    HG2  GLU  86           HG2      GLU  86  16.047   0.578   8.796
  649    HG3  GLU  86           HG1      GLU  86  17.058  -0.101   7.514
  650    H    HIS  87           HN       HIS  87  18.885   2.956   4.201
  651    HA   HIS  87           HA       HIS  87  18.733   0.185   3.312
  652    HB2  HIS  87           HB2      HIS  87  17.735   2.014   1.800
  653    HB3  HIS  87           HB1      HIS  87  19.381   2.577   1.561
  654    HD1  HIS  87           HD1      HIS  87  17.220  -0.459   0.910
  655    HD2  HIS  87           HD2      HIS  87  20.796   1.229  -0.350
  656    HE1  HIS  87           HE1      HIS  87  17.965  -1.816  -1.070
  657    H    HIS  88           HN       HIS  88  20.401  -0.345   4.739
  658    HA   HIS  88           HA       HIS  88  23.048   0.684   3.979
  659    HB2  HIS  88           HB2      HIS  88  22.176  -0.363   6.683
  660    HB3  HIS  88           HB1      HIS  88  23.762   0.280   6.291
  661    HD1  HIS  88           HD1      HIS  88  20.641   1.225   7.881
  662    HD2  HIS  88           HD2      HIS  88  23.500   3.156   5.532
  663    HE1  HIS  88           HE1      HIS  88  20.362   3.664   8.311
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1   8.029   5.016  18.422
    2    H2   MET   1           HT2      MET   1   6.419   5.496  18.350
    3    H3   MET   1           HT3      MET   1   7.603   6.619  18.756
    4    HA   MET   1           HA       MET   1   6.798   6.875  16.505
    5    HB2  MET   1           HB2      MET   1   8.959   6.920  15.349
    6    HB3  MET   1           HB1      MET   1   9.144   7.514  16.989
    7    HG2  MET   1           HG2      MET   1  10.160   5.424  17.672
    8    HG3  MET   1           HG1      MET   1   9.833   4.717  16.097
    9    HE1  MET   1           HE1      MET   1  12.883   8.118  16.798
   10    HE2  MET   1           HE2      MET   1  11.922   7.383  18.084
   11    HE3  MET   1           HE3      MET   1  11.139   8.368  16.846
   12    H    VAL   2           HN       VAL   2   5.912   5.885  14.818
   13    HA   VAL   2           HA       VAL   2   6.945   3.274  14.069
   14    HB   VAL   2           HB       VAL   2   4.682   2.620  13.222
   15   HG11  VAL   2          HG11      VAL   2   3.636   2.076  15.369
   16   HG12  VAL   2          HG12      VAL   2   4.743   3.188  16.174
   17   HG13  VAL   2          HG13      VAL   2   5.370   1.753  15.362
   18   HG21  VAL   2          HG21      VAL   2   3.667   5.042  14.723
   19   HG22  VAL   2          HG22      VAL   2   2.666   3.813  13.958
   20   HG23  VAL   2          HG23      VAL   2   3.694   4.854  12.971
   21    H    THR   3           HN       THR   3   7.122   3.001  11.833
   22    HA   THR   3           HA       THR   3   6.533   5.404  10.365
   23    HB   THR   3           HB       THR   3   8.857   5.655  10.951
   24    HG1  THR   3           HG1      THR   3   8.518   6.417   8.965
   25   HG21  THR   3          HG21      THR   3   9.339   2.963   9.655
   26   HG22  THR   3          HG22      THR   3   9.459   3.324  11.376
   27   HG23  THR   3          HG23      THR   3  10.594   4.053  10.242
   28    H    ALA   4           HN       ALA   4   5.265   4.952   8.851
   29    HA   ALA   4           HA       ALA   4   5.515   2.401   7.446
   30    HB1  ALA   4           HB1      ALA   4   3.387   2.659   8.607
   31    HB2  ALA   4           HB2      ALA   4   3.154   2.695   6.862
   32    HB3  ALA   4           HB3      ALA   4   3.118   4.198   7.790
   33    H    ALA   5           HN       ALA   5   6.504   2.697   5.608
   34    HA   ALA   5           HA       ALA   5   6.582   5.316   4.366
   35    HB1  ALA   5           HB1      ALA   5   8.218   4.292   2.853
   36    HB2  ALA   5           HB2      ALA   5   7.905   2.725   3.612
   37    HB3  ALA   5           HB3      ALA   5   8.634   4.028   4.547
   38    H    LEU   6           HN       LEU   6   4.471   2.927   4.370
   39    HA   LEU   6           HA       LEU   6   3.332   3.708   1.864
   40    HB2  LEU   6           HB2      LEU   6   2.688   1.314   1.393
   41    HB3  LEU   6           HB1      LEU   6   4.314   1.750   0.985
   42    HG   LEU   6           HG       LEU   6   3.662   0.353   3.552
   43   HD11  LEU   6          HD11      LEU   6   4.288  -0.875   0.855
   44   HD12  LEU   6          HD12      LEU   6   2.734  -0.970   1.685
   45   HD13  LEU   6          HD13      LEU   6   4.150  -1.759   2.374
   46   HD21  LEU   6          HD21      LEU   6   5.890   1.325   3.333
   47   HD22  LEU   6          HD22      LEU   6   6.131   0.436   1.828
   48   HD23  LEU   6          HD23      LEU   6   5.965  -0.437   3.352
   49    H    THR   7           HN       THR   7   1.339   4.057   2.067
   50    HA   THR   7           HA       THR   7  -0.110   3.136   4.422
   51    HB   THR   7           HB       THR   7  -0.847   5.273   2.391
   52    HG1  THR   7           HG1      THR   7   0.350   5.611   4.947
   53   HG21  THR   7          HG21      THR   7  -2.700   4.394   3.728
   54   HG22  THR   7          HG22      THR   7  -2.339   6.064   4.167
   55   HG23  THR   7          HG23      THR   7  -1.803   4.740   5.204
   56    H    ILE   8           HN       ILE   8  -1.503   1.483   4.039
   57    HA   ILE   8           HA       ILE   8  -2.175   0.877   1.243
   58    HB   ILE   8           HB       ILE   8  -1.870  -1.007   3.589
   59   HG12  ILE   8          HG12      ILE   8  -0.359  -0.759   0.990
   60   HG13  ILE   8          HG11      ILE   8   0.240  -0.327   2.590
   61   HG21  ILE   8          HG21      ILE   8  -3.767  -1.711   2.244
   62   HG22  ILE   8          HG22      ILE   8  -2.434  -2.841   2.073
   63   HG23  ILE   8          HG23      ILE   8  -2.785  -1.694   0.775
   64   HD11  ILE   8          HD11      ILE   8   1.131  -2.446   1.862
   65   HD12  ILE   8          HD12      ILE   8  -0.505  -3.073   1.649
   66   HD13  ILE   8          HD13      ILE   8   0.081  -2.663   3.262
   67    H    TYR   9           HN       TYR   9  -4.197   0.935   0.705
   68    HA   TYR   9           HA       TYR   9  -6.067   1.477   2.754
   69    HB2  TYR   9           HB2      TYR   9  -6.410   1.318  -0.241
   70    HB3  TYR   9           HB1      TYR   9  -7.686   1.786   0.881
   71    HD1  TYR   9           HD1      TYR   9  -7.453   3.884   2.200
   72    HD2  TYR   9           HD2      TYR   9  -4.706   2.882  -0.875
   73    HE1  TYR   9           HE1      TYR   9  -6.649   6.208   2.171
   74    HE2  TYR   9           HE2      TYR   9  -3.897   5.201  -0.919
   75    HH   TYR   9           HH       TYR   9  -4.713   7.459   1.525
   76    H    THR  10           HN       THR  10  -7.549   0.103   3.632
   77    HA   THR  10           HA       THR  10  -7.679  -2.587   2.508
   78    HB   THR  10           HB       THR  10  -7.524  -3.442   4.886
   79    HG1  THR  10           HG1      THR  10  -7.555  -0.998   5.592
   80   HG21  THR  10          HG21      THR  10  -5.048  -2.170   3.720
   81   HG22  THR  10          HG22      THR  10  -5.720  -3.718   3.220
   82   HG23  THR  10          HG23      THR  10  -5.071  -3.523   4.857
   83    H    THR  11           HN       THR  11  -9.551  -3.692   2.878
   84    HA   THR  11           HA       THR  11 -11.498  -2.687   4.771
   85    HB   THR  11           HB       THR  11 -13.329  -3.212   3.153
   86    HG1  THR  11           HG1      THR  11 -11.307  -3.321   1.163
   87   HG21  THR  11          HG21      THR  11 -13.145  -1.263   1.668
   88   HG22  THR  11          HG22      THR  11 -11.442  -1.092   2.106
   89   HG23  THR  11          HG23      THR  11 -12.698  -0.859   3.322
   90    H    SER  12           HN       SER  12 -12.991  -4.508   5.271
   91    HA   SER  12           HA       SER  12 -11.529  -6.985   5.202
   92    HB2  SER  12           HB2      SER  12 -13.397  -7.791   6.689
   93    HB3  SER  12           HB1      SER  12 -12.497  -6.416   7.320
   94    HG   SER  12           HG       SER  12 -14.231  -5.060   6.537
   95    H    TRP  13           HN       TRP  13 -13.427  -5.532   3.056
   96    HA   TRP  13           HA       TRP  13 -15.292  -7.616   2.380
   97    HB2  TRP  13           HB2      TRP  13 -14.460  -5.272   0.668
   98    HB3  TRP  13           HB1      TRP  13 -15.941  -6.207   0.552
   99    HD1  TRP  13           HD1      TRP  13 -16.596  -6.002   3.779
  100    HE1  TRP  13           HE1      TRP  13 -17.515  -3.770   4.659
  101    HE3  TRP  13           HE3      TRP  13 -15.076  -2.949  -0.021
  102    HZ2  TRP  13           HZ2      TRP  13 -17.595  -1.073   3.846
  103    HZ3  TRP  13           HZ3      TRP  13 -15.621  -0.554   0.107
  104    HH2  TRP  13           HH2      TRP  13 -16.852   0.358   2.005
  105    H    CYS  14           HN       CYS  14 -12.099  -6.637   1.431
  106    HA   CYS  14           HA       CYS  14 -12.157  -8.510  -0.805
  107    HB2  CYS  14           HB2      CYS  14 -10.084  -7.264  -1.505
  108    HB3  CYS  14           HB1      CYS  14 -11.592  -6.349  -1.557
  109    H    GLY  15           HN       GLY  15 -10.969 -10.270  -0.812
  110    HA2  GLY  15           HA2      GLY  15  -9.342 -10.903   1.487
  111    HA3  GLY  15           HA1      GLY  15  -9.784 -12.000   0.179
  112    H    TYR  16           HN       TYR  16  -8.905 -10.003  -1.862
  113    HA   TYR  16           HA       TYR  16  -6.236 -10.905  -2.101
  114    HB2  TYR  16           HB2      TYR  16  -7.520 -10.367  -4.125
  115    HB3  TYR  16           HB1      TYR  16  -7.662  -8.691  -3.617
  116    HD1  TYR  16           HD1      TYR  16  -5.103 -11.262  -4.529
  117    HD2  TYR  16           HD2      TYR  16  -6.082  -7.135  -4.318
  118    HE1  TYR  16           HE1      TYR  16  -3.004 -10.712  -5.695
  119    HE2  TYR  16           HE2      TYR  16  -3.985  -6.562  -5.486
  120    HH   TYR  16           HH       TYR  16  -1.731  -7.556  -5.890
  121    H    CYS  17           HN       CYS  17  -7.677  -7.939  -0.954
  122    HA   CYS  17           HA       CYS  17  -5.477  -6.339  -0.653
  123    HB2  CYS  17           HB2      CYS  17  -7.797  -6.625   1.256
  124    HB3  CYS  17           HB1      CYS  17  -6.718  -5.234   1.158
  125    H    LEU  18           HN       LEU  18  -6.855  -8.793   1.510
  126    HA   LEU  18           HA       LEU  18  -5.029  -8.531   3.628
  127    HB2  LEU  18           HB2      LEU  18  -7.298  -9.441   3.865
  128    HB3  LEU  18           HB1      LEU  18  -6.857 -10.812   2.876
  129    HG   LEU  18           HG       LEU  18  -5.426 -10.326   5.488
  130   HD11  LEU  18          HD11      LEU  18  -8.043 -11.765   5.099
  131   HD12  LEU  18          HD12      LEU  18  -7.809 -10.233   5.949
  132   HD13  LEU  18          HD13      LEU  18  -7.089 -11.713   6.588
  133   HD21  LEU  18          HD21      LEU  18  -4.565 -12.070   3.967
  134   HD22  LEU  18          HD22      LEU  18  -6.151 -12.845   3.974
  135   HD23  LEU  18          HD23      LEU  18  -5.207 -12.752   5.459
  136    H    ARG  19           HN       ARG  19  -5.159 -10.634   0.815
  137    HA   ARG  19           HA       ARG  19  -3.060 -12.355   1.477
  138    HB2  ARG  19           HB2      ARG  19  -4.019 -11.430  -1.213
  139    HB3  ARG  19           HB1      ARG  19  -2.724 -12.594  -1.021
  140    HG2  ARG  19           HG2      ARG  19  -4.284 -14.068   0.207
  141    HG3  ARG  19           HG1      ARG  19  -5.575 -12.905  -0.112
  142    HD2  ARG  19           HD2      ARG  19  -5.553 -14.773  -1.738
  143    HD3  ARG  19           HD1      ARG  19  -5.318 -13.200  -2.489
  144    HE   ARG  19           HE       ARG  19  -2.796 -13.933  -2.149
  145   HH11  ARG  19          HH11      ARG  19  -5.405 -16.033  -3.268
  146   HH12  ARG  19          HH12      ARG  19  -4.471 -16.794  -4.455
  147   HH21  ARG  19          HH21      ARG  19  -1.510 -14.990  -3.680
  148   HH22  ARG  19          HH22      ARG  19  -2.148 -16.221  -4.675
  149    H    LEU  20           HN       LEU  20  -2.875  -9.414  -0.506
  150    HA   LEU  20           HA       LEU  20  -0.108  -9.472  -0.833
  151    HB2  LEU  20           HB2      LEU  20  -1.457  -8.070  -2.255
  152    HB3  LEU  20           HB1      LEU  20  -2.076  -7.186  -0.883
  153    HG   LEU  20           HG       LEU  20   0.336  -6.351  -0.567
  154   HD11  LEU  20          HD11      LEU  20   1.652  -7.738  -2.026
  155   HD12  LEU  20          HD12      LEU  20   1.611  -6.119  -2.685
  156   HD13  LEU  20          HD13      LEU  20   0.592  -7.355  -3.387
  157   HD21  LEU  20          HD21      LEU  20  -0.019  -4.527  -2.173
  158   HD22  LEU  20          HD22      LEU  20  -1.469  -4.922  -1.252
  159   HD23  LEU  20          HD23      LEU  20  -1.309  -5.473  -2.920
  160    H    LYS  21           HN       LYS  21  -2.177  -8.020   1.532
  161    HA   LYS  21           HA       LYS  21  -0.466  -6.463   3.069
  162    HB2  LYS  21           HB2      LYS  21  -2.984  -6.667   3.096
  163    HB3  LYS  21           HB1      LYS  21  -2.781  -8.137   4.026
  164    HG2  LYS  21           HG2      LYS  21  -1.756  -6.863   5.808
  165    HG3  LYS  21           HG1      LYS  21  -1.935  -5.386   4.859
  166    HD2  LYS  21           HD2      LYS  21  -4.369  -5.751   4.798
  167    HD3  LYS  21           HD1      LYS  21  -4.169  -7.163   5.835
  168    HE2  LYS  21           HE2      LYS  21  -3.465  -4.312   6.523
  169    HE3  LYS  21           HE1      LYS  21  -4.850  -5.216   7.117
  170    HZ1  LYS  21           HZ1      LYS  21  -2.001  -5.904   7.670
  171    HZ2  LYS  21           HZ2      LYS  21  -3.368  -6.710   8.269
  172    HZ3  LYS  21           HZ3      LYS  21  -3.076  -5.104   8.703
  173    H    THR  22           HN       THR  22  -1.332  -9.890   3.342
  174    HA   THR  22           HA       THR  22   0.157 -10.567   5.617
  175    HB   THR  22           HB       THR  22  -0.673 -12.300   3.267
  176    HG1  THR  22           HG1      THR  22  -2.466 -11.363   4.181
  177   HG21  THR  22          HG21      THR  22  -0.573 -14.170   4.869
  178   HG22  THR  22          HG22      THR  22   0.013 -13.069   6.115
  179   HG23  THR  22          HG23      THR  22   1.009 -13.405   4.698
  180    H    ALA  23           HN       ALA  23   0.944 -10.696   2.176
  181    HA   ALA  23           HA       ALA  23   3.477 -11.900   2.290
  182    HB1  ALA  23           HB1      ALA  23   3.820 -10.931   0.087
  183    HB2  ALA  23           HB2      ALA  23   2.458  -9.839   0.343
  184    HB3  ALA  23           HB3      ALA  23   2.181 -11.576   0.232
  185    H    LEU  24           HN       LEU  24   2.575  -8.502   2.305
  186    HA   LEU  24           HA       LEU  24   5.207  -7.492   2.438
  187    HB2  LEU  24           HB2      LEU  24   2.666  -6.206   3.398
  188    HB3  LEU  24           HB1      LEU  24   4.165  -5.379   3.027
  189    HG   LEU  24           HG       LEU  24   2.438  -6.842   1.055
  190   HD11  LEU  24          HD11      LEU  24   2.897  -3.901   1.416
  191   HD12  LEU  24          HD12      LEU  24   1.479  -4.793   1.945
  192   HD13  LEU  24          HD13      LEU  24   1.830  -4.669   0.229
  193   HD21  LEU  24          HD21      LEU  24   4.913  -5.174   0.623
  194   HD22  LEU  24          HD22      LEU  24   3.877  -5.815  -0.649
  195   HD23  LEU  24          HD23      LEU  24   4.777  -6.918   0.388
  196    H    THR  25           HN       THR  25   2.899  -8.428   4.898
  197    HA   THR  25           HA       THR  25   4.269  -7.363   7.118
  198    HB   THR  25           HB       THR  25   2.519  -9.859   7.129
  199    HG1  THR  25           HG1      THR  25   1.466  -7.967   6.164
  200   HG21  THR  25          HG21      THR  25   3.756  -9.446   9.220
  201   HG22  THR  25          HG22      THR  25   2.023  -9.184   9.440
  202   HG23  THR  25          HG23      THR  25   3.107  -7.807   9.271
  203    H    ALA  26           HN       ALA  26   4.372 -10.573   5.572
  204    HA   ALA  26           HA       ALA  26   6.285 -11.732   7.304
  205    HB1  ALA  26           HB1      ALA  26   4.820 -13.071   5.847
  206    HB2  ALA  26           HB2      ALA  26   6.521 -13.459   5.591
  207    HB3  ALA  26           HB3      ALA  26   5.665 -12.435   4.438
  208    H    ASN  27           HN       ASN  27   6.526  -9.866   4.426
  209    HA   ASN  27           HA       ASN  27   9.375 -10.237   4.153
  210    HB2  ASN  27           HB2      ASN  27   7.240  -8.899   2.626
  211    HB3  ASN  27           HB1      ASN  27   8.907  -8.376   2.312
  212   HD21  ASN  27          HD21      ASN  27   6.562 -10.899   2.033
  213   HD22  ASN  27          HD22      ASN  27   7.487 -11.953   1.023
  214    H    ARG  28           HN       ARG  28   8.074  -8.818   6.488
  215    HA   ARG  28           HA       ARG  28   8.471  -7.200   7.955
  216    HB2  ARG  28           HB2      ARG  28  10.793  -6.455   8.330
  217    HB3  ARG  28           HB1      ARG  28  10.714  -8.177   8.035
  218    HG2  ARG  28           HG2      ARG  28  11.526  -7.816   5.745
  219    HG3  ARG  28           HG1      ARG  28  11.581  -6.082   6.045
  220    HD2  ARG  28           HD2      ARG  28  13.173  -8.165   7.540
  221    HD3  ARG  28           HD1      ARG  28  13.793  -7.152   6.240
  222    HE   ARG  28           HE       ARG  28  12.634  -5.643   8.362
  223   HH11  ARG  28          HH11      ARG  28  15.637  -7.260   7.380
  224   HH12  ARG  28          HH12      ARG  28  16.620  -6.313   8.404
  225   HH21  ARG  28          HH21      ARG  28  13.973  -4.394   9.710
  226   HH22  ARG  28          HH22      ARG  28  15.663  -4.628   9.748
  227    H    ILE  29           HN       ILE  29   7.417  -6.332   5.356
  228    HA   ILE  29           HA       ILE  29   8.435  -3.645   5.106
  229    HB   ILE  29           HB       ILE  29   6.152  -5.027   3.628
  230   HG12  ILE  29          HG12      ILE  29   8.986  -4.408   2.708
  231   HG13  ILE  29          HG11      ILE  29   8.406  -5.996   3.182
  232   HG21  ILE  29          HG21      ILE  29   5.882  -2.605   3.715
  233   HG22  ILE  29          HG22      ILE  29   6.291  -3.125   2.075
  234   HG23  ILE  29          HG23      ILE  29   7.518  -2.388   3.107
  235   HD11  ILE  29          HD11      ILE  29   8.527  -5.747   0.771
  236   HD12  ILE  29          HD12      ILE  29   7.417  -4.374   0.845
  237   HD13  ILE  29          HD13      ILE  29   6.864  -5.988   1.301
  238    H    ALA  30           HN       ALA  30   7.747  -2.114   6.380
  239    HA   ALA  30           HA       ALA  30   5.429  -2.471   8.046
  240    HB1  ALA  30           HB1      ALA  30   6.202  -0.463   9.158
  241    HB2  ALA  30           HB2      ALA  30   7.384  -0.204   7.875
  242    HB3  ALA  30           HB3      ALA  30   7.536  -1.604   8.941
  243    H    TYR  31           HN       TYR  31   3.500  -1.841   7.481
  244    HA   TYR  31           HA       TYR  31   3.187   0.462   5.695
  245    HB2  TYR  31           HB2      TYR  31   1.286  -0.707   4.619
  246    HB3  TYR  31           HB1      TYR  31   2.804  -1.558   4.373
  247    HD1  TYR  31           HD1      TYR  31  -0.390  -1.608   6.247
  248    HD2  TYR  31           HD2      TYR  31   3.103  -3.785   5.177
  249    HE1  TYR  31           HE1      TYR  31  -1.386  -3.649   7.166
  250    HE2  TYR  31           HE2      TYR  31   2.109  -5.832   6.102
  251    HH   TYR  31           HH       TYR  31   0.455  -6.531   7.587
  252    H    ASP  32           HN       ASP  32   1.151   1.507   5.905
  253    HA   ASP  32           HA       ASP  32  -0.129   1.117   8.528
  254    HB2  ASP  32           HB2      ASP  32   0.919   3.307   8.333
  255    HB3  ASP  32           HB1      ASP  32   0.076   3.596   6.815
  256    H    GLU  33           HN       GLU  33  -2.005   0.119   8.351
  257    HA   GLU  33           HA       GLU  33  -3.404   0.067   5.817
  258    HB2  GLU  33           HB2      GLU  33  -4.879  -1.580   6.886
  259    HB3  GLU  33           HB1      GLU  33  -3.195  -1.997   7.082
  260    HG2  GLU  33           HG2      GLU  33  -3.202  -1.126   9.374
  261    HG3  GLU  33           HG1      GLU  33  -4.901  -0.702   9.200
  262    H    VAL  34           HN       VAL  34  -5.309   1.057   5.358
  263    HA   VAL  34           HA       VAL  34  -6.017   3.147   7.257
  264    HB   VAL  34           HB       VAL  34  -7.156   3.053   4.470
  265   HG11  VAL  34          HG11      VAL  34  -6.749   5.323   6.349
  266   HG12  VAL  34          HG12      VAL  34  -8.282   4.579   5.879
  267   HG13  VAL  34          HG13      VAL  34  -7.335   5.449   4.693
  268   HG21  VAL  34          HG21      VAL  34  -4.542   4.278   5.326
  269   HG22  VAL  34          HG22      VAL  34  -5.311   4.496   3.754
  270   HG23  VAL  34          HG23      VAL  34  -4.732   2.902   4.241
  271    H    ASP  35           HN       ASP  35  -7.794   3.584   7.942
  272    HA   ASP  35           HA       ASP  35  -9.770   1.764   8.684
  273    HB2  ASP  35           HB2      ASP  35 -10.715   3.982   9.665
  274    HB3  ASP  35           HB1      ASP  35  -9.241   3.265  10.311
  275    H    ILE  36           HN       ILE  36  -9.625   3.176   5.735
  276    HA   ILE  36           HA       ILE  36 -11.780   4.807   5.207
  277    HB   ILE  36           HB       ILE  36 -11.889   4.088   2.888
  278   HG12  ILE  36          HG12      ILE  36  -9.828   1.995   3.393
  279   HG13  ILE  36          HG11      ILE  36 -11.534   1.579   3.574
  280   HG21  ILE  36          HG21      ILE  36  -9.085   4.175   3.934
  281   HG22  ILE  36          HG22      ILE  36 -10.118   5.552   3.555
  282   HG23  ILE  36          HG23      ILE  36  -9.571   4.481   2.263
  283   HD11  ILE  36          HD11      ILE  36 -10.741   0.972   1.331
  284   HD12  ILE  36          HD12      ILE  36 -10.234   2.635   1.040
  285   HD13  ILE  36          HD13      ILE  36 -11.925   2.258   1.218
  286    H    GLU  37           HN       GLU  37 -12.068   1.390   5.777
  287    HA   GLU  37           HA       GLU  37 -14.513   0.862   4.518
  288    HB2  GLU  37           HB2      GLU  37 -12.955  -0.838   5.616
  289    HB3  GLU  37           HB1      GLU  37 -13.606  -0.306   7.149
  290    HG2  GLU  37           HG2      GLU  37 -15.858  -0.928   6.398
  291    HG3  GLU  37           HG1      GLU  37 -15.162  -1.562   4.911
  292    H    HIS  38           HN       HIS  38 -13.715   2.356   7.565
  293    HA   HIS  38           HA       HIS  38 -16.486   2.412   8.465
  294    HB2  HIS  38           HB2      HIS  38 -13.964   3.367   9.838
  295    HB3  HIS  38           HB1      HIS  38 -15.557   3.250  10.569
  296    HD1  HIS  38           HD1      HIS  38 -16.122   1.039  11.654
  297    HD2  HIS  38           HD2      HIS  38 -12.790   0.808   9.191
  298    HE1  HIS  38           HE1      HIS  38 -15.136  -1.264  12.005
  299    H    ASN  39           HN       ASN  39 -13.946   4.527   7.325
  300    HA   ASN  39           HA       ASN  39 -15.812   6.753   7.566
  301    HB2  ASN  39           HB2      ASN  39 -13.669   8.233   7.555
  302    HB3  ASN  39           HB1      ASN  39 -14.223   7.498   9.059
  303   HD21  ASN  39          HD21      ASN  39 -11.706   7.575   6.577
  304   HD22  ASN  39          HD22      ASN  39 -10.630   6.596   7.494
  305    H    ARG  40           HN       ARG  40 -16.619   7.445   5.881
  306    HA   ARG  40           HA       ARG  40 -15.762   6.845   3.283
  307    HB2  ARG  40           HB2      ARG  40 -17.464   8.464   2.507
  308    HB3  ARG  40           HB1      ARG  40 -18.097   7.315   3.670
  309    HG2  ARG  40           HG2      ARG  40 -18.024   8.973   5.416
  310    HG3  ARG  40           HG1      ARG  40 -17.241  10.122   4.337
  311    HD2  ARG  40           HD2      ARG  40 -19.628  10.597   4.575
  312    HD3  ARG  40           HD1      ARG  40 -19.199  10.177   2.928
  313    HE   ARG  40           HE       ARG  40 -20.035   7.867   3.564
  314   HH11  ARG  40          HH11      ARG  40 -21.382  10.737   5.119
  315   HH12  ARG  40          HH12      ARG  40 -22.984  10.156   5.105
  316   HH21  ARG  40          HH21      ARG  40 -22.214   7.068   3.584
  317   HH22  ARG  40          HH22      ARG  40 -23.474   8.022   4.219
  318    H    ALA  41           HN       ALA  41 -14.961   9.458   5.393
  319    HA   ALA  41           HA       ALA  41 -14.200  11.457   3.635
  320    HB1  ALA  41           HB1      ALA  41 -12.880  10.689   6.220
  321    HB2  ALA  41           HB2      ALA  41 -14.284  11.750   6.044
  322    HB3  ALA  41           HB3      ALA  41 -12.711  12.246   5.407
  323    H    ALA  42           HN       ALA  42 -12.383   8.688   4.734
  324    HA   ALA  42           HA       ALA  42 -10.122   9.424   3.098
  325    HB1  ALA  42           HB1      ALA  42  -9.681   8.456   5.274
  326    HB2  ALA  42           HB2      ALA  42  -9.079   7.376   4.015
  327    HB3  ALA  42           HB3      ALA  42 -10.599   7.019   4.851
  328    H    ALA  43           HN       ALA  43 -12.876   7.306   3.023
  329    HA   ALA  43           HA       ALA  43 -11.985   5.525   1.022
  330    HB1  ALA  43           HB1      ALA  43 -13.905   5.082   2.551
  331    HB2  ALA  43           HB2      ALA  43 -14.248   4.776   0.850
  332    HB3  ALA  43           HB3      ALA  43 -14.849   6.246   1.612
  333    H    GLU  44           HN       GLU  44 -13.605   8.637   0.852
  334    HA   GLU  44           HA       GLU  44 -14.165   8.519  -1.908
  335    HB2  GLU  44           HB2      GLU  44 -13.808  10.909  -0.104
  336    HB3  GLU  44           HB1      GLU  44 -14.367  11.002  -1.771
  337    HG2  GLU  44           HG2      GLU  44 -15.738   9.583   0.500
  338    HG3  GLU  44           HG1      GLU  44 -16.239  11.095  -0.261
  339    H    PHE  45           HN       PHE  45 -11.321   9.500  -0.129
  340    HA   PHE  45           HA       PHE  45  -9.969  10.696  -2.307
  341    HB2  PHE  45           HB2      PHE  45  -9.242  11.058   0.025
  342    HB3  PHE  45           HB1      PHE  45  -8.837   9.353   0.169
  343    HD1  PHE  45           HD2      PHE  45  -7.984  12.408  -1.772
  344    HD2  PHE  45           HD1      PHE  45  -6.673   8.636  -0.307
  345    HE1  PHE  45           HE2      PHE  45  -5.700  12.898  -2.561
  346    HE2  PHE  45           HE1      PHE  45  -4.390   9.120  -1.090
  347    HZ   PHE  45           HZ       PHE  45  -3.904  11.252  -2.220
  348    H    VAL  46           HN       VAL  46 -10.206   7.465  -1.069
  349    HA   VAL  46           HA       VAL  46  -8.364   6.114  -2.682
  350    HB   VAL  46           HB       VAL  46 -11.026   5.094  -1.649
  351   HG11  VAL  46          HG11      VAL  46  -8.557   3.583  -2.476
  352   HG12  VAL  46          HG12      VAL  46 -10.092   3.611  -3.344
  353   HG13  VAL  46          HG13      VAL  46  -9.996   2.870  -1.746
  354   HG21  VAL  46          HG21      VAL  46  -9.762   4.264   0.234
  355   HG22  VAL  46          HG22      VAL  46  -9.645   6.017   0.112
  356   HG23  VAL  46          HG23      VAL  46  -8.298   4.999  -0.406
  357    H    GLY  47           HN       GLY  47 -11.688   7.057  -3.213
  358    HA2  GLY  47           HA2      GLY  47 -12.037   5.760  -5.716
  359    HA3  GLY  47           HA1      GLY  47 -13.017   7.081  -5.079
  360    H    SER  48           HN       SER  48 -11.268   9.092  -4.788
  361    HA   SER  48           HA       SER  48 -11.083  10.177  -7.345
  362    HB2  SER  48           HB2      SER  48  -9.574  11.010  -4.870
  363    HB3  SER  48           HB1      SER  48  -9.934  12.013  -6.279
  364    HG   SER  48           HG       SER  48 -12.228  11.132  -5.619
  365    H    VAL  49           HN       VAL  49  -8.593   8.555  -5.388
  366    HA   VAL  49           HA       VAL  49  -6.525   9.234  -7.255
  367    HB   VAL  49           HB       VAL  49  -6.163   8.938  -4.779
  368   HG11  VAL  49          HG11      VAL  49  -7.418   6.946  -4.384
  369   HG12  VAL  49          HG12      VAL  49  -5.741   6.713  -3.881
  370   HG13  VAL  49          HG13      VAL  49  -6.318   6.004  -5.390
  371   HG21  VAL  49          HG21      VAL  49  -4.366   7.303  -6.558
  372   HG22  VAL  49          HG22      VAL  49  -3.929   7.985  -4.984
  373   HG23  VAL  49          HG23      VAL  49  -4.297   9.048  -6.344
  374    H    ASN  50           HN       ASN  50  -8.913   6.954  -7.286
  375    HA   ASN  50           HA       ASN  50  -7.365   5.153  -9.000
  376    HB2  ASN  50           HB2      ASN  50  -9.775   4.715  -7.308
  377    HB3  ASN  50           HB1      ASN  50  -9.636   3.778  -8.787
  378   HD21  ASN  50          HD21      ASN  50  -8.408   4.310  -5.616
  379   HD22  ASN  50          HD22      ASN  50  -7.371   2.923  -5.560
  380    H    GLY  51           HN       GLY  51 -10.721   6.337  -8.869
  381    HA2  GLY  51           HA2      GLY  51 -11.270   7.693 -10.935
  382    HA3  GLY  51           HA1      GLY  51 -10.736   6.246 -11.790
  383    H    GLY  52           HN       GLY  52 -12.200   4.807 -12.236
  384    HA2  GLY  52           HA2      GLY  52 -14.903   5.184 -11.263
  385    HA3  GLY  52           HA1      GLY  52 -14.384   4.059 -12.506
  386    H    ASN  53           HN       ASN  53 -12.494   2.633 -11.233
  387    HA   ASN  53           HA       ASN  53 -14.154   1.017  -9.455
  388    HB2  ASN  53           HB2      ASN  53 -12.991  -0.068 -11.382
  389    HB3  ASN  53           HB1      ASN  53 -11.450   0.385 -10.665
  390   HD21  ASN  53          HD21      ASN  53 -10.700  -0.774  -8.823
  391   HD22  ASN  53          HD22      ASN  53 -11.460  -2.245  -8.348
  392    H    ARG  54           HN       ARG  54 -13.955   1.339  -7.364
  393    HA   ARG  54           HA       ARG  54 -11.693   2.760  -6.283
  394    HB2  ARG  54           HB2      ARG  54 -14.237   2.887  -5.528
  395    HB3  ARG  54           HB1      ARG  54 -13.807   1.447  -4.606
  396    HG2  ARG  54           HG2      ARG  54 -12.173   2.642  -3.371
  397    HG3  ARG  54           HG1      ARG  54 -12.435   4.093  -4.343
  398    HD2  ARG  54           HD2      ARG  54 -14.414   2.752  -2.499
  399    HD3  ARG  54           HD1      ARG  54 -13.640   4.315  -2.266
  400    HE   ARG  54           HE       ARG  54 -15.473   3.816  -4.530
  401   HH11  ARG  54          HH11      ARG  54 -14.519   5.874  -1.802
  402   HH12  ARG  54          HH12      ARG  54 -15.822   6.954  -2.008
  403   HH21  ARG  54          HH21      ARG  54 -17.164   5.363  -4.846
  404   HH22  ARG  54          HH22      ARG  54 -17.307   6.695  -3.809
  405    H    THR  55           HN       THR  55 -10.104   1.243  -6.838
  406    HA   THR  55           HA       THR  55 -10.108  -1.442  -5.956
  407    HB   THR  55           HB       THR  55  -7.700   0.258  -6.587
  408    HG1  THR  55           HG1      THR  55  -8.517   0.498  -8.472
  409   HG21  THR  55          HG21      THR  55  -8.336  -2.670  -6.951
  410   HG22  THR  55          HG22      THR  55  -7.239  -1.978  -5.747
  411   HG23  THR  55          HG23      THR  55  -6.841  -1.883  -7.463
  412    H    VAL  56           HN       VAL  56  -9.621  -2.170  -3.929
  413    HA   VAL  56           HA       VAL  56  -9.095  -0.158  -1.995
  414    HB   VAL  56           HB       VAL  56  -8.958  -3.038  -1.269
  415   HG11  VAL  56          HG11      VAL  56  -8.234  -1.355   0.305
  416   HG12  VAL  56          HG12      VAL  56  -9.698  -2.162   0.897
  417   HG13  VAL  56          HG13      VAL  56  -9.782  -0.547   0.181
  418   HG21  VAL  56          HG21      VAL  56 -11.041  -2.697  -2.529
  419   HG22  VAL  56          HG22      VAL  56 -11.404  -1.323  -1.469
  420   HG23  VAL  56          HG23      VAL  56 -11.321  -2.968  -0.799
  421    HA   PRO  57           HA       PRO  57  -5.322  -2.459  -1.001
  422    HB2  PRO  57           HB2      PRO  57  -3.889  -4.153  -2.547
  423    HB3  PRO  57           HB1      PRO  57  -5.275  -4.636  -1.562
  424    HG2  PRO  57           HG2      PRO  57  -5.318  -3.804  -4.456
  425    HG3  PRO  57           HG1      PRO  57  -5.933  -5.310  -3.742
  426    HD2  PRO  57           HD2      PRO  57  -7.599  -3.336  -4.173
  427    HD3  PRO  57           HD1      PRO  57  -7.589  -4.304  -2.646
  428    H    THR  58           HN       THR  58  -5.503  -0.231  -2.534
  429    HA   THR  58           HA       THR  58  -3.404   0.244  -4.409
  430    HB   THR  58           HB       THR  58  -5.403   1.939  -2.946
  431    HG1  THR  58           HG1      THR  58  -6.644   0.970  -4.372
  432   HG21  THR  58          HG21      THR  58  -3.614   2.706  -5.278
  433   HG22  THR  58          HG22      THR  58  -3.492   3.326  -3.632
  434   HG23  THR  58          HG23      THR  58  -4.897   3.723  -4.619
  435    H    VAL  59           HN       VAL  59  -1.418   0.535  -3.619
  436    HA   VAL  59           HA       VAL  59  -1.118   1.306  -0.845
  437    HB   VAL  59           HB       VAL  59   0.145  -0.685  -1.512
  438   HG11  VAL  59          HG11      VAL  59   1.373   1.058  -3.563
  439   HG12  VAL  59          HG12      VAL  59   0.324  -0.330  -3.833
  440   HG13  VAL  59          HG13      VAL  59   1.945  -0.567  -3.149
  441   HG21  VAL  59          HG21      VAL  59   1.982   1.666  -1.114
  442   HG22  VAL  59          HG22      VAL  59   2.396  -0.028  -0.848
  443   HG23  VAL  59          HG23      VAL  59   1.164   0.751   0.150
  444    H    LYS  60           HN       LYS  60  -0.488   3.208  -0.272
  445    HA   LYS  60           HA       LYS  60   0.266   5.196  -2.300
  446    HB2  LYS  60           HB2      LYS  60  -1.743   5.671  -0.945
  447    HB3  LYS  60           HB1      LYS  60  -0.805   5.430   0.514
  448    HG2  LYS  60           HG2      LYS  60   0.523   7.417  -0.135
  449    HG3  LYS  60           HG1      LYS  60  -0.588   7.650  -1.491
  450    HD2  LYS  60           HD2      LYS  60  -2.472   7.727   0.082
  451    HD3  LYS  60           HD1      LYS  60  -1.351   7.536   1.424
  452    HE2  LYS  60           HE2      LYS  60  -0.221   9.586   0.654
  453    HE3  LYS  60           HE1      LYS  60  -1.523   9.828  -0.506
  454    HZ1  LYS  60           HZ1      LYS  60  -3.102   9.818   1.392
  455    HZ2  LYS  60           HZ2      LYS  60  -2.006  11.087   1.465
  456    HZ3  LYS  60           HZ3      LYS  60  -1.795   9.737   2.451
  457    H    PHE  61           HN       PHE  61   2.396   5.634  -2.335
  458    HA   PHE  61           HA       PHE  61   3.973   4.728  -0.091
  459    HB2  PHE  61           HB2      PHE  61   4.723   5.541  -2.889
  460    HB3  PHE  61           HB1      PHE  61   5.953   5.345  -1.626
  461    HD1  PHE  61           HD1      PHE  61   6.327   3.110  -0.635
  462    HD2  PHE  61           HD2      PHE  61   3.621   3.749  -3.885
  463    HE1  PHE  61           HE1      PHE  61   6.260   0.727  -1.058
  464    HE2  PHE  61           HE2      PHE  61   3.591   1.323  -4.314
  465    HZ   PHE  61           HZ       PHE  61   4.900  -0.175  -2.912
  466    H    ALA  62           HN       ALA  62   5.774   6.004   0.646
  467    HA   ALA  62           HA       ALA  62   4.942   8.357   1.844
  468    HB1  ALA  62           HB1      ALA  62   6.706   6.890   2.706
  469    HB2  ALA  62           HB2      ALA  62   7.202   8.580   2.651
  470    HB3  ALA  62           HB3      ALA  62   7.783   7.453   1.426
  471    H    ASP  63           HN       ASP  63   6.228   7.950  -1.313
  472    HA   ASP  63           HA       ASP  63   7.193  10.650  -1.569
  473    HB2  ASP  63           HB2      ASP  63   7.578  10.169  -3.910
  474    HB3  ASP  63           HB1      ASP  63   8.110   8.782  -2.974
  475    H    GLY  64           HN       GLY  64   4.146   9.146  -1.680
  476    HA2  GLY  64           HA2      GLY  64   2.227  10.594  -1.562
  477    HA3  GLY  64           HA1      GLY  64   2.995  11.623  -2.761
  478    H    SER  65           HN       SER  65   3.796   9.075  -4.271
  479    HA   SER  65           HA       SER  65   1.378   9.013  -5.815
  480    HB2  SER  65           HB2      SER  65   3.934   7.470  -6.245
  481    HB3  SER  65           HB1      SER  65   2.677   7.812  -7.439
  482    HG   SER  65           HG       SER  65   4.615   9.378  -6.327
  483    H    THR  66           HN       THR  66   0.434   6.969  -6.515
  484    HA   THR  66           HA       THR  66   0.415   5.041  -4.339
  485    HB   THR  66           HB       THR  66  -1.913   4.565  -5.321
  486    HG1  THR  66           HG1      THR  66  -2.011   7.204  -6.148
  487   HG21  THR  66          HG21      THR  66  -2.945   6.387  -4.019
  488   HG22  THR  66          HG22      THR  66  -1.389   7.219  -3.953
  489   HG23  THR  66          HG23      THR  66  -1.596   5.662  -3.152
  490    H    LEU  67           HN       LEU  67  -0.337   2.888  -5.146
  491    HA   LEU  67           HA       LEU  67   0.285   2.346  -7.917
  492    HB2  LEU  67           HB2      LEU  67   2.332   2.022  -6.400
  493    HB3  LEU  67           HB1      LEU  67   1.443   0.732  -5.635
  494    HG   LEU  67           HG       LEU  67   1.423  -0.497  -7.794
  495   HD11  LEU  67          HD11      LEU  67   3.032   0.261  -9.524
  496   HD12  LEU  67          HD12      LEU  67   3.172   1.803  -8.682
  497   HD13  LEU  67          HD13      LEU  67   1.633   1.313  -9.391
  498   HD21  LEU  67          HD21      LEU  67   3.770  -1.130  -7.716
  499   HD22  LEU  67          HD22      LEU  67   3.137  -0.909  -6.081
  500   HD23  LEU  67          HD23      LEU  67   4.142   0.337  -6.820
  501    H    THR  68           HN       THR  68  -1.562   1.487  -8.559
  502    HA   THR  68           HA       THR  68  -3.353   0.245  -6.693
  503    HB   THR  68           HB       THR  68  -3.620   0.961  -9.620
  504    HG1  THR  68           HG1      THR  68  -4.963   2.206  -7.496
  505   HG21  THR  68          HG21      THR  68  -6.040   0.672  -9.257
  506   HG22  THR  68          HG22      THR  68  -5.715   0.112  -7.617
  507   HG23  THR  68          HG23      THR  68  -5.167  -0.839  -8.996
  508    H    ASN  69           HN       ASN  69  -3.470  -1.864  -6.392
  509    HA   ASN  69           HA       ASN  69  -3.163  -4.059  -6.501
  510    HB2  ASN  69           HB2      ASN  69  -3.921  -3.517  -9.340
  511    HB3  ASN  69           HB1      ASN  69  -3.443  -5.142  -8.866
  512   HD21  ASN  69          HD21      ASN  69  -5.965  -4.190  -9.835
  513   HD22  ASN  69          HD22      ASN  69  -7.130  -4.586  -8.630
  514    HA   PRO  70           HA       PRO  70   1.161  -4.167  -7.962
  515    HB2  PRO  70           HB2      PRO  70   2.502  -3.727  -5.765
  516    HB3  PRO  70           HB1      PRO  70   1.688  -2.371  -6.568
  517    HG2  PRO  70           HG2      PRO  70   0.750  -3.993  -4.224
  518    HG3  PRO  70           HG1      PRO  70   0.829  -2.225  -4.377
  519    HD2  PRO  70           HD2      PRO  70  -1.458  -3.654  -4.848
  520    HD3  PRO  70           HD1      PRO  70  -1.046  -2.119  -5.648
  521    H    SER  71           HN       SER  71   2.961  -5.498  -6.824
  522    HA   SER  71           HA       SER  71   1.941  -7.845  -5.406
  523    HB2  SER  71           HB2      SER  71   4.159  -7.781  -7.483
  524    HB3  SER  71           HB1      SER  71   3.480  -9.208  -6.699
  525    HG   SER  71           HG       SER  71   1.967  -7.423  -8.278
  526    H    ALA  72           HN       ALA  72   3.891  -8.858  -4.151
  527    HA   ALA  72           HA       ALA  72   4.933  -6.997  -2.405
  528    HB1  ALA  72           HB1      ALA  72   6.113  -9.712  -3.000
  529    HB2  ALA  72           HB2      ALA  72   4.748  -9.407  -1.928
  530    HB3  ALA  72           HB3      ALA  72   6.344  -8.766  -1.531
  531    H    ASP  73           HN       ASP  73   6.580  -8.457  -5.180
  532    HA   ASP  73           HA       ASP  73   9.045  -7.175  -4.733
  533    HB2  ASP  73           HB2      ASP  73   9.710  -7.865  -6.967
  534    HB3  ASP  73           HB1      ASP  73   8.813  -9.165  -6.207
  535    H    GLU  74           HN       GLU  74   6.222  -6.162  -6.515
  536    HA   GLU  74           HA       GLU  74   7.255  -3.854  -7.793
  537    HB2  GLU  74           HB2      GLU  74   4.491  -4.546  -6.835
  538    HB3  GLU  74           HB1      GLU  74   4.846  -3.066  -7.709
  539    HG2  GLU  74           HG2      GLU  74   5.317  -5.841  -8.751
  540    HG3  GLU  74           HG1      GLU  74   3.915  -4.834  -9.122
  541    H    VAL  75           HN       VAL  75   5.776  -4.372  -4.681
  542    HA   VAL  75           HA       VAL  75   5.656  -1.677  -3.876
  543    HB   VAL  75           HB       VAL  75   5.626  -4.230  -2.239
  544   HG11  VAL  75          HG11      VAL  75   6.273  -2.306  -0.834
  545   HG12  VAL  75          HG12      VAL  75   4.682  -2.932  -0.415
  546   HG13  VAL  75          HG13      VAL  75   4.817  -1.451  -1.354
  547   HG21  VAL  75          HG21      VAL  75   3.203  -3.867  -2.190
  548   HG22  VAL  75          HG22      VAL  75   3.811  -4.044  -3.831
  549   HG23  VAL  75          HG23      VAL  75   3.406  -2.446  -3.211
  550    H    LYS  76           HN       LYS  76   7.888  -4.306  -3.156
  551    HA   LYS  76           HA       LYS  76   9.553  -2.817  -1.511
  552    HB2  LYS  76           HB2      LYS  76   9.603  -5.211  -1.376
  553    HB3  LYS  76           HB1      LYS  76  10.106  -5.358  -3.057
  554    HG2  LYS  76           HG2      LYS  76  12.197  -4.671  -2.637
  555    HG3  LYS  76           HG1      LYS  76  11.825  -3.895  -1.077
  556    HD2  LYS  76           HD2      LYS  76  11.397  -6.281  -0.264
  557    HD3  LYS  76           HD1      LYS  76  12.104  -6.819  -1.796
  558    HE2  LYS  76           HE2      LYS  76  14.141  -5.584  -1.306
  559    HE3  LYS  76           HE1      LYS  76  13.449  -5.009   0.202
  560    HZ1  LYS  76           HZ1      LYS  76  14.143  -7.812  -0.476
  561    HZ2  LYS  76           HZ2      LYS  76  13.366  -7.347   0.951
  562    HZ3  LYS  76           HZ3      LYS  76  14.921  -6.778   0.607
  563    H    ALA  77           HN       ALA  77   9.470  -3.061  -4.974
  564    HA   ALA  77           HA       ALA  77  12.030  -1.903  -5.472
  565    HB1  ALA  77           HB1      ALA  77  11.267  -1.674  -7.766
  566    HB2  ALA  77           HB2      ALA  77   9.605  -1.989  -7.267
  567    HB3  ALA  77           HB3      ALA  77  10.820  -3.258  -7.134
  568    H    LYS  78           HN       LYS  78   8.912  -0.499  -4.775
  569    HA   LYS  78           HA       LYS  78   9.923   2.196  -5.354
  570    HB2  LYS  78           HB2      LYS  78   7.333   1.177  -4.199
  571    HB3  LYS  78           HB1      LYS  78   7.764   2.862  -4.051
  572    HG2  LYS  78           HG2      LYS  78   7.387   1.358  -6.646
  573    HG3  LYS  78           HG1      LYS  78   6.220   2.459  -5.898
  574    HD2  LYS  78           HD2      LYS  78   8.958   3.171  -6.955
  575    HD3  LYS  78           HD1      LYS  78   7.426   3.560  -7.703
  576    HE2  LYS  78           HE2      LYS  78   8.266   4.600  -4.972
  577    HE3  LYS  78           HE1      LYS  78   8.436   5.488  -6.473
  578    HZ1  LYS  78           HZ1      LYS  78   5.785   4.559  -5.445
  579    HZ2  LYS  78           HZ2      LYS  78   6.095   5.593  -6.727
  580    HZ3  LYS  78           HZ3      LYS  78   6.440   6.090  -5.166
  581    H    LEU  79           HN       LEU  79   9.408   0.093  -2.662
  582    HA   LEU  79           HA       LEU  79   9.730   1.834  -0.568
  583    HB2  LEU  79           HB2      LEU  79   9.155  -0.664  -0.455
  584    HB3  LEU  79           HB1      LEU  79  10.853  -0.954  -0.684
  585    HG   LEU  79           HG       LEU  79  11.263   0.302   1.436
  586   HD11  LEU  79          HD11      LEU  79   8.276   0.107   1.650
  587   HD12  LEU  79          HD12      LEU  79   9.278   1.563   1.798
  588   HD13  LEU  79          HD13      LEU  79   9.341   0.308   3.025
  589   HD21  LEU  79          HD21      LEU  79  11.372  -2.119   1.320
  590   HD22  LEU  79          HD22      LEU  79   9.629  -2.226   1.559
  591   HD23  LEU  79          HD23      LEU  79  10.660  -1.613   2.852
  592    H    VAL  80           HN       VAL  80  12.159  -0.036  -2.290
  593    HA   VAL  80           HA       VAL  80  14.386   0.776  -0.849
  594    HB   VAL  80           HB       VAL  80  15.739   0.015  -2.835
  595   HG11  VAL  80          HG11      VAL  80  14.973  -2.299  -2.702
  596   HG12  VAL  80          HG12      VAL  80  13.549  -1.713  -1.794
  597   HG13  VAL  80          HG13      VAL  80  15.165  -1.518  -1.131
  598   HG21  VAL  80          HG21      VAL  80  14.231   0.662  -4.614
  599   HG22  VAL  80          HG22      VAL  80  13.011  -0.438  -3.993
  600   HG23  VAL  80          HG23      VAL  80  14.517  -1.085  -4.660
  601    H    LYS  81           HN       LYS  81  12.848   2.403  -3.517
  602    HA   LYS  81           HA       LYS  81  15.106   4.149  -3.686
  603    HB2  LYS  81           HB2      LYS  81  14.031   5.287  -5.517
  604    HB3  LYS  81           HB1      LYS  81  13.868   3.545  -5.703
  605    HG2  LYS  81           HG2      LYS  81  11.621   3.587  -5.086
  606    HG3  LYS  81           HG1      LYS  81  11.712   5.281  -4.621
  607    HD2  LYS  81           HD2      LYS  81  10.681   5.310  -6.774
  608    HD3  LYS  81           HD1      LYS  81  12.338   5.792  -7.012
  609    HE2  LYS  81           HE2      LYS  81  11.438   2.949  -7.430
  610    HE3  LYS  81           HE1      LYS  81  11.385   4.151  -8.701
  611    HZ1  LYS  81           HZ1      LYS  81  13.354   2.838  -8.882
  612    HZ2  LYS  81           HZ2      LYS  81  13.862   3.168  -7.334
  613    HZ3  LYS  81           HZ3      LYS  81  13.805   4.400  -8.490
  614    H    ILE  82           HN       ILE  82  11.838   4.326  -2.386
  615    HA   ILE  82           HA       ILE  82  12.138   7.110  -1.844
  616    HB   ILE  82           HB       ILE  82   9.903   7.029  -0.761
  617   HG12  ILE  82          HG12      ILE  82   8.524   4.877  -1.171
  618   HG13  ILE  82          HG11      ILE  82  10.067   4.059  -1.338
  619   HG21  ILE  82          HG21      ILE  82   8.616   6.534  -2.773
  620   HG22  ILE  82          HG22      ILE  82  10.009   5.707  -3.455
  621   HG23  ILE  82          HG23      ILE  82  10.087   7.446  -3.133
  622   HD11  ILE  82          HD11      ILE  82   9.077   5.491   1.113
  623   HD12  ILE  82          HD12      ILE  82  10.624   4.665   0.962
  624   HD13  ILE  82          HD13      ILE  82   9.119   3.745   0.867
  625    H    ALA  83           HN       ALA  83  12.895   4.279  -0.133
  626    HA   ALA  83           HA       ALA  83  13.007   5.611   2.431
  627    HB1  ALA  83           HB1      ALA  83  12.343   3.248   2.313
  628    HB2  ALA  83           HB2      ALA  83  13.804   3.464   3.285
  629    HB3  ALA  83           HB3      ALA  83  13.922   2.846   1.642
  630    H    GLY  84           HN       GLY  84  14.826   5.868  -0.178
  631    HA2  GLY  84           HA2      GLY  84  16.863   6.906  -0.452
  632    HA3  GLY  84           HA1      GLY  84  17.052   6.898   1.295
  633    H    LEU  85           HN       LEU  85  18.350   5.447   2.199
  634    HA   LEU  85           HA       LEU  85  19.264   3.221   0.534
  635    HB2  LEU  85           HB2      LEU  85  21.542   3.425   1.346
  636    HB3  LEU  85           HB1      LEU  85  21.054   4.892   0.540
  637    HG   LEU  85           HG       LEU  85  21.150   4.612   3.560
  638   HD11  LEU  85          HD11      LEU  85  23.214   5.734   1.673
  639   HD12  LEU  85          HD12      LEU  85  23.367   4.250   2.613
  640   HD13  LEU  85          HD13      LEU  85  23.277   5.809   3.434
  641   HD21  LEU  85          HD21      LEU  85  19.743   6.455   2.714
  642   HD22  LEU  85          HD22      LEU  85  21.100   7.049   1.765
  643   HD23  LEU  85          HD23      LEU  85  21.186   7.057   3.527
  644    H    GLU  86           HN       GLU  86  17.584   3.975   3.149
  645    HA   GLU  86           HA       GLU  86  18.715   1.904   4.860
  646    HB2  GLU  86           HB2      GLU  86  17.858   4.275   5.624
  647    HB3  GLU  86           HB1      GLU  86  16.269   3.551   5.498
  648    HG2  GLU  86           HG2      GLU  86  18.518   2.675   7.312
  649    HG3  GLU  86           HG1      GLU  86  17.056   3.525   7.791
  650    H    HIS  87           HN       HIS  87  18.203   0.098   3.651
  651    HA   HIS  87           HA       HIS  87  15.576  -0.951   3.857
  652    HB2  HIS  87           HB2      HIS  87  15.176  -1.309   1.447
  653    HB3  HIS  87           HB1      HIS  87  15.244   0.411   1.800
  654    HD1  HIS  87           HD1      HIS  87  17.306  -2.349   0.097
  655    HD2  HIS  87           HD2      HIS  87  17.187   1.810   0.452
  656    HE1  HIS  87           HE1      HIS  87  18.924  -1.454  -1.583
  657    H    HIS  88           HN       HIS  88  15.616  -3.150   2.622
  658    HA   HIS  88           HA       HIS  88  18.324  -4.209   2.653
  659    HB2  HIS  88           HB2      HIS  88  15.827  -5.499   3.818
  660    HB3  HIS  88           HB1      HIS  88  17.336  -6.360   3.542
  661    HD1  HIS  88           HD1      HIS  88  19.135  -6.131   5.317
  662    HD2  HIS  88           HD2      HIS  88  15.977  -3.496   5.870
  663    HE1  HIS  88           HE1      HIS  88  19.516  -5.044   7.561
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  -2.997   4.549  12.085
    2    H2   MET   1           HT2      MET   1  -1.730   3.571  12.562
    3    H3   MET   1           HT3      MET   1  -1.507   4.597  11.276
    4    HA   MET   1           HA       MET   1  -1.848   6.491  12.796
    5    HB2  MET   1           HB2      MET   1  -3.247   5.308  14.446
    6    HB3  MET   1           HB1      MET   1  -1.888   4.300  14.898
    7    HG2  MET   1           HG2      MET   1  -1.738   7.273  15.221
    8    HG3  MET   1           HG1      MET   1  -2.582   6.289  16.410
    9    HE1  MET   1           HE1      MET   1  -0.936   7.380  18.237
   10    HE2  MET   1           HE2      MET   1  -0.072   8.267  16.982
   11    HE3  MET   1           HE3      MET   1   0.823   7.289  18.147
   12    H    VAL   2           HN       VAL   2   0.140   3.629  13.743
   13    HA   VAL   2           HA       VAL   2   2.473   5.170  14.160
   14    HB   VAL   2           HB       VAL   2   2.261   2.249  13.330
   15   HG11  VAL   2          HG11      VAL   2   4.490   3.118  12.968
   16   HG12  VAL   2          HG12      VAL   2   4.498   2.022  14.353
   17   HG13  VAL   2          HG13      VAL   2   4.528   3.770  14.604
   18   HG21  VAL   2          HG21      VAL   2   2.453   3.446  16.094
   19   HG22  VAL   2          HG22      VAL   2   2.490   1.723  15.720
   20   HG23  VAL   2          HG23      VAL   2   1.034   2.663  15.400
   21    H    THR   3           HN       THR   3   3.534   6.281  12.623
   22    HA   THR   3           HA       THR   3   2.687   5.907   9.941
   23    HB   THR   3           HB       THR   3   4.838   7.801  10.869
   24    HG1  THR   3           HG1      THR   3   2.229   7.637  11.612
   25   HG21  THR   3          HG21      THR   3   2.726   7.980   8.704
   26   HG22  THR   3          HG22      THR   3   4.401   7.527   8.432
   27   HG23  THR   3          HG23      THR   3   4.012   9.151   9.012
   28    H    ALA   4           HN       ALA   4   3.426   4.018   9.265
   29    HA   ALA   4           HA       ALA   4   6.256   3.388   9.168
   30    HB1  ALA   4           HB1      ALA   4   3.864   1.970   7.966
   31    HB2  ALA   4           HB2      ALA   4   4.620   1.577   9.508
   32    HB3  ALA   4           HB3      ALA   4   5.515   1.352   8.006
   33    H    ALA   5           HN       ALA   5   7.009   2.647   6.901
   34    HA   ALA   5           HA       ALA   5   7.028   4.955   5.281
   35    HB1  ALA   5           HB1      ALA   5   8.925   3.461   5.447
   36    HB2  ALA   5           HB2      ALA   5   8.416   3.629   3.761
   37    HB3  ALA   5           HB3      ALA   5   7.991   2.178   4.688
   38    H    LEU   6           HN       LEU   6   4.961   2.204   5.315
   39    HA   LEU   6           HA       LEU   6   3.933   2.937   2.655
   40    HB2  LEU   6           HB2      LEU   6   3.516   0.313   4.069
   41    HB3  LEU   6           HB1      LEU   6   3.056   0.757   2.439
   42    HG   LEU   6           HG       LEU   6   5.873   0.427   3.405
   43   HD11  LEU   6          HD11      LEU   6   4.674  -1.674   3.283
   44   HD12  LEU   6          HD12      LEU   6   5.828  -1.543   1.956
   45   HD13  LEU   6          HD13      LEU   6   4.110  -1.278   1.662
   46   HD21  LEU   6          HD21      LEU   6   4.720   0.957   0.690
   47   HD22  LEU   6          HD22      LEU   6   6.423   0.620   1.073
   48   HD23  LEU   6          HD23      LEU   6   5.652   2.093   1.679
   49    H    THR   7           HN       THR   7   2.085   3.943   2.704
   50    HA   THR   7           HA       THR   7   0.260   3.476   4.933
   51    HB   THR   7           HB       THR   7   0.171   5.594   2.756
   52    HG1  THR   7           HG1      THR   7   1.509   5.401   5.203
   53   HG21  THR   7          HG21      THR   7  -1.972   5.167   3.932
   54   HG22  THR   7          HG22      THR   7  -1.327   6.760   4.321
   55   HG23  THR   7          HG23      THR   7  -1.166   5.439   5.476
   56    H    ILE   8           HN       ILE   8  -1.098   1.830   4.456
   57    HA   ILE   8           HA       ILE   8  -1.781   1.452   1.636
   58    HB   ILE   8           HB       ILE   8  -1.651  -0.649   3.821
   59   HG12  ILE   8          HG12      ILE   8  -0.009  -0.222   1.314
   60   HG13  ILE   8          HG11      ILE   8   0.537   0.017   2.971
   61   HG21  ILE   8          HG21      ILE   8  -3.502  -1.049   2.322
   62   HG22  ILE   8          HG22      ILE   8  -2.264  -2.293   2.116
   63   HG23  ILE   8          HG23      ILE   8  -2.448  -1.024   0.906
   64   HD11  ILE   8          HD11      ILE   8   1.387  -2.061   2.047
   65   HD12  ILE   8          HD12      ILE   8  -0.262  -2.600   1.720
   66   HD13  ILE   8          HD13      ILE   8   0.279  -2.381   3.382
   67    H    TYR   9           HN       TYR   9  -3.748   1.442   0.997
   68    HA   TYR   9           HA       TYR   9  -5.868   2.034   2.892
   69    HB2  TYR   9           HB2      TYR   9  -5.648   2.182  -0.110
   70    HB3  TYR   9           HB1      TYR   9  -7.092   2.657   0.742
   71    HD1  TYR   9           HD1      TYR   9  -7.035   4.713   2.178
   72    HD2  TYR   9           HD2      TYR   9  -3.718   3.572  -0.227
   73    HE1  TYR   9           HE1      TYR   9  -6.082   6.969   2.416
   74    HE2  TYR   9           HE2      TYR   9  -2.767   5.816   0.009
   75    HH   TYR   9           HH       TYR   9  -3.546   8.089   0.495
   76    H    THR  10           HN       THR  10  -6.752   0.168   3.708
   77    HA   THR  10           HA       THR  10  -7.633  -1.839   1.800
   78    HB   THR  10           HB       THR  10  -7.147  -3.509   3.735
   79    HG1  THR  10           HG1      THR  10  -6.274  -2.464   5.403
   80   HG21  THR  10          HG21      THR  10  -6.047  -3.544   1.537
   81   HG22  THR  10          HG22      THR  10  -4.902  -3.938   2.829
   82   HG23  THR  10          HG23      THR  10  -4.905  -2.333   2.102
   83    H    THR  11           HN       THR  11  -9.439  -3.188   2.594
   84    HA   THR  11           HA       THR  11 -10.899  -2.090   4.861
   85    HB   THR  11           HB       THR  11 -13.000  -2.542   3.548
   86    HG1  THR  11           HG1      THR  11 -12.470  -2.363   1.144
   87   HG21  THR  11          HG21      THR  11 -11.225  -0.450   2.285
   88   HG22  THR  11          HG22      THR  11 -12.112  -0.253   3.793
   89   HG23  THR  11          HG23      THR  11 -12.994  -0.497   2.280
   90    H    SER  12           HN       SER  12 -12.707  -3.724   5.354
   91    HA   SER  12           HA       SER  12 -11.601  -6.407   5.379
   92    HB2  SER  12           HB2      SER  12 -12.664  -5.427   7.405
   93    HB3  SER  12           HB1      SER  12 -14.181  -5.289   6.526
   94    HG   SER  12           HG       SER  12 -12.842  -7.591   7.437
   95    H    TRP  13           HN       TRP  13 -13.343  -4.600   3.255
   96    HA   TRP  13           HA       TRP  13 -15.409  -6.418   2.502
   97    HB2  TRP  13           HB2      TRP  13 -14.334  -4.041   0.990
   98    HB3  TRP  13           HB1      TRP  13 -15.826  -4.909   0.653
   99    HD1  TRP  13           HD1      TRP  13 -16.829  -5.052   3.723
  100    HE1  TRP  13           HE1      TRP  13 -17.761  -2.904   4.790
  101    HE3  TRP  13           HE3      TRP  13 -14.724  -1.611   0.611
  102    HZ2  TRP  13           HZ2      TRP  13 -17.631  -0.136   4.372
  103    HZ3  TRP  13           HZ3      TRP  13 -15.178   0.769   1.011
  104    HH2  TRP  13           HH2      TRP  13 -16.604   1.489   2.856
  105    H    CYS  14           HN       CYS  14 -12.142  -5.856   1.466
  106    HA   CYS  14           HA       CYS  14 -12.567  -7.407  -0.945
  107    HB2  CYS  14           HB2      CYS  14 -10.146  -6.784  -1.348
  108    HB3  CYS  14           HB1      CYS  14 -11.305  -5.456  -1.341
  109    H    GLY  15           HN       GLY  15 -10.924  -9.071  -1.496
  110    HA2  GLY  15           HA2      GLY  15 -10.191 -10.608   0.899
  111    HA3  GLY  15           HA1      GLY  15 -10.603 -11.325  -0.652
  112    H    TYR  16           HN       TYR  16  -9.122  -9.665  -2.363
  113    HA   TYR  16           HA       TYR  16  -6.632 -10.926  -2.185
  114    HB2  TYR  16           HB2      TYR  16  -7.508 -10.311  -4.365
  115    HB3  TYR  16           HB1      TYR  16  -7.451  -8.602  -3.950
  116    HD1  TYR  16           HD2      TYR  16  -5.313 -11.582  -4.556
  117    HD2  TYR  16           HD1      TYR  16  -5.498  -7.356  -4.297
  118    HE1  TYR  16           HE2      TYR  16  -3.015 -11.439  -5.416
  119    HE2  TYR  16           HE1      TYR  16  -3.216  -7.174  -5.137
  120    HH   TYR  16           HH       TYR  16  -1.166  -8.562  -5.301
  121    H    CYS  17           HN       CYS  17  -7.686  -7.913  -0.912
  122    HA   CYS  17           HA       CYS  17  -5.265  -6.644  -0.564
  123    HB2  CYS  17           HB2      CYS  17  -6.412  -5.834   1.647
  124    HB3  CYS  17           HB1      CYS  17  -7.020  -5.247   0.107
  125    H    LEU  18           HN       LEU  18  -6.789  -9.195   1.391
  126    HA   LEU  18           HA       LEU  18  -4.783  -9.150   3.419
  127    HB2  LEU  18           HB2      LEU  18  -6.911 -11.177   2.800
  128    HB3  LEU  18           HB1      LEU  18  -5.806 -11.319   4.152
  129    HG   LEU  18           HG       LEU  18  -6.764  -9.027   4.891
  130   HD11  LEU  18          HD11      LEU  18  -9.066  -8.607   4.258
  131   HD12  LEU  18          HD12      LEU  18  -8.980  -9.908   3.070
  132   HD13  LEU  18          HD13      LEU  18  -7.973  -8.472   2.882
  133   HD21  LEU  18          HD21      LEU  18  -7.096 -11.068   6.086
  134   HD22  LEU  18          HD22      LEU  18  -8.428 -11.515   5.014
  135   HD23  LEU  18          HD23      LEU  18  -8.580 -10.115   6.082
  136    H    ARG  19           HN       ARG  19  -5.094 -10.657   0.398
  137    HA   ARG  19           HA       ARG  19  -3.232 -12.794   0.819
  138    HB2  ARG  19           HB2      ARG  19  -3.923 -11.463  -1.808
  139    HB3  ARG  19           HB1      ARG  19  -3.315 -13.094  -1.565
  140    HG2  ARG  19           HG2      ARG  19  -6.017 -12.099  -0.679
  141    HG3  ARG  19           HG1      ARG  19  -5.700 -13.047  -2.136
  142    HD2  ARG  19           HD2      ARG  19  -5.130 -13.941   0.681
  143    HD3  ARG  19           HD1      ARG  19  -6.587 -14.345  -0.222
  144    HE   ARG  19           HE       ARG  19  -4.273 -15.045  -1.679
  145   HH11  ARG  19          HH11      ARG  19  -6.230 -16.095   1.059
  146   HH12  ARG  19          HH12      ARG  19  -5.794 -17.740   0.913
  147   HH21  ARG  19          HH21      ARG  19  -3.712 -17.270  -1.905
  148   HH22  ARG  19          HH22      ARG  19  -4.338 -18.426  -0.796
  149    H    LEU  20           HN       LEU  20  -3.093  -9.479  -0.267
  150    HA   LEU  20           HA       LEU  20  -0.340  -9.556  -0.917
  151    HB2  LEU  20           HB2      LEU  20  -1.788  -7.902  -1.963
  152    HB3  LEU  20           HB1      LEU  20  -2.227  -7.250  -0.406
  153    HG   LEU  20           HG       LEU  20   0.251  -6.562  -0.210
  154   HD11  LEU  20          HD11      LEU  20   1.291  -6.000  -2.389
  155   HD12  LEU  20          HD12      LEU  20   0.187  -7.110  -3.180
  156   HD13  LEU  20          HD13      LEU  20   1.361  -7.695  -1.990
  157   HD21  LEU  20          HD21      LEU  20  -0.176  -4.485  -1.468
  158   HD22  LEU  20          HD22      LEU  20  -1.513  -4.973  -0.428
  159   HD23  LEU  20          HD23      LEU  20  -1.612  -5.245  -2.167
  160    H    LYS  21           HN       LYS  21  -2.284  -8.606   1.841
  161    HA   LYS  21           HA       LYS  21  -0.395  -7.484   3.530
  162    HB2  LYS  21           HB2      LYS  21  -2.845  -9.107   4.155
  163    HB3  LYS  21           HB1      LYS  21  -1.836  -8.393   5.402
  164    HG2  LYS  21           HG2      LYS  21  -2.313  -6.177   4.628
  165    HG3  LYS  21           HG1      LYS  21  -3.144  -6.803   3.206
  166    HD2  LYS  21           HD2      LYS  21  -4.668  -5.999   4.986
  167    HD3  LYS  21           HD1      LYS  21  -4.950  -7.684   4.593
  168    HE2  LYS  21           HE2      LYS  21  -5.030  -7.461   6.971
  169    HE3  LYS  21           HE1      LYS  21  -3.540  -8.286   6.577
  170    HZ1  LYS  21           HZ1      LYS  21  -2.346  -6.186   6.839
  171    HZ2  LYS  21           HZ2      LYS  21  -3.182  -6.623   8.227
  172    HZ3  LYS  21           HZ3      LYS  21  -3.795  -5.399   7.257
  173    H    THR  22           HN       THR  22  -1.233 -10.939   3.166
  174    HA   THR  22           HA       THR  22   0.560 -11.762   5.152
  175    HB   THR  22           HB       THR  22   0.336 -14.028   3.907
  176    HG1  THR  22           HG1      THR  22  -1.997 -13.399   2.804
  177   HG21  THR  22          HG21      THR  22  -1.884 -14.377   4.871
  178   HG22  THR  22          HG22      THR  22  -2.105 -12.630   4.988
  179   HG23  THR  22          HG23      THR  22  -0.870 -13.429   5.962
  180    H    ALA  23           HN       ALA  23   0.890 -11.371   1.681
  181    HA   ALA  23           HA       ALA  23   3.483 -12.462   1.397
  182    HB1  ALA  23           HB1      ALA  23   1.992 -11.945  -0.513
  183    HB2  ALA  23           HB2      ALA  23   3.587 -11.210  -0.687
  184    HB3  ALA  23           HB3      ALA  23   2.212 -10.226  -0.185
  185    H    LEU  24           HN       LEU  24   2.472  -9.121   1.967
  186    HA   LEU  24           HA       LEU  24   5.104  -8.096   2.092
  187    HB2  LEU  24           HB2      LEU  24   2.601  -6.989   3.357
  188    HB3  LEU  24           HB1      LEU  24   4.100  -6.110   3.153
  189    HG   LEU  24           HG       LEU  24   2.279  -7.090   0.966
  190   HD11  LEU  24          HD11      LEU  24   1.954  -4.711   0.504
  191   HD12  LEU  24          HD12      LEU  24   2.949  -4.309   1.901
  192   HD13  LEU  24          HD13      LEU  24   1.415  -5.153   2.123
  193   HD21  LEU  24          HD21      LEU  24   3.766  -5.890  -0.577
  194   HD22  LEU  24          HD22      LEU  24   4.579  -7.237   0.213
  195   HD23  LEU  24          HD23      LEU  24   4.882  -5.583   0.752
  196    H    THR  25           HN       THR  25   2.945  -9.292   4.601
  197    HA   THR  25           HA       THR  25   4.627  -8.574   6.757
  198    HB   THR  25           HB       THR  25   2.458 -10.688   6.627
  199    HG1  THR  25           HG1      THR  25   1.498  -8.823   6.194
  200   HG21  THR  25          HG21      THR  25   2.305 -10.382   9.070
  201   HG22  THR  25          HG22      THR  25   3.667  -9.263   9.017
  202   HG23  THR  25          HG23      THR  25   3.905 -10.962   8.608
  203    H    ALA  26           HN       ALA  26   4.349 -11.524   4.815
  204    HA   ALA  26           HA       ALA  26   6.185 -13.068   6.334
  205    HB1  ALA  26           HB1      ALA  26   6.204 -14.570   4.415
  206    HB2  ALA  26           HB2      ALA  26   5.412 -13.335   3.436
  207    HB3  ALA  26           HB3      ALA  26   4.558 -14.061   4.797
  208    H    ASN  27           HN       ASN  27   6.506 -10.696   3.903
  209    HA   ASN  27           HA       ASN  27   9.320 -11.277   3.550
  210    HB2  ASN  27           HB2      ASN  27   7.327  -9.611   2.144
  211    HB3  ASN  27           HB1      ASN  27   9.055  -9.238   1.883
  212   HD21  ASN  27          HD21      ASN  27   6.412 -11.355   1.274
  213   HD22  ASN  27          HD22      ASN  27   7.208 -12.425   0.184
  214    H    ARG  28           HN       ARG  28   7.751  -9.954   5.875
  215    HA   ARG  28           HA       ARG  28   8.179  -8.585   7.599
  216    HB2  ARG  28           HB2      ARG  28  10.997  -8.575   6.509
  217    HB3  ARG  28           HB1      ARG  28  10.520  -8.027   8.106
  218    HG2  ARG  28           HG2      ARG  28   9.727 -10.316   8.612
  219    HG3  ARG  28           HG1      ARG  28  10.328 -10.836   7.037
  220    HD2  ARG  28           HD2      ARG  28  12.589 -10.054   7.697
  221    HD3  ARG  28           HD1      ARG  28  11.938  -9.665   9.288
  222    HE   ARG  28           HE       ARG  28  11.579 -12.373   8.369
  223   HH11  ARG  28          HH11      ARG  28  13.438 -10.168  10.416
  224   HH12  ARG  28          HH12      ARG  28  14.201 -11.418  11.296
  225   HH21  ARG  28          HH21      ARG  28  12.655 -14.083   9.553
  226   HH22  ARG  28          HH22      ARG  28  13.746 -13.681  10.791
  227    H    ILE  29           HN       ILE  29   7.264  -7.350   5.160
  228    HA   ILE  29           HA       ILE  29   8.604  -4.775   5.125
  229    HB   ILE  29           HB       ILE  29   6.207  -5.771   3.520
  230   HG12  ILE  29          HG12      ILE  29   9.114  -5.468   2.704
  231   HG13  ILE  29          HG11      ILE  29   8.321  -6.996   3.054
  232   HG21  ILE  29          HG21      ILE  29   6.630  -3.826   2.090
  233   HG22  ILE  29          HG22      ILE  29   7.919  -3.306   3.182
  234   HG23  ILE  29          HG23      ILE  29   6.248  -3.340   3.742
  235   HD11  ILE  29          HD11      ILE  29   8.527  -6.611   0.665
  236   HD12  ILE  29          HD12      ILE  29   7.609  -5.112   0.814
  237   HD13  ILE  29          HD13      ILE  29   6.835  -6.659   1.154
  238    H    ALA  30           HN       ALA  30   7.935  -3.101   6.312
  239    HA   ALA  30           HA       ALA  30   5.648  -3.464   8.050
  240    HB1  ALA  30           HB1      ALA  30   6.512  -1.538   9.254
  241    HB2  ALA  30           HB2      ALA  30   7.689  -1.244   7.982
  242    HB3  ALA  30           HB3      ALA  30   7.808  -2.702   8.965
  243    H    TYR  31           HN       TYR  31   3.770  -2.446   7.863
  244    HA   TYR  31           HA       TYR  31   3.538  -0.097   6.183
  245    HB2  TYR  31           HB2      TYR  31   1.666  -1.017   4.897
  246    HB3  TYR  31           HB1      TYR  31   3.109  -1.977   4.643
  247    HD1  TYR  31           HD2      TYR  31   3.232  -4.287   5.475
  248    HD2  TYR  31           HD1      TYR  31  -0.267  -1.929   6.062
  249    HE1  TYR  31           HE2      TYR  31   1.954  -6.312   6.050
  250    HE2  TYR  31           HE1      TYR  31  -1.537  -3.949   6.634
  251    HH   TYR  31           HH       TYR  31  -0.075  -6.875   7.350
  252    H    ASP  32           HN       ASP  32   1.527   1.039   6.555
  253    HA   ASP  32           HA       ASP  32   0.068   0.161   8.940
  254    HB2  ASP  32           HB2      ASP  32   1.633   2.057   9.453
  255    HB3  ASP  32           HB1      ASP  32   0.806   3.021   8.237
  256    H    GLU  33           HN       GLU  33  -2.065  -0.001   8.536
  257    HA   GLU  33           HA       GLU  33  -2.899   0.927   5.924
  258    HB2  GLU  33           HB2      GLU  33  -4.775  -0.657   6.154
  259    HB3  GLU  33           HB1      GLU  33  -3.199  -1.399   6.257
  260    HG2  GLU  33           HG2      GLU  33  -3.419  -1.498   8.705
  261    HG3  GLU  33           HG1      GLU  33  -5.054  -0.842   8.552
  262    H    VAL  34           HN       VAL  34  -4.768   1.997   5.588
  263    HA   VAL  34           HA       VAL  34  -5.330   3.993   7.623
  264    HB   VAL  34           HB       VAL  34  -6.510   3.799   4.832
  265   HG11  VAL  34          HG11      VAL  34  -6.827   6.211   5.014
  266   HG12  VAL  34          HG12      VAL  34  -6.164   6.182   6.649
  267   HG13  VAL  34          HG13      VAL  34  -7.682   5.355   6.301
  268   HG21  VAL  34          HG21      VAL  34  -4.730   5.317   4.117
  269   HG22  VAL  34          HG22      VAL  34  -4.085   3.778   4.685
  270   HG23  VAL  34          HG23      VAL  34  -4.001   5.203   5.719
  271    H    ASP  35           HN       ASP  35  -7.336   4.640   8.276
  272    HA   ASP  35           HA       ASP  35  -8.949   2.554   9.302
  273    HB2  ASP  35           HB2      ASP  35  -9.993   4.302  10.609
  274    HB3  ASP  35           HB1      ASP  35  -8.242   4.448  10.665
  275    H    ILE  36           HN       ILE  36  -9.139   3.795   6.369
  276    HA   ILE  36           HA       ILE  36 -11.476   5.115   5.789
  277    HB   ILE  36           HB       ILE  36 -11.495   4.123   3.549
  278   HG12  ILE  36          HG12      ILE  36  -9.217   2.388   4.470
  279   HG13  ILE  36          HG11      ILE  36 -10.878   1.807   4.359
  280   HG21  ILE  36          HG21      ILE  36  -9.962   5.934   4.026
  281   HG22  ILE  36          HG22      ILE  36  -9.248   4.805   2.880
  282   HG23  ILE  36          HG23      ILE  36  -8.742   4.782   4.569
  283   HD11  ILE  36          HD11      ILE  36  -9.322   2.970   2.093
  284   HD12  ILE  36          HD12      ILE  36 -10.902   2.184   2.004
  285   HD13  ILE  36          HD13      ILE  36  -9.465   1.237   2.411
  286    H    GLU  37           HN       GLU  37 -11.357   1.723   6.664
  287    HA   GLU  37           HA       GLU  37 -13.750   0.698   5.702
  288    HB2  GLU  37           HB2      GLU  37 -12.044  -0.582   6.909
  289    HB3  GLU  37           HB1      GLU  37 -12.395   0.303   8.383
  290    HG2  GLU  37           HG2      GLU  37 -13.317  -1.891   8.471
  291    HG3  GLU  37           HG1      GLU  37 -14.622  -0.710   8.413
  292    H    HIS  38           HN       HIS  38 -13.118   2.785   8.451
  293    HA   HIS  38           HA       HIS  38 -16.013   3.114   8.797
  294    HB2  HIS  38           HB2      HIS  38 -13.843   3.147  10.886
  295    HB3  HIS  38           HB1      HIS  38 -15.481   3.704  11.185
  296    HD1  HIS  38           HD1      HIS  38 -17.362   1.829  11.282
  297    HD2  HIS  38           HD2      HIS  38 -13.477   0.423  10.832
  298    HE1  HIS  38           HE1      HIS  38 -17.446  -0.628  11.802
  299    H    ASN  39           HN       ASN  39 -13.933   4.602   7.177
  300    HA   ASN  39           HA       ASN  39 -14.731   7.243   8.140
  301    HB2  ASN  39           HB2      ASN  39 -12.440   6.945   8.951
  302    HB3  ASN  39           HB1      ASN  39 -11.911   6.616   7.306
  303   HD21  ASN  39          HD21      ASN  39 -10.691   8.303   6.920
  304   HD22  ASN  39          HD22      ASN  39 -11.090   9.954   7.068
  305    H    ARG  40           HN       ARG  40 -15.969   7.803   6.582
  306    HA   ARG  40           HA       ARG  40 -15.619   7.129   3.884
  307    HB2  ARG  40           HB2      ARG  40 -17.424   8.572   3.341
  308    HB3  ARG  40           HB1      ARG  40 -17.811   7.846   4.889
  309    HG2  ARG  40           HG2      ARG  40 -16.759  10.647   4.466
  310    HG3  ARG  40           HG1      ARG  40 -18.448  10.220   4.719
  311    HD2  ARG  40           HD2      ARG  40 -17.943   9.443   6.956
  312    HD3  ARG  40           HD1      ARG  40 -16.220   9.700   6.685
  313    HE   ARG  40           HE       ARG  40 -17.661  12.070   6.235
  314   HH11  ARG  40          HH11      ARG  40 -16.594  10.012   8.962
  315   HH12  ARG  40          HH12      ARG  40 -16.440  11.303  10.035
  316   HH21  ARG  40          HH21      ARG  40 -17.401  13.821   7.750
  317   HH22  ARG  40          HH22      ARG  40 -16.888  13.509   9.343
  318    H    ALA  41           HN       ALA  41 -14.276   9.799   5.748
  319    HA   ALA  41           HA       ALA  41 -13.911  11.437   3.493
  320    HB1  ALA  41           HB1      ALA  41 -14.093  12.371   5.768
  321    HB2  ALA  41           HB2      ALA  41 -12.715  12.985   4.870
  322    HB3  ALA  41           HB3      ALA  41 -12.471  11.795   6.133
  323    H    ALA  42           HN       ALA  42 -11.781   9.163   5.015
  324    HA   ALA  42           HA       ALA  42  -9.717   9.840   3.090
  325    HB1  ALA  42           HB1      ALA  42  -9.015   9.216   5.341
  326    HB2  ALA  42           HB2      ALA  42  -8.390   8.056   4.166
  327    HB3  ALA  42           HB3      ALA  42  -9.789   7.646   5.166
  328    H    ALA  43           HN       ALA  43 -12.371   7.731   3.371
  329    HA   ALA  43           HA       ALA  43 -11.533   5.664   1.634
  330    HB1  ALA  43           HB1      ALA  43 -13.875   5.035   1.561
  331    HB2  ALA  43           HB2      ALA  43 -14.323   6.611   2.225
  332    HB3  ALA  43           HB3      ALA  43 -13.404   5.476   3.212
  333    H    GLU  44           HN       GLU  44 -13.309   8.676   1.136
  334    HA   GLU  44           HA       GLU  44 -13.648   8.256  -1.629
  335    HB2  GLU  44           HB2      GLU  44 -13.793  10.780   0.012
  336    HB3  GLU  44           HB1      GLU  44 -14.209  10.701  -1.694
  337    HG2  GLU  44           HG2      GLU  44 -15.548   9.120   0.499
  338    HG3  GLU  44           HG1      GLU  44 -16.190  10.582  -0.250
  339    H    PHE  45           HN       PHE  45 -10.991   9.370   0.225
  340    HA   PHE  45           HA       PHE  45  -9.568  10.691  -1.852
  341    HB2  PHE  45           HB2      PHE  45  -8.945  10.945   0.544
  342    HB3  PHE  45           HB1      PHE  45  -8.475   9.251   0.591
  343    HD1  PHE  45           HD1      PHE  45  -7.624  12.564  -0.782
  344    HD2  PHE  45           HD2      PHE  45  -6.341   8.541  -0.230
  345    HE1  PHE  45           HE1      PHE  45  -5.349  13.196  -1.473
  346    HE2  PHE  45           HE2      PHE  45  -4.063   9.168  -0.922
  347    HZ   PHE  45           HZ       PHE  45  -3.565  11.498  -1.543
  348    H    VAL  46           HN       VAL  46  -9.940   7.387  -0.831
  349    HA   VAL  46           HA       VAL  46  -7.926   6.149  -2.338
  350    HB   VAL  46           HB       VAL  46 -10.668   5.041  -1.640
  351   HG11  VAL  46          HG11      VAL  46  -9.617   3.717  -3.387
  352   HG12  VAL  46          HG12      VAL  46  -9.645   2.818  -1.870
  353   HG13  VAL  46          HG13      VAL  46  -8.148   3.575  -2.422
  354   HG21  VAL  46          HG21      VAL  46  -9.449   5.747   0.342
  355   HG22  VAL  46          HG22      VAL  46  -8.053   4.796  -0.165
  356   HG23  VAL  46          HG23      VAL  46  -9.560   3.989   0.264
  357    H    GLY  47           HN       GLY  47 -11.210   7.111  -3.170
  358    HA2  GLY  47           HA2      GLY  47 -11.241   5.984  -5.785
  359    HA3  GLY  47           HA1      GLY  47 -12.316   7.245  -5.201
  360    H    SER  48           HN       SER  48 -10.142   9.016  -4.497
  361    HA   SER  48           HA       SER  48  -9.902  10.447  -6.913
  362    HB2  SER  48           HB2      SER  48  -9.941  11.493  -4.650
  363    HB3  SER  48           HB1      SER  48  -8.365  10.789  -4.317
  364    HG   SER  48           HG       SER  48  -7.597  12.046  -6.169
  365    H    VAL  49           HN       VAL  49  -7.863   8.111  -5.302
  366    HA   VAL  49           HA       VAL  49  -5.799   8.532  -7.339
  367    HB   VAL  49           HB       VAL  49  -4.261   7.281  -5.835
  368   HG11  VAL  49          HG11      VAL  49  -4.017   9.007  -4.113
  369   HG12  VAL  49          HG12      VAL  49  -5.611   9.637  -4.529
  370   HG13  VAL  49          HG13      VAL  49  -4.302   9.705  -5.708
  371   HG21  VAL  49          HG21      VAL  49  -6.575   7.336  -3.890
  372   HG22  VAL  49          HG22      VAL  49  -4.930   6.852  -3.490
  373   HG23  VAL  49          HG23      VAL  49  -5.877   5.896  -4.633
  374    H    ASN  50           HN       ASN  50  -8.395   6.968  -7.442
  375    HA   ASN  50           HA       ASN  50  -7.254   4.313  -8.069
  376    HB2  ASN  50           HB2      ASN  50  -9.177   4.793  -6.226
  377    HB3  ASN  50           HB1      ASN  50 -10.172   4.597  -7.667
  378   HD21  ASN  50          HD21      ASN  50  -8.080   3.116  -5.427
  379   HD22  ASN  50          HD22      ASN  50  -8.367   1.479  -5.842
  380    H    GLY  51           HN       GLY  51  -9.182   3.244  -9.589
  381    HA2  GLY  51           HA2      GLY  51  -9.289   5.075 -11.885
  382    HA3  GLY  51           HA1      GLY  51  -9.211   3.315 -11.974
  383    H    GLY  52           HN       GLY  52 -11.246   5.964 -10.868
  384    HA2  GLY  52           HA2      GLY  52 -13.501   6.280 -11.187
  385    HA3  GLY  52           HA1      GLY  52 -13.574   4.741 -12.042
  386    H    ASN  53           HN       ASN  53 -13.976   2.900 -10.940
  387    HA   ASN  53           HA       ASN  53 -15.301   3.230  -8.401
  388    HB2  ASN  53           HB2      ASN  53 -14.846   0.788 -10.129
  389    HB3  ASN  53           HB1      ASN  53 -15.621   0.705  -8.552
  390   HD21  ASN  53          HD21      ASN  53 -15.950   1.642 -11.867
  391   HD22  ASN  53          HD22      ASN  53 -17.637   1.990 -11.793
  392    H    ARG  54           HN       ARG  54 -14.586   2.639  -6.472
  393    HA   ARG  54           HA       ARG  54 -11.813   2.525  -6.121
  394    HB2  ARG  54           HB2      ARG  54 -14.030   2.088  -4.132
  395    HB3  ARG  54           HB1      ARG  54 -12.329   2.067  -3.699
  396    HG2  ARG  54           HG2      ARG  54 -12.162   4.383  -4.629
  397    HG3  ARG  54           HG1      ARG  54 -13.919   4.379  -4.776
  398    HD2  ARG  54           HD2      ARG  54 -12.418   3.877  -2.214
  399    HD3  ARG  54           HD1      ARG  54 -13.044   5.448  -2.686
  400    HE   ARG  54           HE       ARG  54 -15.264   4.256  -2.716
  401   HH11  ARG  54          HH11      ARG  54 -12.659   3.258  -0.537
  402   HH12  ARG  54          HH12      ARG  54 -13.670   2.863   0.774
  403   HH21  ARG  54          HH21      ARG  54 -16.681   3.771  -0.874
  404   HH22  ARG  54          HH22      ARG  54 -16.046   3.139   0.563
  405    H    THR  55           HN       THR  55 -10.799   0.912  -6.953
  406    HA   THR  55           HA       THR  55 -11.329  -1.861  -6.289
  407    HB   THR  55           HB       THR  55  -8.675  -0.763  -7.197
  408    HG1  THR  55           HG1      THR  55 -10.060   0.347  -8.554
  409   HG21  THR  55          HG21      THR  55 -10.315  -3.168  -8.025
  410   HG22  THR  55          HG22      THR  55  -8.987  -3.183  -6.867
  411   HG23  THR  55          HG23      THR  55  -8.677  -2.805  -8.568
  412    H    VAL  56           HN       VAL  56  -9.731  -2.954  -4.615
  413    HA   VAL  56           HA       VAL  56  -9.157  -0.749  -2.914
  414    HB   VAL  56           HB       VAL  56  -8.937  -3.527  -1.805
  415   HG11  VAL  56          HG11      VAL  56  -9.259  -0.821  -0.471
  416   HG12  VAL  56          HG12      VAL  56  -7.711  -1.509  -0.711
  417   HG13  VAL  56          HG13      VAL  56  -8.896  -2.342   0.340
  418   HG21  VAL  56          HG21      VAL  56 -11.206  -3.021  -2.551
  419   HG22  VAL  56          HG22      VAL  56 -11.073  -1.493  -1.623
  420   HG23  VAL  56          HG23      VAL  56 -11.008  -3.055  -0.776
  421    HA   PRO  57           HA       PRO  57  -5.637  -2.403  -1.153
  422    HB2  PRO  57           HB2      PRO  57  -3.601  -3.884  -2.279
  423    HB3  PRO  57           HB1      PRO  57  -4.881  -4.498  -1.241
  424    HG2  PRO  57           HG2      PRO  57  -4.833  -4.438  -4.242
  425    HG3  PRO  57           HG1      PRO  57  -5.339  -5.749  -3.149
  426    HD2  PRO  57           HD2      PRO  57  -7.109  -4.167  -4.361
  427    HD3  PRO  57           HD1      PRO  57  -7.359  -4.793  -2.709
  428    H    THR  58           HN       THR  58  -5.099  -0.304  -1.360
  429    HA   THR  58           HA       THR  58  -3.538   0.614  -3.615
  430    HB   THR  58           HB       THR  58  -4.674   2.703  -2.019
  431    HG1  THR  58           HG1      THR  58  -6.502   0.697  -2.702
  432   HG21  THR  58          HG21      THR  58  -4.268   2.770  -4.502
  433   HG22  THR  58          HG22      THR  58  -5.916   3.201  -4.064
  434   HG23  THR  58          HG23      THR  58  -5.578   1.599  -4.700
  435    H    VAL  59           HN       VAL  59  -1.464   0.671  -3.067
  436    HA   VAL  59           HA       VAL  59  -0.758   1.444  -0.335
  437    HB   VAL  59           HB       VAL  59   0.266  -0.681  -0.952
  438   HG11  VAL  59          HG11      VAL  59   1.241   0.740  -3.360
  439   HG12  VAL  59          HG12      VAL  59   0.128  -0.622  -3.289
  440   HG13  VAL  59          HG13      VAL  59   1.834  -0.844  -2.849
  441   HG21  VAL  59          HG21      VAL  59   2.345   1.505  -1.090
  442   HG22  VAL  59          HG22      VAL  59   2.653  -0.184  -0.686
  443   HG23  VAL  59          HG23      VAL  59   1.678   0.821   0.389
  444    H    LYS  60           HN       LYS  60   0.055   3.371   0.054
  445    HA   LYS  60           HA       LYS  60   0.843   4.999  -2.235
  446    HB2  LYS  60           HB2      LYS  60  -0.998   5.932  -0.932
  447    HB3  LYS  60           HB1      LYS  60  -0.047   5.809   0.546
  448    HG2  LYS  60           HG2      LYS  60   1.477   7.484  -0.321
  449    HG3  LYS  60           HG1      LYS  60   0.566   7.541  -1.829
  450    HD2  LYS  60           HD2      LYS  60  -1.424   8.270  -0.593
  451    HD3  LYS  60           HD1      LYS  60  -0.490   8.238   0.906
  452    HE2  LYS  60           HE2      LYS  60   0.189   9.873  -1.499
  453    HE3  LYS  60           HE1      LYS  60  -0.717  10.497  -0.115
  454    HZ1  LYS  60           HZ1      LYS  60   2.075   9.421   0.004
  455    HZ2  LYS  60           HZ2      LYS  60   1.208  10.064   1.283
  456    HZ3  LYS  60           HZ3      LYS  60   1.659  11.044   0.013
  457    H    PHE  61           HN       PHE  61   2.853   5.560  -2.450
  458    HA   PHE  61           HA       PHE  61   4.763   4.912  -0.323
  459    HB2  PHE  61           HB2      PHE  61   5.229   5.308  -3.299
  460    HB3  PHE  61           HB1      PHE  61   6.458   4.938  -2.095
  461    HD1  PHE  61           HD2      PHE  61   6.697   2.694  -1.159
  462    HD2  PHE  61           HD1      PHE  61   3.647   3.573  -4.023
  463    HE1  PHE  61           HE2      PHE  61   6.341   0.322  -1.512
  464    HE2  PHE  61           HE1      PHE  61   3.304   1.137  -4.354
  465    HZ   PHE  61           HZ       PHE  61   4.638  -0.463  -3.102
  466    H    ALA  62           HN       ALA  62   6.791   6.422  -0.440
  467    HA   ALA  62           HA       ALA  62   5.899   8.927   0.450
  468    HB1  ALA  62           HB1      ALA  62   8.775   8.309  -0.123
  469    HB2  ALA  62           HB2      ALA  62   7.910   7.682   1.278
  470    HB3  ALA  62           HB3      ALA  62   8.107   9.420   1.071
  471    H    ASP  63           HN       ASP  63   6.672   8.062  -2.747
  472    HA   ASP  63           HA       ASP  63   7.391  10.738  -3.615
  473    HB2  ASP  63           HB2      ASP  63   6.522   8.300  -5.181
  474    HB3  ASP  63           HB1      ASP  63   6.772   9.850  -5.945
  475    H    GLY  64           HN       GLY  64   4.578   9.248  -2.632
  476    HA2  GLY  64           HA2      GLY  64   2.468  10.233  -2.526
  477    HA3  GLY  64           HA1      GLY  64   2.905  11.300  -3.860
  478    H    SER  65           HN       SER  65   4.069   8.449  -4.702
  479    HA   SER  65           HA       SER  65   2.227   7.854  -6.731
  480    HB2  SER  65           HB2      SER  65   4.276   6.005  -5.513
  481    HB3  SER  65           HB1      SER  65   3.691   6.019  -7.173
  482    HG   SER  65           HG       SER  65   4.611   8.232  -7.210
  483    H    THR  66           HN       THR  66   0.446   6.504  -6.636
  484    HA   THR  66           HA       THR  66   0.232   4.824  -4.238
  485    HB   THR  66           HB       THR  66  -2.192   5.758  -5.768
  486    HG1  THR  66           HG1      THR  66  -1.290   7.697  -5.298
  487   HG21  THR  66          HG21      THR  66  -1.676   5.194  -2.852
  488   HG22  THR  66          HG22      THR  66  -2.385   4.044  -3.988
  489   HG23  THR  66          HG23      THR  66  -3.250   5.529  -3.568
  490    H    LEU  67           HN       LEU  67  -0.192   2.712  -4.700
  491    HA   LEU  67           HA       LEU  67  -0.602   2.040  -7.526
  492    HB2  LEU  67           HB2      LEU  67   1.265   0.836  -5.538
  493    HB3  LEU  67           HB1      LEU  67   0.535  -0.215  -6.727
  494    HG   LEU  67           HG       LEU  67   1.478   1.195  -8.502
  495   HD11  LEU  67          HD11      LEU  67   2.981   2.638  -6.315
  496   HD12  LEU  67          HD12      LEU  67   1.768   3.300  -7.398
  497   HD13  LEU  67          HD13      LEU  67   3.304   2.740  -8.045
  498   HD21  LEU  67          HD21      LEU  67   2.590  -0.824  -7.918
  499   HD22  LEU  67          HD22      LEU  67   3.444  -0.045  -6.593
  500   HD23  LEU  67          HD23      LEU  67   3.800   0.407  -8.267
  501    H    THR  68           HN       THR  68  -2.412   1.155  -7.942
  502    HA   THR  68           HA       THR  68  -3.949  -0.138  -5.856
  503    HB   THR  68           HB       THR  68  -4.670   0.345  -8.762
  504    HG1  THR  68           HG1      THR  68  -4.372   2.356  -7.995
  505   HG21  THR  68          HG21      THR  68  -6.091  -1.265  -7.563
  506   HG22  THR  68          HG22      THR  68  -6.968   0.220  -7.931
  507   HG23  THR  68          HG23      THR  68  -6.374  -0.069  -6.296
  508    H    ASN  69           HN       ASN  69  -3.578  -2.234  -5.591
  509    HA   ASN  69           HA       ASN  69  -3.236  -4.463  -5.936
  510    HB2  ASN  69           HB2      ASN  69  -5.223  -4.199  -7.444
  511    HB3  ASN  69           HB1      ASN  69  -4.133  -3.922  -8.791
  512   HD21  ASN  69          HD21      ASN  69  -5.630  -6.216  -6.769
  513   HD22  ASN  69          HD22      ASN  69  -5.082  -7.641  -7.551
  514    HA   PRO  70           HA       PRO  70   0.855  -4.003  -8.044
  515    HB2  PRO  70           HB2      PRO  70   2.463  -3.561  -6.020
  516    HB3  PRO  70           HB1      PRO  70   1.388  -2.258  -6.552
  517    HG2  PRO  70           HG2      PRO  70   1.050  -4.162  -4.258
  518    HG3  PRO  70           HG1      PRO  70   0.834  -2.400  -4.274
  519    HD2  PRO  70           HD2      PRO  70  -1.239  -4.216  -4.553
  520    HD3  PRO  70           HD1      PRO  70  -1.252  -2.539  -5.162
  521    H    SER  71           HN       SER  71   3.009  -5.159  -7.077
  522    HA   SER  71           HA       SER  71   2.276  -7.850  -6.184
  523    HB2  SER  71           HB2      SER  71   4.700  -6.986  -7.799
  524    HB3  SER  71           HB1      SER  71   4.148  -8.636  -7.500
  525    HG   SER  71           HG       SER  71   3.497  -7.100  -9.527
  526    H    ALA  72           HN       ALA  72   3.744  -8.739  -4.583
  527    HA   ALA  72           HA       ALA  72   4.557  -6.988  -2.573
  528    HB1  ALA  72           HB1      ALA  72   5.527  -9.809  -3.035
  529    HB2  ALA  72           HB2      ALA  72   4.044  -9.357  -2.192
  530    HB3  ALA  72           HB3      ALA  72   5.612  -8.917  -1.518
  531    H    ASP  73           HN       ASP  73   6.427  -8.502  -5.107
  532    HA   ASP  73           HA       ASP  73   8.981  -7.627  -4.284
  533    HB2  ASP  73           HB2      ASP  73   7.943  -8.469  -6.985
  534    HB3  ASP  73           HB1      ASP  73   9.616  -7.991  -6.729
  535    H    GLU  74           HN       GLU  74   6.556  -6.199  -6.328
  536    HA   GLU  74           HA       GLU  74   8.010  -3.942  -7.186
  537    HB2  GLU  74           HB2      GLU  74   5.074  -4.425  -6.795
  538    HB3  GLU  74           HB1      GLU  74   5.682  -2.849  -7.266
  539    HG2  GLU  74           HG2      GLU  74   6.092  -5.405  -8.782
  540    HG3  GLU  74           HG1      GLU  74   4.946  -4.121  -9.191
  541    H    VAL  75           HN       VAL  75   5.902  -4.504  -4.445
  542    HA   VAL  75           HA       VAL  75   6.008  -1.944  -3.381
  543    HB   VAL  75           HB       VAL  75   5.600  -4.567  -1.902
  544   HG11  VAL  75          HG11      VAL  75   4.945  -1.754  -1.027
  545   HG12  VAL  75          HG12      VAL  75   6.203  -2.785  -0.349
  546   HG13  VAL  75          HG13      VAL  75   4.505  -3.230  -0.168
  547   HG21  VAL  75          HG21      VAL  75   3.214  -4.030  -2.073
  548   HG22  VAL  75          HG22      VAL  75   3.956  -4.203  -3.663
  549   HG23  VAL  75          HG23      VAL  75   3.608  -2.598  -3.023
  550    H    LYS  76           HN       LYS  76   8.105  -4.723  -2.842
  551    HA   LYS  76           HA       LYS  76   9.644  -3.515  -0.793
  552    HB2  LYS  76           HB2      LYS  76   9.427  -6.026  -1.477
  553    HB3  LYS  76           HB1      LYS  76  10.708  -5.665  -2.625
  554    HG2  LYS  76           HG2      LYS  76  10.917  -5.301   0.364
  555    HG3  LYS  76           HG1      LYS  76  11.454  -6.732  -0.499
  556    HD2  LYS  76           HD2      LYS  76  13.098  -5.432  -1.703
  557    HD3  LYS  76           HD1      LYS  76  12.496  -3.940  -0.971
  558    HE2  LYS  76           HE2      LYS  76  14.515  -4.683   0.176
  559    HE3  LYS  76           HE1      LYS  76  13.105  -4.794   1.233
  560    HZ1  LYS  76           HZ1      LYS  76  14.303  -7.069  -0.240
  561    HZ2  LYS  76           HZ2      LYS  76  13.033  -7.152   0.877
  562    HZ3  LYS  76           HZ3      LYS  76  14.579  -6.706   1.380
  563    H    ALA  77           HN       ALA  77  10.041  -3.623  -4.323
  564    HA   ALA  77           HA       ALA  77  12.614  -2.300  -4.265
  565    HB1  ALA  77           HB1      ALA  77  12.408  -2.231  -6.701
  566    HB2  ALA  77           HB2      ALA  77  10.719  -2.714  -6.588
  567    HB3  ALA  77           HB3      ALA  77  11.990  -3.834  -6.100
  568    H    LYS  78           HN       LYS  78   9.300  -1.262  -4.564
  569    HA   LYS  78           HA       LYS  78  10.023   1.461  -5.149
  570    HB2  LYS  78           HB2      LYS  78   7.435   0.259  -4.146
  571    HB3  LYS  78           HB1      LYS  78   7.633   1.938  -4.618
  572    HG2  LYS  78           HG2      LYS  78   8.029  -0.418  -6.458
  573    HG3  LYS  78           HG1      LYS  78   6.549   0.533  -6.343
  574    HD2  LYS  78           HD2      LYS  78   7.762   2.526  -7.042
  575    HD3  LYS  78           HD1      LYS  78   9.264   1.615  -7.105
  576    HE2  LYS  78           HE2      LYS  78   6.820   1.073  -8.789
  577    HE3  LYS  78           HE1      LYS  78   8.234   1.961  -9.332
  578    HZ1  LYS  78           HZ1      LYS  78   8.012  -0.960  -8.766
  579    HZ2  LYS  78           HZ2      LYS  78   9.502  -0.150  -8.760
  580    HZ3  LYS  78           HZ3      LYS  78   8.567  -0.143 -10.138
  581    H    LEU  79           HN       LEU  79   9.476  -0.478  -2.336
  582    HA   LEU  79           HA       LEU  79   9.231   1.443  -0.375
  583    HB2  LEU  79           HB2      LEU  79   8.993  -1.063  -0.045
  584    HB3  LEU  79           HB1      LEU  79  10.721  -1.170  -0.191
  585    HG   LEU  79           HG       LEU  79  10.850   0.340   1.821
  586   HD11  LEU  79          HD11      LEU  79   8.965   0.219   3.364
  587   HD12  LEU  79          HD12      LEU  79   7.979  -0.480   2.086
  588   HD13  LEU  79          HD13      LEU  79   8.568   1.168   1.936
  589   HD21  LEU  79          HD21      LEU  79  11.432  -2.004   1.887
  590   HD22  LEU  79          HD22      LEU  79   9.736  -2.445   2.082
  591   HD23  LEU  79          HD23      LEU  79  10.571  -1.560   3.359
  592    H    VAL  80           HN       VAL  80  12.111  -0.149  -1.630
  593    HA   VAL  80           HA       VAL  80  13.916   1.151   0.046
  594    HB   VAL  80           HB       VAL  80  15.729   0.379  -1.506
  595   HG11  VAL  80          HG11      VAL  80  14.929  -1.079   0.234
  596   HG12  VAL  80          HG12      VAL  80  15.348  -1.991  -1.218
  597   HG13  VAL  80          HG13      VAL  80  13.655  -1.673  -0.834
  598   HG21  VAL  80          HG21      VAL  80  13.407  -0.528  -3.144
  599   HG22  VAL  80          HG22      VAL  80  15.060  -1.099  -3.366
  600   HG23  VAL  80          HG23      VAL  80  14.668   0.604  -3.634
  601    H    LYS  81           HN       LYS  81  12.760   2.148  -3.144
  602    HA   LYS  81           HA       LYS  81  14.660   4.277  -3.280
  603    HB2  LYS  81           HB2      LYS  81  13.493   5.082  -5.228
  604    HB3  LYS  81           HB1      LYS  81  13.581   3.332  -5.331
  605    HG2  LYS  81           HG2      LYS  81  11.280   3.118  -4.683
  606    HG3  LYS  81           HG1      LYS  81  11.180   4.840  -4.344
  607    HD2  LYS  81           HD2      LYS  81  11.597   3.580  -7.056
  608    HD3  LYS  81           HD1      LYS  81  10.105   4.311  -6.468
  609    HE2  LYS  81           HE2      LYS  81  12.724   5.707  -7.071
  610    HE3  LYS  81           HE1      LYS  81  11.193   5.885  -7.909
  611    HZ1  LYS  81           HZ1      LYS  81  11.566   7.741  -6.498
  612    HZ2  LYS  81           HZ2      LYS  81  11.819   6.822  -5.153
  613    HZ3  LYS  81           HZ3      LYS  81  10.272   6.927  -5.815
  614    H    ILE  82           HN       ILE  82  11.427   3.942  -1.960
  615    HA   ILE  82           HA       ILE  82  11.261   6.783  -1.637
  616    HB   ILE  82           HB       ILE  82   9.022   6.514  -0.706
  617   HG12  ILE  82          HG12      ILE  82   7.946   4.178  -0.897
  618   HG13  ILE  82          HG11      ILE  82   9.580   3.537  -0.878
  619   HG21  ILE  82          HG21      ILE  82   9.349   4.841  -3.175
  620   HG22  ILE  82          HG22      ILE  82   9.482   6.587  -3.116
  621   HG23  ILE  82          HG23      ILE  82   7.948   5.832  -2.736
  622   HD11  ILE  82          HD11      ILE  82   8.243   5.121   1.315
  623   HD12  ILE  82          HD12      ILE  82   9.893   4.507   1.362
  624   HD13  ILE  82          HD13      ILE  82   8.535   3.381   1.308
  625    H    ALA  83           HN       ALA  83  12.564   4.311   0.070
  626    HA   ALA  83           HA       ALA  83  12.402   5.514   2.654
  627    HB1  ALA  83           HB1      ALA  83  14.087   3.843   3.275
  628    HB2  ALA  83           HB2      ALA  83  14.301   3.431   1.573
  629    HB3  ALA  83           HB3      ALA  83  12.765   3.101   2.372
  630    H    GLY  84           HN       GLY  84  13.975   6.270  -0.166
  631    HA2  GLY  84           HA2      GLY  84  15.306   8.079  -0.615
  632    HA3  GLY  84           HA1      GLY  84  15.531   8.325   1.115
  633    H    LEU  85           HN       LEU  85  16.825   6.639   2.157
  634    HA   LEU  85           HA       LEU  85  19.315   6.352   0.667
  635    HB2  LEU  85           HB2      LEU  85  18.711   5.970   3.598
  636    HB3  LEU  85           HB1      LEU  85  20.306   5.945   2.873
  637    HG   LEU  85           HG       LEU  85  18.476   8.348   2.934
  638   HD11  LEU  85          HD11      LEU  85  20.912   7.708   4.574
  639   HD12  LEU  85          HD12      LEU  85  19.249   7.808   5.152
  640   HD13  LEU  85          HD13      LEU  85  20.065   9.253   4.556
  641   HD21  LEU  85          HD21      LEU  85  20.477   9.581   2.192
  642   HD22  LEU  85          HD22      LEU  85  19.955   8.390   1.008
  643   HD23  LEU  85          HD23      LEU  85  21.347   8.054   2.037
  644    H    GLU  86           HN       GLU  86  16.783   4.645   0.648
  645    HA   GLU  86           HA       GLU  86  16.153   2.548   0.204
  646    HB2  GLU  86           HB2      GLU  86  19.102   2.076  -0.180
  647    HB3  GLU  86           HB1      GLU  86  17.848   0.938  -0.622
  648    HG2  GLU  86           HG2      GLU  86  16.978   2.513  -2.251
  649    HG3  GLU  86           HG1      GLU  86  18.193   3.698  -1.762
  650    H    HIS  87           HN       HIS  87  19.167   1.693   1.654
  651    HA   HIS  87           HA       HIS  87  18.755   0.720   4.109
  652    HB2  HIS  87           HB2      HIS  87  16.789  -0.610   2.952
  653    HB3  HIS  87           HB1      HIS  87  18.058  -1.549   2.187
  654    HD1  HIS  87           HD1      HIS  87  15.762  -2.038   4.732
  655    HD2  HIS  87           HD2      HIS  87  19.904  -2.402   4.637
  656    HE1  HIS  87           HE1      HIS  87  16.362  -3.626   6.566
  657    H    HIS  88           HN       HIS  88  19.728   0.336   0.868
  658    HA   HIS  88           HA       HIS  88  22.104  -1.191   1.277
  659    HB2  HIS  88           HB2      HIS  88  21.257   0.511  -1.097
  660    HB3  HIS  88           HB1      HIS  88  22.554  -0.675  -1.090
  661    HD1  HIS  88           HD1      HIS  88  19.255  -0.400  -2.364
  662    HD2  HIS  88           HD2      HIS  88  21.285  -3.350  -0.217
  663    HE1  HIS  88           HE1      HIS  88  17.969  -2.521  -2.688
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1   0.083   9.951  14.487
    2    H2   MET   1           HT2      MET   1   1.640   9.408  14.764
    3    H3   MET   1           HT3      MET   1   0.755  10.107  16.013
    4    HA   MET   1           HA       MET   1   0.853   7.695  16.188
    5    HB2  MET   1           HB2      MET   1  -1.052   8.855  17.165
    6    HB3  MET   1           HB1      MET   1  -1.885   8.848  15.618
    7    HG2  MET   1           HG2      MET   1  -2.039   6.462  15.656
    8    HG3  MET   1           HG1      MET   1  -1.122   6.379  17.162
    9    HE1  MET   1           HE1      MET   1  -3.033   4.820  18.141
   10    HE2  MET   1           HE2      MET   1  -3.905   4.954  16.616
   11    HE3  MET   1           HE3      MET   1  -4.743   5.249  18.138
   12    H    VAL   2           HN       VAL   2   1.307   5.990  15.052
   13    HA   VAL   2           HA       VAL   2   1.366   4.393  13.470
   14    HB   VAL   2           HB       VAL   2  -1.318   5.456  12.513
   15   HG11  VAL   2          HG11      VAL   2  -1.627   3.231  11.513
   16   HG12  VAL   2          HG12      VAL   2   0.000   2.783  12.035
   17   HG13  VAL   2          HG13      VAL   2  -0.218   4.061  10.848
   18   HG21  VAL   2          HG21      VAL   2  -1.393   4.762  14.867
   19   HG22  VAL   2          HG22      VAL   2  -0.746   3.188  14.412
   20   HG23  VAL   2          HG23      VAL   2  -2.336   3.689  13.836
   21    H    THR   3           HN       THR   3   3.143   5.159  12.382
   22    HA   THR   3           HA       THR   3   2.502   6.444   9.853
   23    HB   THR   3           HB       THR   3   4.818   7.225  11.640
   24    HG1  THR   3           HG1      THR   3   2.216   8.058  11.435
   25   HG21  THR   3          HG21      THR   3   3.789   8.402   9.047
   26   HG22  THR   3          HG22      THR   3   5.253   7.437   9.223
   27   HG23  THR   3          HG23      THR   3   5.146   9.015   9.991
   28    H    ALA   4           HN       ALA   4   3.288   5.268   8.235
   29    HA   ALA   4           HA       ALA   4   5.752   3.796   8.672
   30    HB1  ALA   4           HB1      ALA   4   3.338   2.887   7.097
   31    HB2  ALA   4           HB2      ALA   4   3.894   2.208   8.623
   32    HB3  ALA   4           HB3      ALA   4   4.879   2.037   7.168
   33    H    ALA   5           HN       ALA   5   6.656   3.258   6.374
   34    HA   ALA   5           HA       ALA   5   6.627   5.731   4.843
   35    HB1  ALA   5           HB1      ALA   5   8.797   4.712   5.419
   36    HB2  ALA   5           HB2      ALA   5   8.556   4.781   3.673
   37    HB3  ALA   5           HB3      ALA   5   8.341   3.258   4.528
   38    H    LEU   6           HN       LEU   6   4.774   3.119   4.942
   39    HA   LEU   6           HA       LEU   6   4.128   3.223   2.110
   40    HB2  LEU   6           HB2      LEU   6   5.664   1.233   2.791
   41    HB3  LEU   6           HB1      LEU   6   4.222   0.629   3.594
   42    HG   LEU   6           HG       LEU   6   3.064   0.797   1.393
   43   HD11  LEU   6          HD11      LEU   6   5.889   1.187   0.473
   44   HD12  LEU   6          HD12      LEU   6   4.555   2.333   0.307
   45   HD13  LEU   6          HD13      LEU   6   4.526   0.805  -0.572
   46   HD21  LEU   6          HD21      LEU   6   3.809  -1.332   2.289
   47   HD22  LEU   6          HD22      LEU   6   5.425  -1.048   1.640
   48   HD23  LEU   6          HD23      LEU   6   4.059  -1.267   0.545
   49    H    THR   7           HN       THR   7   2.033   3.847   2.210
   50    HA   THR   7           HA       THR   7   0.425   2.855   4.437
   51    HB   THR   7           HB       THR   7  -0.091   5.221   2.615
   52    HG1  THR   7           HG1      THR   7   1.031   4.864   5.161
   53   HG21  THR   7          HG21      THR   7  -2.128   4.267   3.613
   54   HG22  THR   7          HG22      THR   7  -1.746   5.834   4.330
   55   HG23  THR   7          HG23      THR   7  -1.378   4.350   5.205
   56    H    ILE   8           HN       ILE   8  -1.187   1.492   4.033
   57    HA   ILE   8           HA       ILE   8  -1.914   1.000   1.231
   58    HB   ILE   8           HB       ILE   8  -1.600  -1.004   3.482
   59   HG12  ILE   8          HG12      ILE   8  -0.201  -0.734   0.823
   60   HG13  ILE   8          HG11      ILE   8   0.482  -0.315   2.390
   61   HG21  ILE   8          HG21      ILE   8  -2.292  -2.747   1.879
   62   HG22  ILE   8          HG22      ILE   8  -2.673  -1.503   0.686
   63   HG23  ILE   8          HG23      ILE   8  -3.569  -1.577   2.208
   64   HD11  ILE   8          HD11      ILE   8  -0.339  -3.059   1.492
   65   HD12  ILE   8          HD12      ILE   8   0.381  -2.640   3.054
   66   HD13  ILE   8          HD13      ILE   8   1.305  -2.430   1.568
   67    H    TYR   9           HN       TYR   9  -3.984   0.945   0.767
   68    HA   TYR   9           HA       TYR   9  -5.857   1.610   2.843
   69    HB2  TYR   9           HB2      TYR   9  -5.980   1.536  -0.163
   70    HB3  TYR   9           HB1      TYR   9  -7.399   1.899   0.792
   71    HD1  TYR   9           HD2      TYR   9  -4.151   3.128  -0.378
   72    HD2  TYR   9           HD1      TYR   9  -7.516   4.018   2.057
   73    HE1  TYR   9           HE2      TYR   9  -3.442   5.479  -0.263
   74    HE2  TYR   9           HE1      TYR   9  -6.820   6.369   2.176
   75    HH   TYR   9           HH       TYR   9  -4.851   7.708   1.929
   76    H    THR  10           HN       THR  10  -7.296   0.167   3.761
   77    HA   THR  10           HA       THR  10  -7.601  -2.468   2.513
   78    HB   THR  10           HB       THR  10  -7.518  -3.338   4.906
   79    HG1  THR  10           HG1      THR  10  -7.594  -1.579   6.128
   80   HG21  THR  10          HG21      THR  10  -5.690  -3.728   3.295
   81   HG22  THR  10          HG22      THR  10  -5.055  -3.468   4.923
   82   HG23  THR  10          HG23      THR  10  -4.986  -2.171   3.728
   83    H    THR  11           HN       THR  11  -9.552  -3.567   3.068
   84    HA   THR  11           HA       THR  11 -11.521  -2.206   4.732
   85    HB   THR  11           HB       THR  11 -13.276  -2.991   3.031
   86    HG1  THR  11           HG1      THR  11 -11.211  -2.660   1.178
   87   HG21  THR  11          HG21      THR  11 -11.529  -0.633   2.302
   88   HG22  THR  11          HG22      THR  11 -12.900  -0.634   3.427
   89   HG23  THR  11          HG23      THR  11 -13.170  -0.927   1.713
   90    H    SER  12           HN       SER  12 -13.298  -3.712   5.302
   91    HA   SER  12           HA       SER  12 -12.279  -6.275   5.996
   92    HB2  SER  12           HB2      SER  12 -15.112  -5.269   6.216
   93    HB3  SER  12           HB1      SER  12 -14.286  -6.429   7.256
   94    HG   SER  12           HG       SER  12 -13.256  -4.827   8.276
   95    H    TRP  13           HN       TRP  13 -13.700  -5.063   3.190
   96    HA   TRP  13           HA       TRP  13 -15.338  -7.379   2.536
   97    HB2  TRP  13           HB2      TRP  13 -14.583  -5.229   0.582
   98    HB3  TRP  13           HB1      TRP  13 -16.017  -6.235   0.619
   99    HD1  TRP  13           HD1      TRP  13 -16.985  -5.566   3.583
  100    HE1  TRP  13           HE1      TRP  13 -17.908  -3.243   4.087
  101    HE3  TRP  13           HE3      TRP  13 -14.901  -3.038  -0.327
  102    HZ2  TRP  13           HZ2      TRP  13 -17.793  -0.640   2.935
  103    HZ3  TRP  13           HZ3      TRP  13 -15.364  -0.634  -0.557
  104    HH2  TRP  13           HH2      TRP  13 -16.778   0.533   1.045
  105    H    CYS  14           HN       CYS  14 -12.179  -6.196   2.042
  106    HA   CYS  14           HA       CYS  14 -11.822  -7.492  -0.523
  107    HB2  CYS  14           HB2      CYS  14 -11.182  -5.197  -0.282
  108    HB3  CYS  14           HB1      CYS  14 -10.122  -5.599   1.061
  109    H    GLY  15           HN       GLY  15 -11.073  -9.544  -0.596
  110    HA2  GLY  15           HA2      GLY  15  -9.446 -10.556   1.580
  111    HA3  GLY  15           HA1      GLY  15 -10.117 -11.478   0.241
  112    H    TYR  16           HN       TYR  16  -9.200  -9.650  -1.788
  113    HA   TYR  16           HA       TYR  16  -6.624 -10.732  -2.116
  114    HB2  TYR  16           HB2      TYR  16  -6.474  -9.568  -4.263
  115    HB3  TYR  16           HB1      TYR  16  -8.010 -10.377  -4.085
  116    HD1  TYR  16           HD2      TYR  16 -10.004  -8.780  -3.307
  117    HD2  TYR  16           HD1      TYR  16  -6.394  -7.406  -5.086
  118    HE1  TYR  16           HE2      TYR  16 -11.139  -6.712  -4.033
  119    HE2  TYR  16           HE1      TYR  16  -7.503  -5.397  -5.824
  120    HH   TYR  16           HH       TYR  16  -9.736  -4.605  -6.300
  121    H    CYS  17           HN       CYS  17  -7.629  -7.891  -0.626
  122    HA   CYS  17           HA       CYS  17  -5.261  -6.413  -0.757
  123    HB2  CYS  17           HB2      CYS  17  -7.378  -6.527   1.398
  124    HB3  CYS  17           HB1      CYS  17  -6.092  -5.323   1.342
  125    H    LEU  18           HN       LEU  18  -6.473  -8.994   1.318
  126    HA   LEU  18           HA       LEU  18  -4.467  -8.908   3.315
  127    HB2  LEU  18           HB2      LEU  18  -6.754  -9.812   3.639
  128    HB3  LEU  18           HB1      LEU  18  -6.386 -11.115   2.542
  129    HG   LEU  18           HG       LEU  18  -4.791 -10.794   5.079
  130   HD11  LEU  18          HD11      LEU  18  -6.406 -12.250   6.188
  131   HD12  LEU  18          HD12      LEU  18  -7.446 -12.188   4.759
  132   HD13  LEU  18          HD13      LEU  18  -7.138 -10.722   5.696
  133   HD21  LEU  18          HD21      LEU  18  -4.041 -12.428   3.392
  134   HD22  LEU  18          HD22      LEU  18  -5.628 -13.201   3.452
  135   HD23  LEU  18          HD23      LEU  18  -4.584 -13.214   4.874
  136    H    ARG  19           HN       ARG  19  -4.818 -10.471   0.252
  137    HA   ARG  19           HA       ARG  19  -2.745 -12.363   0.355
  138    HB2  ARG  19           HB2      ARG  19  -4.417 -12.245  -1.440
  139    HB3  ARG  19           HB1      ARG  19  -3.736 -10.719  -1.976
  140    HG2  ARG  19           HG2      ARG  19  -1.599 -11.917  -2.442
  141    HG3  ARG  19           HG1      ARG  19  -2.434 -13.429  -2.074
  142    HD2  ARG  19           HD2      ARG  19  -3.162 -11.452  -4.220
  143    HD3  ARG  19           HD1      ARG  19  -2.433 -13.040  -4.468
  144    HE   ARG  19           HE       ARG  19  -4.553 -13.840  -3.293
  145   HH11  ARG  19          HH11      ARG  19  -4.408 -11.123  -5.554
  146   HH12  ARG  19          HH12      ARG  19  -6.028 -11.242  -6.037
  147   HH21  ARG  19          HH21      ARG  19  -6.801 -14.000  -3.937
  148   HH22  ARG  19          HH22      ARG  19  -7.428 -12.913  -5.102
  149    H    LEU  20           HN       LEU  20  -2.776  -8.939  -0.473
  150    HA   LEU  20           HA       LEU  20  -0.039  -8.910  -1.161
  151    HB2  LEU  20           HB2      LEU  20  -1.570  -7.285  -2.137
  152    HB3  LEU  20           HB1      LEU  20  -1.973  -6.671  -0.557
  153    HG   LEU  20           HG       LEU  20   0.514  -5.967  -0.436
  154   HD11  LEU  20          HD11      LEU  20   1.527  -7.024  -2.353
  155   HD12  LEU  20          HD12      LEU  20   1.441  -5.305  -2.654
  156   HD13  LEU  20          HD13      LEU  20   0.273  -6.365  -3.405
  157   HD21  LEU  20          HD21      LEU  20  -1.458  -4.591  -2.248
  158   HD22  LEU  20          HD22      LEU  20  -0.015  -3.838  -1.573
  159   HD23  LEU  20          HD23      LEU  20  -1.306  -4.393  -0.504
  160    H    LYS  21           HN       LYS  21  -1.943  -8.072   1.665
  161    HA   LYS  21           HA       LYS  21  -0.008  -6.902   3.283
  162    HB2  LYS  21           HB2      LYS  21  -2.373  -8.595   4.048
  163    HB3  LYS  21           HB1      LYS  21  -1.343  -7.780   5.213
  164    HG2  LYS  21           HG2      LYS  21  -1.923  -5.621   4.155
  165    HG3  LYS  21           HG1      LYS  21  -3.024  -6.479   3.079
  166    HD2  LYS  21           HD2      LYS  21  -4.194  -5.469   5.010
  167    HD3  LYS  21           HD1      LYS  21  -4.347  -7.226   4.981
  168    HE2  LYS  21           HE2      LYS  21  -2.647  -7.451   6.688
  169    HE3  LYS  21           HE1      LYS  21  -2.318  -5.722   6.644
  170    HZ1  LYS  21           HZ1      LYS  21  -3.706  -6.536   8.500
  171    HZ2  LYS  21           HZ2      LYS  21  -4.979  -6.807   7.401
  172    HZ3  LYS  21           HZ3      LYS  21  -4.332  -5.254   7.641
  173    H    THR  22           HN       THR  22  -0.895 -10.345   3.126
  174    HA   THR  22           HA       THR  22   0.954 -11.217   5.027
  175    HB   THR  22           HB       THR  22   0.650 -13.461   3.779
  176    HG1  THR  22           HG1      THR  22  -1.574 -12.248   2.566
  177   HG21  THR  22          HG21      THR  22  -0.617 -12.856   5.797
  178   HG22  THR  22          HG22      THR  22  -1.638 -13.718   4.646
  179   HG23  THR  22          HG23      THR  22  -1.771 -11.966   4.803
  180    H    ALA  23           HN       ALA  23   1.150 -10.917   1.554
  181    HA   ALA  23           HA       ALA  23   3.720 -11.981   1.102
  182    HB1  ALA  23           HB1      ALA  23   2.089 -11.488  -0.680
  183    HB2  ALA  23           HB2      ALA  23   3.657 -10.735  -0.980
  184    HB3  ALA  23           HB3      ALA  23   2.312  -9.764  -0.381
  185    H    LEU  24           HN       LEU  24   2.748  -8.634   1.712
  186    HA   LEU  24           HA       LEU  24   5.404  -7.685   1.595
  187    HB2  LEU  24           HB2      LEU  24   3.015  -6.415   2.917
  188    HB3  LEU  24           HB1      LEU  24   4.514  -5.596   2.564
  189    HG   LEU  24           HG       LEU  24   2.463  -6.602   0.613
  190   HD11  LEU  24          HD11      LEU  24   3.531  -3.867   1.227
  191   HD12  LEU  24          HD12      LEU  24   1.941  -4.502   1.648
  192   HD13  LEU  24          HD13      LEU  24   2.379  -4.253  -0.045
  193   HD21  LEU  24          HD21      LEU  24   3.883  -5.776  -1.180
  194   HD22  LEU  24          HD22      LEU  24   4.706  -7.063  -0.295
  195   HD23  LEU  24          HD23      LEU  24   5.136  -5.370  -0.014
  196    H    THR  25           HN       THR  25   3.418  -8.822   4.247
  197    HA   THR  25           HA       THR  25   5.188  -7.983   6.292
  198    HB   THR  25           HB       THR  25   3.269 -10.336   6.424
  199    HG1  THR  25           HG1      THR  25   2.164  -8.441   5.782
  200   HG21  THR  25          HG21      THR  25   3.211  -9.787   8.829
  201   HG22  THR  25          HG22      THR  25   4.398  -8.514   8.560
  202   HG23  THR  25          HG23      THR  25   4.841 -10.200   8.296
  203    H    ALA  26           HN       ALA  26   4.900 -11.018   4.448
  204    HA   ALA  26           HA       ALA  26   6.991 -12.340   5.868
  205    HB1  ALA  26           HB1      ALA  26   5.766 -13.015   3.196
  206    HB2  ALA  26           HB2      ALA  26   5.163 -13.552   4.761
  207    HB3  ALA  26           HB3      ALA  26   6.746 -14.088   4.198
  208    H    ASN  27           HN       ASN  27   7.068  -9.903   3.638
  209    HA   ASN  27           HA       ASN  27   9.741 -10.617   2.633
  210    HB2  ASN  27           HB2      ASN  27   7.516  -8.978   1.537
  211    HB3  ASN  27           HB1      ASN  27   9.165  -8.478   1.125
  212   HD21  ASN  27          HD21      ASN  27   6.686 -10.852   0.763
  213   HD22  ASN  27          HD22      ASN  27   7.404 -11.727  -0.538
  214    H    ARG  28           HN       ARG  28   8.577  -9.251   5.161
  215    HA   ARG  28           HA       ARG  28   8.991  -7.680   6.631
  216    HB2  ARG  28           HB2      ARG  28  11.265  -8.711   6.684
  217    HB3  ARG  28           HB1      ARG  28  11.803  -7.518   5.505
  218    HG2  ARG  28           HG2      ARG  28  11.147  -5.717   7.094
  219    HG3  ARG  28           HG1      ARG  28  10.786  -6.955   8.285
  220    HD2  ARG  28           HD2      ARG  28  13.120  -7.652   8.270
  221    HD3  ARG  28           HD1      ARG  28  13.477  -6.452   7.023
  222    HE   ARG  28           HE       ARG  28  12.242  -5.410   9.410
  223   HH11  ARG  28          HH11      ARG  28  15.323  -6.032   7.801
  224   HH12  ARG  28          HH12      ARG  28  16.170  -4.863   8.711
  225   HH21  ARG  28          HH21      ARG  28  13.434  -3.824  10.654
  226   HH22  ARG  28          HH22      ARG  28  15.090  -3.584  10.339
  227    H    ILE  29           HN       ILE  29   7.486  -6.562   5.192
  228    HA   ILE  29           HA       ILE  29   8.623  -3.933   4.625
  229    HB   ILE  29           HB       ILE  29   6.276  -5.305   3.313
  230   HG12  ILE  29          HG12      ILE  29   8.949  -4.413   2.189
  231   HG13  ILE  29          HG11      ILE  29   8.472  -6.066   2.533
  232   HG21  ILE  29          HG21      ILE  29   5.785  -2.956   3.625
  233   HG22  ILE  29          HG22      ILE  29   6.117  -3.255   1.914
  234   HG23  ILE  29          HG23      ILE  29   7.343  -2.506   2.946
  235   HD11  ILE  29          HD11      ILE  29   8.360  -5.505   0.155
  236   HD12  ILE  29          HD12      ILE  29   7.131  -4.287   0.518
  237   HD13  ILE  29          HD13      ILE  29   6.811  -5.997   0.832
  238    H    ALA  30           HN       ALA  30   8.040  -2.546   6.107
  239    HA   ALA  30           HA       ALA  30   5.744  -3.080   7.768
  240    HB1  ALA  30           HB1      ALA  30   6.542  -1.176   9.080
  241    HB2  ALA  30           HB2      ALA  30   7.778  -0.869   7.857
  242    HB3  ALA  30           HB3      ALA  30   7.826  -2.359   8.806
  243    H    TYR  31           HN       TYR  31   3.838  -2.252   7.376
  244    HA   TYR  31           HA       TYR  31   3.613   0.193   5.789
  245    HB2  TYR  31           HB2      TYR  31   1.722  -0.857   4.522
  246    HB3  TYR  31           HB1      TYR  31   3.281  -1.611   4.206
  247    HD1  TYR  31           HD1      TYR  31   0.041  -2.059   5.949
  248    HD2  TYR  31           HD2      TYR  31   3.666  -3.907   4.716
  249    HE1  TYR  31           HE1      TYR  31  -0.879  -4.245   6.544
  250    HE2  TYR  31           HE2      TYR  31   2.748  -6.107   5.309
  251    HH   TYR  31           HH       TYR  31   1.066  -6.988   6.828
  252    H    ASP  32           HN       ASP  32   1.611   1.303   6.127
  253    HA   ASP  32           HA       ASP  32   0.195   0.380   8.511
  254    HB2  ASP  32           HB2      ASP  32  -0.257   2.636   9.196
  255    HB3  ASP  32           HB1      ASP  32   1.464   2.559   8.862
  256    H    GLU  33           HN       GLU  33  -1.916   0.132   8.359
  257    HA   GLU  33           HA       GLU  33  -3.060   0.545   5.715
  258    HB2  GLU  33           HB2      GLU  33  -4.885  -0.971   6.515
  259    HB3  GLU  33           HB1      GLU  33  -3.293  -1.702   6.424
  260    HG2  GLU  33           HG2      GLU  33  -3.037  -1.546   8.803
  261    HG3  GLU  33           HG1      GLU  33  -4.566  -0.675   8.940
  262    H    VAL  34           HN       VAL  34  -5.148   1.422   5.481
  263    HA   VAL  34           HA       VAL  34  -5.438   3.665   7.318
  264    HB   VAL  34           HB       VAL  34  -6.768   3.407   4.610
  265   HG11  VAL  34          HG11      VAL  34  -6.219   5.845   6.292
  266   HG12  VAL  34          HG12      VAL  34  -7.787   5.076   6.065
  267   HG13  VAL  34          HG13      VAL  34  -6.970   5.827   4.694
  268   HG21  VAL  34          HG21      VAL  34  -4.942   4.800   3.752
  269   HG22  VAL  34          HG22      VAL  34  -4.360   3.246   4.357
  270   HG23  VAL  34          HG23      VAL  34  -4.147   4.700   5.326
  271    H    ASP  35           HN       ASP  35  -7.223   4.330   8.209
  272    HA   ASP  35           HA       ASP  35  -9.070   2.573   9.356
  273    HB2  ASP  35           HB2      ASP  35  -8.173   4.660  10.359
  274    HB3  ASP  35           HB1      ASP  35  -9.155   5.593   9.247
  275    H    ILE  36           HN       ILE  36  -9.252   3.513   6.237
  276    HA   ILE  36           HA       ILE  36 -11.665   4.748   5.669
  277    HB   ILE  36           HB       ILE  36 -11.723   3.763   3.459
  278   HG12  ILE  36          HG12      ILE  36  -9.332   2.113   4.175
  279   HG13  ILE  36          HG11      ILE  36 -10.972   1.472   4.284
  280   HG21  ILE  36          HG21      ILE  36 -10.241   5.603   3.817
  281   HG22  ILE  36          HG22      ILE  36  -9.527   4.476   2.669
  282   HG23  ILE  36          HG23      ILE  36  -8.953   4.518   4.340
  283   HD11  ILE  36          HD11      ILE  36 -11.317   1.833   1.952
  284   HD12  ILE  36          HD12      ILE  36  -9.830   0.911   2.165
  285   HD13  ILE  36          HD13      ILE  36  -9.782   2.661   1.816
  286    H    GLU  37           HN       GLU  37 -11.434   1.515   6.811
  287    HA   GLU  37           HA       GLU  37 -13.810   0.469   5.833
  288    HB2  GLU  37           HB2      GLU  37 -13.769  -1.027   7.788
  289    HB3  GLU  37           HB1      GLU  37 -12.199  -0.869   7.004
  290    HG2  GLU  37           HG2      GLU  37 -11.410   0.577   8.753
  291    HG3  GLU  37           HG1      GLU  37 -13.001   0.588   9.511
  292    H    HIS  38           HN       HIS  38 -13.267   2.807   8.349
  293    HA   HIS  38           HA       HIS  38 -16.168   3.192   8.370
  294    HB2  HIS  38           HB2      HIS  38 -15.387   2.208  10.558
  295    HB3  HIS  38           HB1      HIS  38 -14.414   3.655  10.807
  296    HD1  HIS  38           HD1      HIS  38 -18.036   2.497  10.778
  297    HD2  HIS  38           HD2      HIS  38 -15.817   5.919  11.610
  298    HE1  HIS  38           HE1      HIS  38 -19.616   4.116  11.817
  299    H    ASN  39           HN       ASN  39 -13.009   4.612   8.155
  300    HA   ASN  39           HA       ASN  39 -14.101   7.304   8.262
  301    HB2  ASN  39           HB2      ASN  39 -11.842   6.841   9.209
  302    HB3  ASN  39           HB1      ASN  39 -11.280   6.405   7.605
  303   HD21  ASN  39          HD21      ASN  39 -10.764   8.017   6.180
  304   HD22  ASN  39          HD22      ASN  39 -10.681   9.691   6.618
  305    H    ARG  40           HN       ARG  40 -15.533   7.336   6.559
  306    HA   ARG  40           HA       ARG  40 -14.927   6.348   3.995
  307    HB2  ARG  40           HB2      ARG  40 -16.989   7.247   3.226
  308    HB3  ARG  40           HB1      ARG  40 -17.246   6.626   4.844
  309    HG2  ARG  40           HG2      ARG  40 -17.317   8.827   5.759
  310    HG3  ARG  40           HG1      ARG  40 -16.759   9.534   4.240
  311    HD2  ARG  40           HD2      ARG  40 -19.389   8.147   4.744
  312    HD3  ARG  40           HD1      ARG  40 -19.112   9.868   4.426
  313    HE   ARG  40           HE       ARG  40 -18.043   8.790   2.242
  314   HH11  ARG  40          HH11      ARG  40 -21.212   8.284   3.699
  315   HH12  ARG  40          HH12      ARG  40 -21.914   7.648   2.270
  316   HH21  ARG  40          HH21      ARG  40 -18.967   7.942   0.337
  317   HH22  ARG  40          HH22      ARG  40 -20.598   7.452   0.285
  318    H    ALA  41           HN       ALA  41 -14.280   9.395   5.452
  319    HA   ALA  41           HA       ALA  41 -14.186  11.009   3.171
  320    HB1  ALA  41           HB1      ALA  41 -12.791  12.521   4.487
  321    HB2  ALA  41           HB2      ALA  41 -12.505  11.241   5.672
  322    HB3  ALA  41           HB3      ALA  41 -14.130  11.889   5.441
  323    H    ALA  42           HN       ALA  42 -11.859   8.804   4.467
  324    HA   ALA  42           HA       ALA  42  -9.903   9.497   2.422
  325    HB1  ALA  42           HB1      ALA  42  -9.815   7.352   4.553
  326    HB2  ALA  42           HB2      ALA  42  -9.050   8.932   4.636
  327    HB3  ALA  42           HB3      ALA  42  -8.494   7.746   3.453
  328    H    ALA  43           HN       ALA  43 -12.502   7.351   2.880
  329    HA   ALA  43           HA       ALA  43 -11.654   5.313   1.065
  330    HB1  ALA  43           HB1      ALA  43 -13.873   4.400   1.321
  331    HB2  ALA  43           HB2      ALA  43 -14.446   5.908   2.006
  332    HB3  ALA  43           HB3      ALA  43 -13.302   4.922   2.913
  333    H    GLU  44           HN       GLU  44 -13.638   8.222   0.854
  334    HA   GLU  44           HA       GLU  44 -14.396   7.905  -1.835
  335    HB2  GLU  44           HB2      GLU  44 -14.295  10.184   0.045
  336    HB3  GLU  44           HB1      GLU  44 -14.226  10.590  -1.661
  337    HG2  GLU  44           HG2      GLU  44 -16.493  10.707  -0.852
  338    HG3  GLU  44           HG1      GLU  44 -16.330   9.421  -2.035
  339    H    PHE  45           HN       PHE  45 -11.473   9.107  -0.358
  340    HA   PHE  45           HA       PHE  45 -10.235  10.161  -2.655
  341    HB2  PHE  45           HB2      PHE  45  -9.327  10.578  -0.405
  342    HB3  PHE  45           HB1      PHE  45  -8.992   8.866  -0.210
  343    HD1  PHE  45           HD2      PHE  45  -8.061  11.857  -2.204
  344    HD2  PHE  45           HD1      PHE  45  -6.955   7.949  -0.913
  345    HE1  PHE  45           HE2      PHE  45  -5.814  12.181  -3.152
  346    HE2  PHE  45           HE1      PHE  45  -4.702   8.271  -1.858
  347    HZ   PHE  45           HZ       PHE  45  -4.133  10.391  -2.981
  348    H    VAL  46           HN       VAL  46 -10.284   6.953  -1.244
  349    HA   VAL  46           HA       VAL  46  -8.597   5.561  -2.976
  350    HB   VAL  46           HB       VAL  46 -11.117   4.581  -1.598
  351   HG11  VAL  46          HG11      VAL  46  -8.839   3.004  -2.775
  352   HG12  VAL  46          HG12      VAL  46 -10.492   3.051  -3.372
  353   HG13  VAL  46          HG13      VAL  46 -10.141   2.336  -1.793
  354   HG21  VAL  46          HG21      VAL  46  -9.600   3.731   0.100
  355   HG22  VAL  46          HG22      VAL  46  -9.454   5.485  -0.068
  356   HG23  VAL  46          HG23      VAL  46  -8.235   4.427  -0.766
  357    H    GLY  47           HN       GLY  47 -12.046   6.202  -3.184
  358    HA2  GLY  47           HA2      GLY  47 -12.476   4.867  -5.635
  359    HA3  GLY  47           HA1      GLY  47 -13.521   6.095  -4.928
  360    H    SER  48           HN       SER  48 -12.045   8.274  -4.854
  361    HA   SER  48           HA       SER  48 -12.283   9.271  -7.424
  362    HB2  SER  48           HB2      SER  48 -12.438  10.580  -5.314
  363    HB3  SER  48           HB1      SER  48 -10.689  10.483  -5.169
  364    HG   SER  48           HG       SER  48 -12.057  12.265  -6.420
  365    H    VAL  49           HN       VAL  49  -9.337   8.151  -5.750
  366    HA   VAL  49           HA       VAL  49  -7.652   9.173  -7.785
  367    HB   VAL  49           HB       VAL  49  -6.879   8.716  -5.454
  368   HG11  VAL  49          HG11      VAL  49  -6.842   5.822  -6.263
  369   HG12  VAL  49          HG12      VAL  49  -7.866   6.570  -5.037
  370   HG13  VAL  49          HG13      VAL  49  -6.121   6.496  -4.802
  371   HG21  VAL  49          HG21      VAL  49  -5.237   7.442  -7.635
  372   HG22  VAL  49          HG22      VAL  49  -4.623   7.941  -6.060
  373   HG23  VAL  49          HG23      VAL  49  -5.247   9.146  -7.184
  374    H    ASN  50           HN       ASN  50  -9.467   6.275  -7.539
  375    HA   ASN  50           HA       ASN  50  -8.058   5.097  -9.823
  376    HB2  ASN  50           HB2      ASN  50 -10.263   4.003  -8.060
  377    HB3  ASN  50           HB1      ASN  50  -9.713   3.183  -9.516
  378   HD21  ASN  50          HD21      ASN  50  -8.978   3.950  -6.206
  379   HD22  ASN  50          HD22      ASN  50  -7.578   2.955  -6.095
  380    H    GLY  51           HN       GLY  51 -10.960   6.733  -9.015
  381    HA2  GLY  51           HA2      GLY  51 -11.545   7.975 -11.250
  382    HA3  GLY  51           HA1      GLY  51 -12.127   6.357 -11.643
  383    H    GLY  52           HN       GLY  52 -13.332   5.383  -9.770
  384    HA2  GLY  52           HA2      GLY  52 -14.910   7.174  -8.150
  385    HA3  GLY  52           HA1      GLY  52 -15.810   6.399  -9.453
  386    H    ASN  53           HN       ASN  53 -14.285   3.973  -9.428
  387    HA   ASN  53           HA       ASN  53 -15.679   2.665  -7.318
  388    HB2  ASN  53           HB2      ASN  53 -14.823   0.593  -8.224
  389    HB3  ASN  53           HB1      ASN  53 -15.394   1.609  -9.537
  390   HD21  ASN  53          HD21      ASN  53 -13.525  -0.629  -9.491
  391   HD22  ASN  53          HD22      ASN  53 -12.057  -0.050 -10.185
  392    H    ARG  54           HN       ARG  54 -14.809   1.525  -5.600
  393    HA   ARG  54           HA       ARG  54 -12.338   2.686  -4.648
  394    HB2  ARG  54           HB2      ARG  54 -14.416   0.993  -3.255
  395    HB3  ARG  54           HB1      ARG  54 -12.941   1.516  -2.481
  396    HG2  ARG  54           HG2      ARG  54 -13.663   3.864  -2.750
  397    HG3  ARG  54           HG1      ARG  54 -15.157   3.294  -3.504
  398    HD2  ARG  54           HD2      ARG  54 -15.715   2.055  -1.458
  399    HD3  ARG  54           HD1      ARG  54 -14.227   2.617  -0.713
  400    HE   ARG  54           HE       ARG  54 -15.685   4.861  -1.500
  401   HH11  ARG  54          HH11      ARG  54 -15.986   2.200   0.860
  402   HH12  ARG  54          HH12      ARG  54 -16.914   3.111   1.954
  403   HH21  ARG  54          HH21      ARG  54 -16.979   6.112   0.120
  404   HH22  ARG  54          HH22      ARG  54 -17.501   5.286   1.511
  405    H    THR  55           HN       THR  55 -10.903   1.514  -6.060
  406    HA   THR  55           HA       THR  55 -10.659  -1.330  -5.680
  407    HB   THR  55           HB       THR  55  -8.499   0.550  -6.724
  408    HG1  THR  55           HG1      THR  55  -9.452   0.359  -8.735
  409   HG21  THR  55          HG21      THR  55  -7.848  -1.738  -6.231
  410   HG22  THR  55          HG22      THR  55  -7.850  -1.458  -7.985
  411   HG23  THR  55          HG23      THR  55  -9.170  -2.351  -7.224
  412    H    VAL  56           HN       VAL  56  -9.759  -2.192  -3.874
  413    HA   VAL  56           HA       VAL  56  -9.080  -0.230  -1.948
  414    HB   VAL  56           HB       VAL  56  -8.831  -3.086  -1.260
  415   HG11  VAL  56          HG11      VAL  56  -9.705  -0.646   0.261
  416   HG12  VAL  56          HG12      VAL  56  -8.092  -1.289   0.244
  417   HG13  VAL  56          HG13      VAL  56  -9.408  -2.250   0.951
  418   HG21  VAL  56          HG21      VAL  56 -11.327  -1.448  -1.356
  419   HG22  VAL  56          HG22      VAL  56 -11.166  -3.079  -0.667
  420   HG23  VAL  56          HG23      VAL  56 -10.964  -2.816  -2.418
  421    HA   PRO  57           HA       PRO  57  -5.237  -2.267  -1.177
  422    HB2  PRO  57           HB2      PRO  57  -3.747  -3.983  -2.680
  423    HB3  PRO  57           HB1      PRO  57  -5.020  -4.486  -1.562
  424    HG2  PRO  57           HG2      PRO  57  -5.277  -3.933  -4.505
  425    HG3  PRO  57           HG1      PRO  57  -5.807  -5.374  -3.610
  426    HD2  PRO  57           HD2      PRO  57  -7.541  -3.461  -4.179
  427    HD3  PRO  57           HD1      PRO  57  -7.481  -4.337  -2.602
  428    H    THR  58           HN       THR  58  -5.126  -0.109  -2.106
  429    HA   THR  58           HA       THR  58  -3.353   0.422  -4.331
  430    HB   THR  58           HB       THR  58  -5.385   2.082  -2.826
  431    HG1  THR  58           HG1      THR  58  -6.736   0.972  -4.065
  432   HG21  THR  58          HG21      THR  58  -5.224   3.620  -4.744
  433   HG22  THR  58          HG22      THR  58  -3.963   2.617  -5.440
  434   HG23  THR  58          HG23      THR  58  -3.661   3.490  -3.920
  435    H    VAL  59           HN       VAL  59  -1.359   0.952  -3.677
  436    HA   VAL  59           HA       VAL  59  -0.992   1.593  -0.859
  437    HB   VAL  59           HB       VAL  59   0.215  -0.421  -1.717
  438   HG11  VAL  59          HG11      VAL  59   0.502   0.143  -3.956
  439   HG12  VAL  59          HG12      VAL  59   2.087  -0.153  -3.210
  440   HG13  VAL  59          HG13      VAL  59   1.511   1.507  -3.494
  441   HG21  VAL  59          HG21      VAL  59   2.424   0.128  -0.853
  442   HG22  VAL  59          HG22      VAL  59   1.177   0.842   0.161
  443   HG23  VAL  59          HG23      VAL  59   2.058   1.841  -0.982
  444    H    LYS  60           HN       LYS  60   0.040   3.356  -0.219
  445    HA   LYS  60           HA       LYS  60   0.594   5.432  -2.217
  446    HB2  LYS  60           HB2      LYS  60  -1.261   5.786  -0.560
  447    HB3  LYS  60           HB1      LYS  60  -0.079   5.632   0.721
  448    HG2  LYS  60           HG2      LYS  60   0.961   7.691   0.039
  449    HG3  LYS  60           HG1      LYS  60  -0.109   7.800  -1.369
  450    HD2  LYS  60           HD2      LYS  60  -2.063   7.822   0.152
  451    HD3  LYS  60           HD1      LYS  60  -0.964   7.807   1.525
  452    HE2  LYS  60           HE2      LYS  60  -1.080   9.948  -0.583
  453    HE3  LYS  60           HE1      LYS  60  -1.877  10.045   0.984
  454    HZ1  LYS  60           HZ1      LYS  60   1.055   9.859   0.520
  455    HZ2  LYS  60           HZ2      LYS  60   0.342   9.913   2.031
  456    HZ3  LYS  60           HZ3      LYS  60   0.228  11.224   1.002
  457    H    PHE  61           HN       PHE  61   2.700   5.579  -2.571
  458    HA   PHE  61           HA       PHE  61   4.664   4.624  -0.627
  459    HB2  PHE  61           HB2      PHE  61   4.898   5.524  -3.496
  460    HB3  PHE  61           HB1      PHE  61   6.306   5.216  -2.495
  461    HD1  PHE  61           HD2      PHE  61   6.880   2.986  -1.829
  462    HD2  PHE  61           HD1      PHE  61   3.519   3.728  -4.312
  463    HE1  PHE  61           HE2      PHE  61   6.786   0.609  -2.407
  464    HE2  PHE  61           HE1      PHE  61   3.437   1.348  -4.907
  465    HZ   PHE  61           HZ       PHE  61   5.072  -0.219  -3.953
  466    H    ALA  62           HN       ALA  62   6.772   5.981  -0.639
  467    HA   ALA  62           HA       ALA  62   6.260   8.483   0.559
  468    HB1  ALA  62           HB1      ALA  62   8.692   8.729   0.653
  469    HB2  ALA  62           HB2      ALA  62   8.880   7.387  -0.471
  470    HB3  ALA  62           HB3      ALA  62   8.211   7.102   1.139
  471    H    ASP  63           HN       ASP  63   6.499   7.537  -2.654
  472    HA   ASP  63           HA       ASP  63   7.417   9.838  -4.009
  473    HB2  ASP  63           HB2      ASP  63   5.285   7.839  -4.768
  474    HB3  ASP  63           HB1      ASP  63   5.914   9.060  -5.844
  475    H    GLY  64           HN       GLY  64   4.555   9.154  -2.209
  476    HA2  GLY  64           HA2      GLY  64   2.874  10.633  -1.608
  477    HA3  GLY  64           HA1      GLY  64   3.418  11.734  -2.867
  478    H    SER  65           HN       SER  65   3.418   9.074  -4.559
  479    HA   SER  65           HA       SER  65   0.737   9.502  -5.512
  480    HB2  SER  65           HB2      SER  65   1.570   8.250  -7.513
  481    HB3  SER  65           HB1      SER  65   2.495   9.704  -7.163
  482    HG   SER  65           HG       SER  65   3.194   7.061  -7.063
  483    H    THR  66           HN       THR  66  -0.385   7.486  -6.313
  484    HA   THR  66           HA       THR  66  -0.099   5.356  -4.332
  485    HB   THR  66           HB       THR  66  -2.603   5.048  -5.078
  486    HG1  THR  66           HG1      THR  66  -2.505   6.660  -6.719
  487   HG21  THR  66          HG21      THR  66  -1.889   5.664  -2.800
  488   HG22  THR  66          HG22      THR  66  -3.309   6.597  -3.287
  489   HG23  THR  66          HG23      THR  66  -1.715   7.343  -3.307
  490    H    LEU  67           HN       LEU  67  -0.042   3.268  -5.042
  491    HA   LEU  67           HA       LEU  67  -0.226   2.857  -7.940
  492    HB2  LEU  67           HB2      LEU  67   2.102   2.620  -7.027
  493    HB3  LEU  67           HB1      LEU  67   1.530   1.327  -5.999
  494    HG   LEU  67           HG       LEU  67   1.004  -0.016  -8.030
  495   HD11  LEU  67          HD11      LEU  67   2.306   2.278  -9.481
  496   HD12  LEU  67          HD12      LEU  67   0.646   1.695  -9.688
  497   HD13  LEU  67          HD13      LEU  67   2.003   0.696 -10.175
  498   HD21  LEU  67          HD21      LEU  67   3.153  -0.350  -6.894
  499   HD22  LEU  67          HD22      LEU  67   3.864   0.950  -7.848
  500   HD23  LEU  67          HD23      LEU  67   3.323  -0.527  -8.636
  501    H    THR  68           HN       THR  68  -2.059   1.855  -8.341
  502    HA   THR  68           HA       THR  68  -3.482   0.379  -6.379
  503    HB   THR  68           HB       THR  68  -4.048   0.726  -9.320
  504    HG1  THR  68           HG1      THR  68  -5.563   2.338  -8.033
  505   HG21  THR  68          HG21      THR  68  -5.344  -1.036  -8.226
  506   HG22  THR  68          HG22      THR  68  -6.371   0.347  -8.617
  507   HG23  THR  68          HG23      THR  68  -5.825   0.096  -6.964
  508    H    ASN  69           HN       ASN  69  -3.190  -1.698  -5.943
  509    HA   ASN  69           HA       ASN  69  -2.739  -3.886  -6.035
  510    HB2  ASN  69           HB2      ASN  69  -4.775  -3.807  -7.469
  511    HB3  ASN  69           HB1      ASN  69  -3.753  -3.701  -8.892
  512   HD21  ASN  69          HD21      ASN  69  -5.770  -5.651  -8.249
  513   HD22  ASN  69          HD22      ASN  69  -4.992  -7.184  -8.192
  514    HA   PRO  70           HA       PRO  70   1.229  -3.782  -8.252
  515    HB2  PRO  70           HB2      PRO  70   2.874  -3.267  -6.264
  516    HB3  PRO  70           HB1      PRO  70   1.851  -1.980  -6.919
  517    HG2  PRO  70           HG2      PRO  70   1.541  -3.544  -4.398
  518    HG3  PRO  70           HG1      PRO  70   1.195  -1.828  -4.693
  519    HD2  PRO  70           HD2      PRO  70  -0.655  -3.970  -4.723
  520    HD3  PRO  70           HD1      PRO  70  -0.955  -2.312  -5.285
  521    H    SER  71           HN       SER  71   2.995  -5.309  -8.079
  522    HA   SER  71           HA       SER  71   2.311  -7.772  -6.741
  523    HB2  SER  71           HB2      SER  71   4.809  -7.058  -8.300
  524    HB3  SER  71           HB1      SER  71   4.182  -8.676  -7.974
  525    HG   SER  71           HG       SER  71   2.528  -8.342  -9.339
  526    H    ALA  72           HN       ALA  72   3.722  -8.731  -5.106
  527    HA   ALA  72           HA       ALA  72   4.453  -6.923  -3.081
  528    HB1  ALA  72           HB1      ALA  72   5.230  -9.818  -3.355
  529    HB2  ALA  72           HB2      ALA  72   3.726  -9.216  -2.654
  530    HB3  ALA  72           HB3      ALA  72   5.264  -8.866  -1.869
  531    H    ASP  73           HN       ASP  73   6.386  -8.724  -5.368
  532    HA   ASP  73           HA       ASP  73   8.933  -7.997  -4.413
  533    HB2  ASP  73           HB2      ASP  73   8.678  -9.851  -5.937
  534    HB3  ASP  73           HB1      ASP  73   7.999  -8.799  -7.171
  535    H    GLU  74           HN       GLU  74   6.747  -6.483  -6.656
  536    HA   GLU  74           HA       GLU  74   8.426  -4.409  -7.596
  537    HB2  GLU  74           HB2      GLU  74   5.432  -4.607  -7.348
  538    HB3  GLU  74           HB1      GLU  74   6.252  -3.269  -8.136
  539    HG2  GLU  74           HG2      GLU  74   6.511  -6.145  -8.952
  540    HG3  GLU  74           HG1      GLU  74   5.400  -4.985  -9.693
  541    H    VAL  75           HN       VAL  75   6.127  -4.638  -4.942
  542    HA   VAL  75           HA       VAL  75   6.337  -1.999  -4.049
  543    HB   VAL  75           HB       VAL  75   5.728  -4.475  -2.404
  544   HG11  VAL  75          HG11      VAL  75   5.156  -1.567  -1.818
  545   HG12  VAL  75          HG12      VAL  75   6.337  -2.579  -0.993
  546   HG13  VAL  75          HG13      VAL  75   4.616  -2.941  -0.852
  547   HG21  VAL  75          HG21      VAL  75   3.887  -2.537  -3.789
  548   HG22  VAL  75          HG22      VAL  75   3.381  -3.870  -2.749
  549   HG23  VAL  75          HG23      VAL  75   4.200  -4.202  -4.274
  550    H    LYS  76           HN       LYS  76   8.124  -4.931  -3.185
  551    HA   LYS  76           HA       LYS  76   9.677  -3.790  -1.146
  552    HB2  LYS  76           HB2      LYS  76   9.434  -6.262  -1.546
  553    HB3  LYS  76           HB1      LYS  76  10.472  -6.088  -2.949
  554    HG2  LYS  76           HG2      LYS  76  11.717  -6.970  -1.049
  555    HG3  LYS  76           HG1      LYS  76  12.317  -5.368  -1.483
  556    HD2  LYS  76           HD2      LYS  76  11.011  -4.376   0.331
  557    HD3  LYS  76           HD1      LYS  76  10.355  -5.966   0.728
  558    HE2  LYS  76           HE2      LYS  76  13.281  -5.233   0.863
  559    HE3  LYS  76           HE1      LYS  76  12.176  -5.214   2.237
  560    HZ1  LYS  76           HZ1      LYS  76  12.941  -7.583   0.616
  561    HZ2  LYS  76           HZ2      LYS  76  11.857  -7.589   1.933
  562    HZ3  LYS  76           HZ3      LYS  76  13.464  -7.201   2.165
  563    H    ALA  77           HN       ALA  77  10.341  -4.201  -4.614
  564    HA   ALA  77           HA       ALA  77  12.937  -3.081  -4.519
  565    HB1  ALA  77           HB1      ALA  77  11.070  -3.322  -6.875
  566    HB2  ALA  77           HB2      ALA  77  12.186  -4.571  -6.320
  567    HB3  ALA  77           HB3      ALA  77  12.810  -3.046  -6.951
  568    H    LYS  78           HN       LYS  78   9.774  -1.632  -4.884
  569    HA   LYS  78           HA       LYS  78  10.934   0.954  -5.559
  570    HB2  LYS  78           HB2      LYS  78   8.386  -0.150  -5.865
  571    HB3  LYS  78           HB1      LYS  78   8.186   0.962  -4.522
  572    HG2  LYS  78           HG2      LYS  78   9.122   1.640  -7.305
  573    HG3  LYS  78           HG1      LYS  78   7.593   2.074  -6.560
  574    HD2  LYS  78           HD2      LYS  78   8.740   3.486  -4.956
  575    HD3  LYS  78           HD1      LYS  78  10.301   3.006  -5.606
  576    HE2  LYS  78           HE2      LYS  78   9.795   5.141  -6.517
  577    HE3  LYS  78           HE1      LYS  78   9.573   3.967  -7.812
  578    HZ1  LYS  78           HZ1      LYS  78   7.483   5.268  -6.176
  579    HZ2  LYS  78           HZ2      LYS  78   7.160   4.052  -7.339
  580    HZ3  LYS  78           HZ3      LYS  78   7.810   5.531  -7.804
  581    H    LEU  79           HN       LEU  79   9.701  -0.702  -2.703
  582    HA   LEU  79           HA       LEU  79   9.644   1.416  -0.915
  583    HB2  LEU  79           HB2      LEU  79   8.881  -0.993  -0.408
  584    HB3  LEU  79           HB1      LEU  79  10.566  -1.381  -0.276
  585    HG   LEU  79           HG       LEU  79  10.695   0.340   1.567
  586   HD11  LEU  79          HD11      LEU  79   8.621   0.693   2.839
  587   HD12  LEU  79          HD12      LEU  79   7.701   0.085   1.466
  588   HD13  LEU  79          HD13      LEU  79   8.651   1.566   1.319
  589   HD21  LEU  79          HD21      LEU  79  10.860  -2.019   2.005
  590   HD22  LEU  79          HD22      LEU  79   9.110  -2.190   1.923
  591   HD23  LEU  79          HD23      LEU  79   9.847  -1.271   3.243
  592    H    VAL  80           HN       VAL  80  12.259  -0.804  -1.698
  593    HA   VAL  80           HA       VAL  80  14.113   0.190   0.134
  594    HB   VAL  80           HB       VAL  80  15.838  -1.048  -1.135
  595   HG11  VAL  80          HG11      VAL  80  14.872  -3.237  -0.927
  596   HG12  VAL  80          HG12      VAL  80  13.254  -2.521  -0.881
  597   HG13  VAL  80          HG13      VAL  80  14.395  -2.203   0.430
  598   HG21  VAL  80          HG21      VAL  80  15.171  -0.597  -3.389
  599   HG22  VAL  80          HG22      VAL  80  13.633  -1.401  -3.123
  600   HG23  VAL  80          HG23      VAL  80  15.130  -2.346  -3.118
  601    H    LYS  81           HN       LYS  81  13.425   1.259  -3.120
  602    HA   LYS  81           HA       LYS  81  15.778   2.909  -3.154
  603    HB2  LYS  81           HB2      LYS  81  14.967   3.760  -5.347
  604    HB3  LYS  81           HB1      LYS  81  15.060   2.008  -5.261
  605    HG2  LYS  81           HG2      LYS  81  12.744   1.779  -5.129
  606    HG3  LYS  81           HG1      LYS  81  12.516   3.504  -4.850
  607    HD2  LYS  81           HD2      LYS  81  11.958   2.810  -7.161
  608    HD3  LYS  81           HD1      LYS  81  13.242   4.010  -7.095
  609    HE2  LYS  81           HE2      LYS  81  13.797   2.348  -8.707
  610    HE3  LYS  81           HE1      LYS  81  14.886   2.222  -7.325
  611    HZ1  LYS  81           HZ1      LYS  81  14.204   0.065  -8.092
  612    HZ2  LYS  81           HZ2      LYS  81  12.578   0.431  -7.929
  613    HZ3  LYS  81           HZ3      LYS  81  13.569   0.290  -6.557
  614    H    ILE  82           HN       ILE  82  12.400   3.355  -2.393
  615    HA   ILE  82           HA       ILE  82  12.837   6.187  -2.310
  616    HB   ILE  82           HB       ILE  82  10.445   6.464  -1.753
  617   HG12  ILE  82          HG12      ILE  82   8.922   4.420  -2.093
  618   HG13  ILE  82          HG11      ILE  82  10.350   3.424  -1.889
  619   HG21  ILE  82          HG21      ILE  82   9.585   5.717  -3.940
  620   HG22  ILE  82          HG22      ILE  82  11.012   4.704  -4.135
  621   HG23  ILE  82          HG23      ILE  82  11.187   6.446  -4.059
  622   HD11  ILE  82          HD11      ILE  82   9.032   3.497   0.139
  623   HD12  ILE  82          HD12      ILE  82   9.137   5.255   0.173
  624   HD13  ILE  82          HD13      ILE  82  10.590   4.283   0.405
  625    H    ALA  83           HN       ALA  83  13.226   3.671  -0.217
  626    HA   ALA  83           HA       ALA  83  12.992   5.267   2.182
  627    HB1  ALA  83           HB1      ALA  83  12.525   2.857   2.280
  628    HB2  ALA  83           HB2      ALA  83  13.885   3.277   3.324
  629    HB3  ALA  83           HB3      ALA  83  14.175   2.515   1.760
  630    H    GLY  84           HN       GLY  84  15.134   4.975  -0.308
  631    HA2  GLY  84           HA2      GLY  84  17.012   6.329  -0.541
  632    HA3  GLY  84           HA1      GLY  84  17.123   6.424   1.210
  633    H    LEU  85           HN       LEU  85  18.968   5.635   1.793
  634    HA   LEU  85           HA       LEU  85  20.076   3.312   0.428
  635    HB2  LEU  85           HB2      LEU  85  21.446   5.337   0.774
  636    HB3  LEU  85           HB1      LEU  85  21.269   5.154   2.502
  637    HG   LEU  85           HG       LEU  85  22.480   2.969   2.311
  638   HD11  LEU  85          HD11      LEU  85  22.072   2.511  -0.027
  639   HD12  LEU  85          HD12      LEU  85  23.803   2.569   0.299
  640   HD13  LEU  85          HD13      LEU  85  23.007   3.931  -0.489
  641   HD21  LEU  85          HD21      LEU  85  23.578   5.014   3.035
  642   HD22  LEU  85          HD22      LEU  85  23.955   5.413   1.358
  643   HD23  LEU  85          HD23      LEU  85  24.669   3.985   2.113
  644    H    GLU  86           HN       GLU  86  18.161   4.002   3.059
  645    HA   GLU  86           HA       GLU  86  19.292   2.223   4.981
  646    HB2  GLU  86           HB2      GLU  86  16.526   3.444   4.917
  647    HB3  GLU  86           HB1      GLU  86  17.194   2.544   6.267
  648    HG2  GLU  86           HG2      GLU  86  18.983   4.266   6.440
  649    HG3  GLU  86           HG1      GLU  86  18.138   5.194   5.201
  650    H    HIS  87           HN       HIS  87  19.520   0.289   4.027
  651    HA   HIS  87           HA       HIS  87  17.025  -1.244   3.662
  652    HB2  HIS  87           HB2      HIS  87  18.109  -0.763   1.470
  653    HB3  HIS  87           HB1      HIS  87  19.576  -1.543   2.045
  654    HD1  HIS  87           HD1      HIS  87  19.791  -3.838   1.035
  655    HD2  HIS  87           HD2      HIS  87  15.846  -2.810   1.818
  656    HE1  HIS  87           HE1      HIS  87  18.404  -5.774   0.270
  657    H    HIS  88           HN       HIS  88  19.767  -0.853   5.448
  658    HA   HIS  88           HA       HIS  88  20.087  -3.716   5.985
  659    HB2  HIS  88           HB2      HIS  88  21.989  -1.459   6.575
  660    HB3  HIS  88           HB1      HIS  88  22.289  -3.157   6.927
  661    HD1  HIS  88           HD1      HIS  88  22.562  -0.618   4.254
  662    HD2  HIS  88           HD2      HIS  88  22.738  -4.757   4.608
  663    HE1  HIS  88           HE1      HIS  88  23.565  -1.451   2.125
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1   3.912   6.197   7.596
    2    H2   MET   1           HT2      MET   1   3.006   6.335   6.198
    3    H3   MET   1           HT3      MET   1   2.406   5.434   7.474
    4    HA   MET   1           HA       MET   1   2.964   8.341   7.360
    5    HB2  MET   1           HB2      MET   1   0.601   8.785   7.365
    6    HB3  MET   1           HB1      MET   1   0.929   7.643   6.076
    7    HG2  MET   1           HG2      MET   1   0.105   5.821   7.523
    8    HG3  MET   1           HG1      MET   1  -0.264   7.004   8.769
    9    HE1  MET   1           HE1      MET   1  -3.080   9.124   6.880
   10    HE2  MET   1           HE2      MET   1  -1.350   9.426   6.756
   11    HE3  MET   1           HE3      MET   1  -2.068   9.041   8.321
   12    H    VAL   2           HN       VAL   2   1.776   5.689   9.570
   13    HA   VAL   2           HA       VAL   2   2.098   7.733  11.601
   14    HB   VAL   2           HB       VAL   2  -0.200   6.901  11.640
   15   HG11  VAL   2          HG11      VAL   2   0.064   4.677  10.753
   16   HG12  VAL   2          HG12      VAL   2  -0.785   4.625  12.301
   17   HG13  VAL   2          HG13      VAL   2   0.917   4.174  12.212
   18   HG21  VAL   2          HG21      VAL   2   1.349   5.978  14.049
   19   HG22  VAL   2          HG22      VAL   2  -0.387   6.294  14.002
   20   HG23  VAL   2          HG23      VAL   2   0.757   7.610  13.747
   21    H    THR   3           HN       THR   3   2.706   4.260  11.177
   22    HA   THR   3           HA       THR   3   5.164   4.787  12.638
   23    HB   THR   3           HB       THR   3   4.892   2.391  13.602
   24    HG1  THR   3           HG1      THR   3   3.072   1.682  12.667
   25   HG21  THR   3          HG21      THR   3   4.946   4.438  14.958
   26   HG22  THR   3          HG22      THR   3   3.787   3.285  15.602
   27   HG23  THR   3          HG23      THR   3   3.222   4.677  14.676
   28    H    ALA   4           HN       ALA   4   3.555   3.268  10.030
   29    HA   ALA   4           HA       ALA   4   5.984   1.829   9.380
   30    HB1  ALA   4           HB1      ALA   4   4.610   0.775   7.650
   31    HB2  ALA   4           HB2      ALA   4   3.237   1.770   8.137
   32    HB3  ALA   4           HB3      ALA   4   3.898   0.572   9.249
   33    H    ALA   5           HN       ALA   5   6.814   2.099   7.218
   34    HA   ALA   5           HA       ALA   5   6.696   4.869   6.370
   35    HB1  ALA   5           HB1      ALA   5   8.374   2.572   5.347
   36    HB2  ALA   5           HB2      ALA   5   8.870   3.742   6.569
   37    HB3  ALA   5           HB3      ALA   5   8.573   4.270   4.915
   38    H    LEU   6           HN       LEU   6   4.900   2.224   5.815
   39    HA   LEU   6           HA       LEU   6   4.298   3.004   3.058
   40    HB2  LEU   6           HB2      LEU   6   5.451   0.741   3.396
   41    HB3  LEU   6           HB1      LEU   6   3.955   0.249   4.189
   42    HG   LEU   6           HG       LEU   6   2.768   0.790   2.112
   43   HD11  LEU   6          HD11      LEU   6   5.586   1.082   1.129
   44   HD12  LEU   6          HD12      LEU   6   4.331   2.334   1.162
   45   HD13  LEU   6          HD13      LEU   6   4.170   0.946   0.094
   46   HD21  LEU   6          HD21      LEU   6   4.978  -1.245   1.957
   47   HD22  LEU   6          HD22      LEU   6   3.523  -1.226   0.966
   48   HD23  LEU   6          HD23      LEU   6   3.402  -1.494   2.707
   49    H    THR   7           HN       THR   7   2.123   3.324   2.700
   50    HA   THR   7           HA       THR   7   0.323   2.622   4.888
   51    HB   THR   7           HB       THR   7   0.236   5.035   3.076
   52    HG1  THR   7           HG1      THR   7   1.164   4.555   5.693
   53   HG21  THR   7          HG21      THR   7  -1.521   4.292   5.435
   54   HG22  THR   7          HG22      THR   7  -2.021   4.284   3.752
   55   HG23  THR   7          HG23      THR   7  -1.603   5.803   4.539
   56    H    ILE   8           HN       ILE   8  -1.527   1.581   4.276
   57    HA   ILE   8           HA       ILE   8  -1.962   1.284   1.416
   58    HB   ILE   8           HB       ILE   8  -1.990  -0.934   3.482
   59   HG12  ILE   8          HG12      ILE   8  -0.451  -0.584   0.906
   60   HG13  ILE   8          HG11      ILE   8   0.209  -0.429   2.531
   61   HG21  ILE   8          HG21      ILE   8  -2.778  -2.430   1.674
   62   HG22  ILE   8          HG22      ILE   8  -3.008  -1.015   0.641
   63   HG23  ILE   8          HG23      ILE   8  -3.918  -1.173   2.155
   64   HD11  ILE   8          HD11      ILE   8  -0.894  -2.939   1.284
   65   HD12  ILE   8          HD12      ILE   8  -0.235  -2.800   2.916
   66   HD13  ILE   8          HD13      ILE   8   0.808  -2.545   1.518
   67    H    TYR   9           HN       TYR   9  -3.958   1.537   0.766
   68    HA   TYR   9           HA       TYR   9  -5.893   2.301   2.780
   69    HB2  TYR   9           HB2      TYR   9  -5.665   2.746  -0.188
   70    HB3  TYR   9           HB1      TYR   9  -7.160   3.116   0.628
   71    HD1  TYR   9           HD1      TYR   9  -3.578   4.002   0.347
   72    HD2  TYR   9           HD2      TYR   9  -7.358   5.119   1.953
   73    HE1  TYR   9           HE1      TYR   9  -2.680   6.221   0.927
   74    HE2  TYR   9           HE2      TYR   9  -6.467   7.337   2.529
   75    HH   TYR   9           HH       TYR   9  -4.310   8.377   2.983
   76    H    THR  10           HN       THR  10  -6.563   0.287   3.571
   77    HA   THR  10           HA       THR  10  -8.024  -1.424   1.691
   78    HB   THR  10           HB       THR  10  -7.429  -3.193   3.490
   79    HG1  THR  10           HG1      THR  10  -6.370  -2.322   5.013
   80   HG21  THR  10          HG21      THR  10  -6.505  -3.577   1.347
   81   HG22  THR  10          HG22      THR  10  -5.134  -3.518   2.497
   82   HG23  THR  10          HG23      THR  10  -5.492  -2.131   1.487
   83    H    THR  11           HN       THR  11  -9.800  -2.578   2.678
   84    HA   THR  11           HA       THR  11 -10.801  -1.457   5.190
   85    HB   THR  11           HB       THR  11 -13.022  -2.323   4.382
   86    HG1  THR  11           HG1      THR  11 -12.568  -2.487   1.777
   87   HG21  THR  11          HG21      THR  11 -13.554  -0.608   2.864
   88   HG22  THR  11          HG22      THR  11 -11.893  -0.484   2.289
   89   HG23  THR  11          HG23      THR  11 -12.302   0.094   3.903
   90    H    SER  12           HN       SER  12 -11.909  -3.246   6.530
   91    HA   SER  12           HA       SER  12 -10.502  -5.695   6.440
   92    HB2  SER  12           HB2      SER  12 -11.534  -4.741   8.504
   93    HB3  SER  12           HB1      SER  12 -13.129  -5.005   7.810
   94    HG   SER  12           HG       SER  12 -11.269  -6.808   8.806
   95    H    TRP  13           HN       TRP  13 -12.968  -4.455   4.548
   96    HA   TRP  13           HA       TRP  13 -14.416  -6.918   4.101
   97    HB2  TRP  13           HB2      TRP  13 -14.844  -4.377   2.550
   98    HB3  TRP  13           HB1      TRP  13 -16.007  -5.632   2.935
   99    HD1  TRP  13           HD1      TRP  13 -15.318  -5.528   6.157
  100    HE1  TRP  13           HE1      TRP  13 -16.261  -3.585   7.503
  101    HE3  TRP  13           HE3      TRP  13 -16.237  -2.320   2.319
  102    HZ2  TRP  13           HZ2      TRP  13 -17.293  -0.995   6.997
  103    HZ3  TRP  13           HZ3      TRP  13 -17.222  -0.131   2.831
  104    HH2  TRP  13           HH2      TRP  13 -17.735   0.511   5.126
  105    H    CYS  14           HN       CYS  14 -12.396  -7.916   3.165
  106    HA   CYS  14           HA       CYS  14 -12.352  -7.536   0.319
  107    HB2  CYS  14           HB2      CYS  14 -10.790  -5.770   1.220
  108    HB3  CYS  14           HB1      CYS  14  -9.802  -7.066   1.877
  109    H    GLY  15           HN       GLY  15 -11.066  -9.157  -0.711
  110    HA2  GLY  15           HA2      GLY  15 -10.455 -11.471   0.994
  111    HA3  GLY  15           HA1      GLY  15 -11.294 -11.634  -0.548
  112    H    TYR  16           HN       TYR  16  -9.882  -9.826  -2.107
  113    HA   TYR  16           HA       TYR  16  -7.619 -11.425  -2.719
  114    HB2  TYR  16           HB2      TYR  16  -8.868 -10.405  -4.556
  115    HB3  TYR  16           HB1      TYR  16  -8.512  -8.791  -3.939
  116    HD1  TYR  16           HD1      TYR  16  -6.941 -11.831  -5.388
  117    HD2  TYR  16           HD2      TYR  16  -6.492  -7.695  -4.500
  118    HE1  TYR  16           HE1      TYR  16  -4.814 -11.805  -6.597
  119    HE2  TYR  16           HE2      TYR  16  -4.367  -7.665  -5.722
  120    HH   TYR  16           HH       TYR  16  -3.398 -10.119  -7.748
  121    H    CYS  17           HN       CYS  17  -8.041  -8.533  -0.871
  122    HA   CYS  17           HA       CYS  17  -5.574  -7.335  -1.090
  123    HB2  CYS  17           HB2      CYS  17  -7.338  -7.475   1.369
  124    HB3  CYS  17           HB1      CYS  17  -6.028  -6.325   1.122
  125    H    LEU  18           HN       LEU  18  -6.546 -10.120   0.783
  126    HA   LEU  18           HA       LEU  18  -4.488 -10.490   2.569
  127    HB2  LEU  18           HB2      LEU  18  -6.566 -11.769   2.431
  128    HB3  LEU  18           HB1      LEU  18  -5.951 -12.584   1.011
  129    HG   LEU  18           HG       LEU  18  -4.161 -13.588   2.359
  130   HD11  LEU  18          HD11      LEU  18  -5.513 -12.180   4.666
  131   HD12  LEU  18          HD12      LEU  18  -3.899 -11.830   4.044
  132   HD13  LEU  18          HD13      LEU  18  -4.233 -13.380   4.805
  133   HD21  LEU  18          HD21      LEU  18  -5.583 -15.062   3.644
  134   HD22  LEU  18          HD22      LEU  18  -6.306 -14.680   2.063
  135   HD23  LEU  18          HD23      LEU  18  -6.879 -13.864   3.527
  136    H    ARG  19           HN       ARG  19  -4.563 -11.145  -0.889
  137    HA   ARG  19           HA       ARG  19  -2.334 -12.840  -1.147
  138    HB2  ARG  19           HB2      ARG  19  -4.090 -12.316  -2.915
  139    HB3  ARG  19           HB1      ARG  19  -3.305 -10.776  -3.155
  140    HG2  ARG  19           HG2      ARG  19  -1.923 -13.427  -3.628
  141    HG3  ARG  19           HG1      ARG  19  -2.819 -12.568  -4.866
  142    HD2  ARG  19           HD2      ARG  19  -0.430 -11.450  -3.392
  143    HD3  ARG  19           HD1      ARG  19  -0.353 -12.222  -4.972
  144    HE   ARG  19           HE       ARG  19  -2.123 -10.312  -5.468
  145   HH11  ARG  19          HH11      ARG  19   0.981 -10.080  -3.761
  146   HH12  ARG  19          HH12      ARG  19   1.251  -8.467  -4.236
  147   HH21  ARG  19          HH21      ARG  19  -1.721  -8.102  -6.099
  148   HH22  ARG  19          HH22      ARG  19  -0.282  -7.344  -5.605
  149    H    LEU  20           HN       LEU  20  -2.629  -9.348  -1.121
  150    HA   LEU  20           HA       LEU  20   0.176  -9.063  -1.603
  151    HB2  LEU  20           HB2      LEU  20  -1.281  -7.439  -2.620
  152    HB3  LEU  20           HB1      LEU  20  -1.985  -7.027  -1.077
  153    HG   LEU  20           HG       LEU  20   0.366  -6.178  -0.459
  154   HD11  LEU  20          HD11      LEU  20   1.590  -5.228  -2.406
  155   HD12  LEU  20          HD12      LEU  20   0.737  -6.356  -3.443
  156   HD13  LEU  20          HD13      LEU  20   1.812  -6.937  -2.164
  157   HD21  LEU  20          HD21      LEU  20  -0.123  -3.984  -1.473
  158   HD22  LEU  20          HD22      LEU  20  -1.535  -4.735  -0.733
  159   HD23  LEU  20          HD23      LEU  20  -1.346  -4.758  -2.484
  160    H    LYS  21           HN       LYS  21  -2.094  -8.703   1.030
  161    HA   LYS  21           HA       LYS  21  -0.538  -7.460   2.958
  162    HB2  LYS  21           HB2      LYS  21  -2.784  -9.439   3.206
  163    HB3  LYS  21           HB1      LYS  21  -2.017  -8.701   4.606
  164    HG2  LYS  21           HG2      LYS  21  -2.683  -6.505   3.873
  165    HG3  LYS  21           HG1      LYS  21  -3.329  -7.166   2.373
  166    HD2  LYS  21           HD2      LYS  21  -5.074  -6.643   4.032
  167    HD3  LYS  21           HD1      LYS  21  -5.056  -8.353   3.591
  168    HE2  LYS  21           HE2      LYS  21  -5.393  -8.013   6.008
  169    HE3  LYS  21           HE1      LYS  21  -3.898  -8.877   5.677
  170    HZ1  LYS  21           HZ1      LYS  21  -3.648  -7.166   7.367
  171    HZ2  LYS  21           HZ2      LYS  21  -4.078  -5.961   6.274
  172    HZ3  LYS  21           HZ3      LYS  21  -2.661  -6.863   6.050
  173    H    THR  22           HN       THR  22  -0.871 -10.944   2.356
  174    HA   THR  22           HA       THR  22   0.829 -11.687   4.479
  175    HB   THR  22           HB       THR  22   0.880 -13.899   3.260
  176    HG1  THR  22           HG1      THR  22  -1.172 -13.108   1.586
  177   HG21  THR  22          HG21      THR  22  -1.515 -14.351   3.645
  178   HG22  THR  22          HG22      THR  22  -1.815 -12.615   3.715
  179   HG23  THR  22          HG23      THR  22  -0.820 -13.388   4.948
  180    H    ALA  23           HN       ALA  23   1.292 -11.143   1.072
  181    HA   ALA  23           HA       ALA  23   3.951 -12.001   0.757
  182    HB1  ALA  23           HB1      ALA  23   2.343 -11.471  -1.059
  183    HB2  ALA  23           HB2      ALA  23   3.936 -10.762  -1.262
  184    HB3  ALA  23           HB3      ALA  23   2.584  -9.754  -0.714
  185    H    LEU  24           HN       LEU  24   2.691  -8.805   1.568
  186    HA   LEU  24           HA       LEU  24   5.279  -7.654   1.745
  187    HB2  LEU  24           HB2      LEU  24   2.690  -6.702   2.954
  188    HB3  LEU  24           HB1      LEU  24   4.151  -5.748   2.852
  189    HG   LEU  24           HG       LEU  24   2.385  -6.648   0.590
  190   HD11  LEU  24          HD11      LEU  24   1.611  -4.712   1.809
  191   HD12  LEU  24          HD12      LEU  24   2.163  -4.248   0.198
  192   HD13  LEU  24          HD13      LEU  24   3.176  -3.929   1.598
  193   HD21  LEU  24          HD21      LEU  24   4.704  -6.874  -0.134
  194   HD22  LEU  24          HD22      LEU  24   5.048  -5.237   0.427
  195   HD23  LEU  24          HD23      LEU  24   3.936  -5.493  -0.916
  196    H    THR  25           HN       THR  25   3.078  -9.007   4.128
  197    HA   THR  25           HA       THR  25   4.626  -8.344   6.369
  198    HB   THR  25           HB       THR  25   2.612 -10.582   6.002
  199    HG1  THR  25           HG1      THR  25   1.484  -8.818   5.658
  200   HG21  THR  25          HG21      THR  25   3.961 -10.876   8.048
  201   HG22  THR  25          HG22      THR  25   2.307 -10.416   8.450
  202   HG23  THR  25          HG23      THR  25   3.600  -9.220   8.530
  203    H    ALA  26           HN       ALA  26   4.682 -11.160   4.213
  204    HA   ALA  26           HA       ALA  26   6.591 -12.650   5.708
  205    HB1  ALA  26           HB1      ALA  26   5.104 -13.701   4.046
  206    HB2  ALA  26           HB2      ALA  26   6.802 -14.031   3.702
  207    HB3  ALA  26           HB3      ALA  26   5.932 -12.819   2.763
  208    H    ASN  27           HN       ASN  27   6.779 -10.096   3.437
  209    HA   ASN  27           HA       ASN  27   9.653 -10.400   3.117
  210    HB2  ASN  27           HB2      ASN  27   7.539  -8.895   1.760
  211    HB3  ASN  27           HB1      ASN  27   9.149  -8.130   1.744
  212   HD21  ASN  27          HD21      ASN  27   7.133 -10.688   0.636
  213   HD22  ASN  27          HD22      ASN  27   8.252 -11.354  -0.496
  214    H    ARG  28           HN       ARG  28   7.942  -9.418   5.490
  215    HA   ARG  28           HA       ARG  28   8.329  -8.263   7.399
  216    HB2  ARG  28           HB2      ARG  28  11.040  -7.532   6.261
  217    HB3  ARG  28           HB1      ARG  28  10.567  -7.534   7.952
  218    HG2  ARG  28           HG2      ARG  28  10.860  -9.953   6.176
  219    HG3  ARG  28           HG1      ARG  28  11.972  -9.437   7.441
  220    HD2  ARG  28           HD2      ARG  28  10.264  -9.857   9.132
  221    HD3  ARG  28           HD1      ARG  28   9.102 -10.277   7.872
  222    HE   ARG  28           HE       ARG  28  11.300 -11.894   7.496
  223   HH11  ARG  28          HH11      ARG  28   8.816 -11.521  10.033
  224   HH12  ARG  28          HH12      ARG  28   8.928 -13.132  10.531
  225   HH21  ARG  28          HH21      ARG  28  11.378 -14.122   8.204
  226   HH22  ARG  28          HH22      ARG  28  10.415 -14.625   9.497
  227    H    ILE  29           HN       ILE  29   7.267  -6.983   4.955
  228    HA   ILE  29           HA       ILE  29   8.036  -4.210   5.287
  229    HB   ILE  29           HB       ILE  29   6.074  -5.560   3.406
  230   HG12  ILE  29          HG12      ILE  29   8.815  -4.384   2.843
  231   HG13  ILE  29          HG11      ILE  29   8.451  -6.098   2.977
  232   HG21  ILE  29          HG21      ILE  29   6.015  -3.406   2.193
  233   HG22  ILE  29          HG22      ILE  29   6.976  -2.674   3.483
  234   HG23  ILE  29          HG23      ILE  29   5.359  -3.278   3.824
  235   HD11  ILE  29          HD11      ILE  29   7.349  -4.219   0.902
  236   HD12  ILE  29          HD12      ILE  29   7.029  -5.953   1.013
  237   HD13  ILE  29          HD13      ILE  29   8.657  -5.376   0.671
  238    H    ALA  30           HN       ALA  30   6.846  -2.802   6.443
  239    HA   ALA  30           HA       ALA  30   4.422  -3.797   7.728
  240    HB1  ALA  30           HB1      ALA  30   6.183  -3.071   9.240
  241    HB2  ALA  30           HB2      ALA  30   4.796  -1.981   9.342
  242    HB3  ALA  30           HB3      ALA  30   6.235  -1.497   8.450
  243    H    TYR  31           HN       TYR  31   2.560  -2.426   7.781
  244    HA   TYR  31           HA       TYR  31   2.596  -0.109   6.070
  245    HB2  TYR  31           HB2      TYR  31   0.636  -0.973   4.737
  246    HB3  TYR  31           HB1      TYR  31   2.178  -1.737   4.398
  247    HD1  TYR  31           HD2      TYR  31   2.570  -4.083   5.044
  248    HD2  TYR  31           HD1      TYR  31  -1.204  -2.228   5.730
  249    HE1  TYR  31           HE2      TYR  31   1.545  -6.298   5.385
  250    HE2  TYR  31           HE1      TYR  31  -2.227  -4.448   6.059
  251    HH   TYR  31           HH       TYR  31  -0.389  -7.280   6.464
  252    H    ASP  32           HN       ASP  32   1.152   1.399   6.609
  253    HA   ASP  32           HA       ASP  32  -0.528   0.921   8.953
  254    HB2  ASP  32           HB2      ASP  32  -0.723   3.488   7.393
  255    HB3  ASP  32           HB1      ASP  32  -0.849   3.246   9.114
  256    H    GLU  33           HN       GLU  33  -2.469  -0.038   8.480
  257    HA   GLU  33           HA       GLU  33  -3.749   0.449   5.930
  258    HB2  GLU  33           HB2      GLU  33  -4.191  -1.726   6.420
  259    HB3  GLU  33           HB1      GLU  33  -4.183  -1.486   8.183
  260    HG2  GLU  33           HG2      GLU  33  -6.456  -0.563   7.948
  261    HG3  GLU  33           HG1      GLU  33  -6.372  -0.843   6.207
  262    H    VAL  34           HN       VAL  34  -5.258   1.865   5.590
  263    HA   VAL  34           HA       VAL  34  -5.658   3.901   7.555
  264    HB   VAL  34           HB       VAL  34  -6.905   3.752   4.795
  265   HG11  VAL  34          HG11      VAL  34  -6.252   6.143   6.500
  266   HG12  VAL  34          HG12      VAL  34  -7.867   5.480   6.232
  267   HG13  VAL  34          HG13      VAL  34  -6.960   6.172   4.882
  268   HG21  VAL  34          HG21      VAL  34  -4.242   4.892   5.607
  269   HG22  VAL  34          HG22      VAL  34  -4.979   5.035   4.010
  270   HG23  VAL  34          HG23      VAL  34  -4.506   3.451   4.628
  271    H    ASP  35           HN       ASP  35  -7.632   4.780   8.213
  272    HA   ASP  35           HA       ASP  35  -9.503   2.955   9.275
  273    HB2  ASP  35           HB2      ASP  35  -9.443   5.966   9.334
  274    HB3  ASP  35           HB1      ASP  35 -10.680   5.019  10.143
  275    H    ILE  36           HN       ILE  36  -9.475   3.844   6.233
  276    HA   ILE  36           HA       ILE  36 -11.708   5.248   5.426
  277    HB   ILE  36           HB       ILE  36 -11.619   4.119   3.264
  278   HG12  ILE  36          HG12      ILE  36  -9.411   2.454   4.437
  279   HG13  ILE  36          HG11      ILE  36 -11.063   1.864   4.271
  280   HG21  ILE  36          HG21      ILE  36 -10.121   5.964   3.729
  281   HG22  ILE  36          HG22      ILE  36  -9.328   4.763   2.709
  282   HG23  ILE  36          HG23      ILE  36  -8.940   4.851   4.425
  283   HD11  ILE  36          HD11      ILE  36  -9.606   1.128   2.448
  284   HD12  ILE  36          HD12      ILE  36  -9.323   2.833   2.041
  285   HD13  ILE  36          HD13      ILE  36 -10.935   2.144   1.879
  286    H    GLU  37           HN       GLU  37 -11.933   1.936   6.529
  287    HA   GLU  37           HA       GLU  37 -14.395   1.481   5.203
  288    HB2  GLU  37           HB2      GLU  37 -14.717  -0.364   6.812
  289    HB3  GLU  37           HB1      GLU  37 -13.177  -0.395   5.967
  290    HG2  GLU  37           HG2      GLU  37 -12.006   0.307   7.879
  291    HG3  GLU  37           HG1      GLU  37 -13.501   0.672   8.742
  292    H    HIS  38           HN       HIS  38 -13.536   3.129   8.035
  293    HA   HIS  38           HA       HIS  38 -16.368   3.564   8.679
  294    HB2  HIS  38           HB2      HIS  38 -14.846   2.668  10.504
  295    HB3  HIS  38           HB1      HIS  38 -13.942   4.167  10.384
  296    HD1  HIS  38           HD1      HIS  38 -16.903   2.666  12.019
  297    HD2  HIS  38           HD2      HIS  38 -15.430   6.483  11.246
  298    HE1  HIS  38           HE1      HIS  38 -18.114   4.207  13.572
  299    H    ASN  39           HN       ASN  39 -13.234   5.097   8.164
  300    HA   ASN  39           HA       ASN  39 -14.304   7.771   8.268
  301    HB2  ASN  39           HB2      ASN  39 -11.965   7.297   8.931
  302    HB3  ASN  39           HB1      ASN  39 -11.612   6.882   7.259
  303   HD21  ASN  39          HD21      ASN  39 -10.339   8.469   6.632
  304   HD22  ASN  39          HD22      ASN  39 -10.611  10.149   6.782
  305    H    ARG  40           HN       ARG  40 -15.671   8.215   6.720
  306    HA   ARG  40           HA       ARG  40 -15.340   7.318   4.053
  307    HB2  ARG  40           HB2      ARG  40 -17.215   8.822   3.478
  308    HB3  ARG  40           HB1      ARG  40 -17.560   7.770   4.841
  309    HG2  ARG  40           HG2      ARG  40 -17.170   9.582   6.377
  310    HG3  ARG  40           HG1      ARG  40 -16.777  10.664   5.037
  311    HD2  ARG  40           HD2      ARG  40 -19.074  10.984   5.788
  312    HD3  ARG  40           HD1      ARG  40 -19.018  10.365   4.138
  313    HE   ARG  40           HE       ARG  40 -19.264   8.286   6.083
  314   HH11  ARG  40          HH11      ARG  40 -21.165  10.757   4.413
  315   HH12  ARG  40          HH12      ARG  40 -22.569   9.784   4.313
  316   HH21  ARG  40          HH21      ARG  40 -21.222   7.005   6.016
  317   HH22  ARG  40          HH22      ARG  40 -22.609   7.657   5.261
  318    H    ALA  41           HN       ALA  41 -14.091  10.047   5.757
  319    HA   ALA  41           HA       ALA  41 -13.800  11.710   3.519
  320    HB1  ALA  41           HB1      ALA  41 -12.331  13.120   4.864
  321    HB2  ALA  41           HB2      ALA  41 -12.279  11.887   6.131
  322    HB3  ALA  41           HB3      ALA  41 -13.789  12.676   5.726
  323    H    ALA  42           HN       ALA  42 -11.634   9.336   4.842
  324    HA   ALA  42           HA       ALA  42  -9.724   9.956   2.745
  325    HB1  ALA  42           HB1      ALA  42  -9.674   7.732   4.790
  326    HB2  ALA  42           HB2      ALA  42  -8.846   9.282   4.931
  327    HB3  ALA  42           HB3      ALA  42  -8.364   8.134   3.681
  328    H    ALA  43           HN       ALA  43 -12.424   7.936   3.248
  329    HA   ALA  43           HA       ALA  43 -11.781   5.822   1.503
  330    HB1  ALA  43           HB1      ALA  43 -14.512   6.820   2.245
  331    HB2  ALA  43           HB2      ALA  43 -13.520   5.774   3.250
  332    HB3  ALA  43           HB3      ALA  43 -14.094   5.194   1.676
  333    H    GLU  44           HN       GLU  44 -13.297   8.945   1.020
  334    HA   GLU  44           HA       GLU  44 -13.988   8.460  -1.681
  335    HB2  GLU  44           HB2      GLU  44 -13.561  11.065  -0.215
  336    HB3  GLU  44           HB1      GLU  44 -14.202  10.938  -1.848
  337    HG2  GLU  44           HG2      GLU  44 -15.464   9.840   0.656
  338    HG3  GLU  44           HG1      GLU  44 -16.001  11.245  -0.262
  339    H    PHE  45           HN       PHE  45 -11.073   9.501  -0.098
  340    HA   PHE  45           HA       PHE  45  -9.729  10.472  -2.395
  341    HB2  PHE  45           HB2      PHE  45  -8.943  11.055  -0.155
  342    HB3  PHE  45           HB1      PHE  45  -8.632   9.365   0.205
  343    HD1  PHE  45           HD2      PHE  45  -7.628  12.065  -2.162
  344    HD2  PHE  45           HD1      PHE  45  -6.495   8.510  -0.110
  345    HE1  PHE  45           HE2      PHE  45  -5.326  12.322  -2.990
  346    HE2  PHE  45           HE1      PHE  45  -4.195   8.761  -0.936
  347    HZ   PHE  45           HZ       PHE  45  -3.608  10.670  -2.378
  348    H    VAL  46           HN       VAL  46 -10.145   7.324  -0.990
  349    HA   VAL  46           HA       VAL  46  -8.273   5.868  -2.508
  350    HB   VAL  46           HB       VAL  46 -10.969   4.888  -1.500
  351   HG11  VAL  46          HG11      VAL  46  -9.909   3.358  -3.092
  352   HG12  VAL  46          HG12      VAL  46  -9.911   2.677  -1.456
  353   HG13  VAL  46          HG13      VAL  46  -8.440   3.387  -2.119
  354   HG21  VAL  46          HG21      VAL  46  -8.295   4.866  -0.124
  355   HG22  VAL  46          HG22      VAL  46  -9.787   4.155   0.496
  356   HG23  VAL  46          HG23      VAL  46  -9.655   5.906   0.287
  357    H    GLY  47           HN       GLY  47 -11.480   7.032  -3.190
  358    HA2  GLY  47           HA2      GLY  47 -11.853   5.598  -5.625
  359    HA3  GLY  47           HA1      GLY  47 -12.767   7.013  -5.096
  360    H    SER  48           HN       SER  48 -10.716   8.838  -4.792
  361    HA   SER  48           HA       SER  48 -10.452   9.910  -7.323
  362    HB2  SER  48           HB2      SER  48  -8.746  10.451  -4.889
  363    HB3  SER  48           HB1      SER  48  -8.980  11.535  -6.262
  364    HG   SER  48           HG       SER  48 -11.172  11.623  -5.747
  365    H    VAL  49           HN       VAL  49  -8.137   7.937  -5.470
  366    HA   VAL  49           HA       VAL  49  -6.102   8.267  -7.475
  367    HB   VAL  49           HB       VAL  49  -4.729   6.691  -6.171
  368   HG11  VAL  49          HG11      VAL  49  -6.054   8.821  -4.512
  369   HG12  VAL  49          HG12      VAL  49  -4.686   9.038  -5.604
  370   HG13  VAL  49          HG13      VAL  49  -4.506   8.056  -4.149
  371   HG21  VAL  49          HG21      VAL  49  -7.129   6.495  -4.348
  372   HG22  VAL  49          HG22      VAL  49  -5.531   5.831  -4.009
  373   HG23  VAL  49          HG23      VAL  49  -6.485   5.199  -5.355
  374    H    ASN  50           HN       ASN  50  -8.787   6.363  -7.391
  375    HA   ASN  50           HA       ASN  50  -7.481   4.357  -9.073
  376    HB2  ASN  50           HB2      ASN  50  -9.925   4.133  -7.354
  377    HB3  ASN  50           HB1      ASN  50  -9.703   3.052  -8.725
  378   HD21  ASN  50          HD21      ASN  50  -8.629   3.887  -5.534
  379   HD22  ASN  50          HD22      ASN  50  -7.582   2.520  -5.340
  380    H    GLY  51           HN       GLY  51 -10.543   6.187  -8.895
  381    HA2  GLY  51           HA2      GLY  51 -10.725   7.473 -11.098
  382    HA3  GLY  51           HA1      GLY  51 -10.720   5.854 -11.792
  383    H    GLY  52           HN       GLY  52 -12.439   4.484 -11.361
  384    HA2  GLY  52           HA2      GLY  52 -14.897   5.989 -10.825
  385    HA3  GLY  52           HA1      GLY  52 -14.790   4.532 -11.807
  386    H    ASN  53           HN       ASN  53 -13.252   2.966 -10.030
  387    HA   ASN  53           HA       ASN  53 -15.136   2.694  -7.801
  388    HB2  ASN  53           HB2      ASN  53 -14.072   0.470  -9.550
  389    HB3  ASN  53           HB1      ASN  53 -14.845   0.192  -7.999
  390   HD21  ASN  53          HD21      ASN  53 -16.857   2.325  -8.426
  391   HD22  ASN  53          HD22      ASN  53 -17.951   1.716  -9.588
  392    H    ARG  54           HN       ARG  54 -14.346   1.835  -5.940
  393    HA   ARG  54           HA       ARG  54 -11.601   2.423  -5.468
  394    HB2  ARG  54           HB2      ARG  54 -13.933   1.701  -3.758
  395    HB3  ARG  54           HB1      ARG  54 -12.317   1.713  -3.081
  396    HG2  ARG  54           HG2      ARG  54 -12.036   4.026  -3.602
  397    HG3  ARG  54           HG1      ARG  54 -13.510   4.033  -4.561
  398    HD2  ARG  54           HD2      ARG  54 -13.523   3.398  -1.638
  399    HD3  ARG  54           HD1      ARG  54 -13.600   5.053  -2.236
  400    HE   ARG  54           HE       ARG  54 -15.547   3.062  -3.154
  401   HH11  ARG  54          HH11      ARG  54 -14.837   6.086  -1.435
  402   HH12  ARG  54          HH12      ARG  54 -16.433   6.627  -1.339
  403   HH21  ARG  54          HH21      ARG  54 -17.808   3.752  -3.002
  404   HH22  ARG  54          HH22      ARG  54 -18.180   5.231  -2.285
  405    H    THR  55           HN       THR  55 -10.338   0.949  -6.385
  406    HA   THR  55           HA       THR  55 -10.614  -1.860  -6.013
  407    HB   THR  55           HB       THR  55  -8.022  -0.443  -6.604
  408    HG1  THR  55           HG1      THR  55  -8.889   0.434  -8.266
  409   HG21  THR  55          HG21      THR  55  -7.734  -2.364  -8.104
  410   HG22  THR  55          HG22      THR  55  -9.349  -2.943  -7.686
  411   HG23  THR  55          HG23      THR  55  -8.087  -2.901  -6.456
  412    H    VAL  56           HN       VAL  56  -9.962  -2.983  -4.180
  413    HA   VAL  56           HA       VAL  56  -8.737  -1.310  -2.625
  414    HB   VAL  56           HB       VAL  56  -8.977  -2.538  -0.427
  415   HG11  VAL  56          HG11      VAL  56 -10.887  -1.074  -0.089
  416   HG12  VAL  56          HG12      VAL  56 -10.878  -0.749  -1.845
  417   HG13  VAL  56          HG13      VAL  56  -9.445  -0.398  -0.852
  418   HG21  VAL  56          HG21      VAL  56 -11.255  -3.525  -2.105
  419   HG22  VAL  56          HG22      VAL  56 -11.270  -3.392  -0.330
  420   HG23  VAL  56          HG23      VAL  56 -10.059  -4.407  -1.121
  421    HA   PRO  57           HA       PRO  57  -5.521  -2.903  -1.100
  422    HB2  PRO  57           HB2      PRO  57  -3.638  -4.520  -2.243
  423    HB3  PRO  57           HB1      PRO  57  -4.995  -5.091  -1.267
  424    HG2  PRO  57           HG2      PRO  57  -4.798  -4.938  -4.257
  425    HG3  PRO  57           HG1      PRO  57  -5.522  -6.205  -3.252
  426    HD2  PRO  57           HD2      PRO  57  -6.957  -4.188  -4.500
  427    HD3  PRO  57           HD1      PRO  57  -7.467  -5.137  -3.072
  428    H    THR  58           HN       THR  58  -5.257  -0.698  -1.911
  429    HA   THR  58           HA       THR  58  -3.324  -0.180  -4.035
  430    HB   THR  58           HB       THR  58  -5.327   1.686  -2.739
  431    HG1  THR  58           HG1      THR  58  -6.613   0.316  -3.893
  432   HG21  THR  58          HG21      THR  58  -3.769   1.911  -5.320
  433   HG22  THR  58          HG22      THR  58  -3.456   2.865  -3.865
  434   HG23  THR  58          HG23      THR  58  -4.972   3.056  -4.759
  435    H    VAL  59           HN       VAL  59  -1.384   0.439  -3.395
  436    HA   VAL  59           HA       VAL  59  -0.976   1.115  -0.581
  437    HB   VAL  59           HB       VAL  59   0.363  -0.801  -1.526
  438   HG11  VAL  59          HG11      VAL  59   1.450   1.273  -3.296
  439   HG12  VAL  59          HG12      VAL  59   0.568  -0.177  -3.767
  440   HG13  VAL  59          HG13      VAL  59   2.198  -0.306  -3.057
  441   HG21  VAL  59          HG21      VAL  59   1.313   0.461   0.372
  442   HG22  VAL  59          HG22      VAL  59   2.034   1.589  -0.754
  443   HG23  VAL  59          HG23      VAL  59   2.566  -0.082  -0.729
  444    H    LYS  60           HN       LYS  60   0.095   2.971   0.019
  445    HA   LYS  60           HA       LYS  60   0.510   4.976  -2.065
  446    HB2  LYS  60           HB2      LYS  60  -1.478   5.414  -0.682
  447    HB3  LYS  60           HB1      LYS  60  -0.494   5.308   0.772
  448    HG2  LYS  60           HG2      LYS  60  -0.998   7.597   0.228
  449    HG3  LYS  60           HG1      LYS  60   0.738   7.308   0.008
  450    HD2  LYS  60           HD2      LYS  60   0.406   7.139  -2.391
  451    HD3  LYS  60           HD1      LYS  60  -1.338   7.299  -2.166
  452    HE2  LYS  60           HE2      LYS  60  -1.041   9.516  -1.273
  453    HE3  LYS  60           HE1      LYS  60   0.710   9.374  -1.455
  454    HZ1  LYS  60           HZ1      LYS  60  -1.222   9.215  -3.717
  455    HZ2  LYS  60           HZ2      LYS  60   0.454   9.278  -3.835
  456    HZ3  LYS  60           HZ3      LYS  60  -0.396  10.603  -3.269
  457    H    PHE  61           HN       PHE  61   2.538   5.740  -2.069
  458    HA   PHE  61           HA       PHE  61   4.300   5.055   0.159
  459    HB2  PHE  61           HB2      PHE  61   4.942   5.862  -2.699
  460    HB3  PHE  61           HB1      PHE  61   6.131   5.484  -1.463
  461    HD1  PHE  61           HD2      PHE  61   3.573   4.064  -3.718
  462    HD2  PHE  61           HD1      PHE  61   6.603   3.185  -0.849
  463    HE1  PHE  61           HE2      PHE  61   3.533   1.653  -4.352
  464    HE2  PHE  61           HE1      PHE  61   6.548   0.848  -1.508
  465    HZ   PHE  61           HZ       PHE  61   5.011   0.078  -3.247
  466    H    ALA  62           HN       ALA  62   5.616   6.695   1.057
  467    HA   ALA  62           HA       ALA  62   4.435   9.254   1.310
  468    HB1  ALA  62           HB1      ALA  62   6.374   9.810   2.690
  469    HB2  ALA  62           HB2      ALA  62   7.218   8.381   2.092
  470    HB3  ALA  62           HB3      ALA  62   5.772   8.199   3.085
  471    H    ASP  63           HN       ASP  63   6.410   8.009  -1.028
  472    HA   ASP  63           HA       ASP  63   7.860  10.330  -1.873
  473    HB2  ASP  63           HB2      ASP  63   8.613   8.062  -2.307
  474    HB3  ASP  63           HB1      ASP  63   7.182   7.739  -3.266
  475    H    GLY  64           HN       GLY  64   4.643   9.288  -2.134
  476    HA2  GLY  64           HA2      GLY  64   2.997  10.873  -2.870
  477    HA3  GLY  64           HA1      GLY  64   4.086  11.328  -4.177
  478    H    SER  65           HN       SER  65   4.707   8.371  -4.435
  479    HA   SER  65           HA       SER  65   2.971   7.873  -6.568
  480    HB2  SER  65           HB2      SER  65   4.294   5.658  -6.389
  481    HB3  SER  65           HB1      SER  65   5.162   7.149  -6.771
  482    HG   SER  65           HG       SER  65   6.174   5.940  -5.103
  483    H    THR  66           HN       THR  66   1.185   6.579  -6.663
  484    HA   THR  66           HA       THR  66   0.540   4.936  -4.307
  485    HB   THR  66           HB       THR  66  -1.600   5.839  -6.199
  486    HG1  THR  66           HG1      THR  66  -0.603   7.784  -5.824
  487   HG21  THR  66          HG21      THR  66  -1.477   5.577  -3.187
  488   HG22  THR  66          HG22      THR  66  -2.098   4.363  -4.301
  489   HG23  THR  66          HG23      THR  66  -2.928   5.912  -4.130
  490    H    LEU  67           HN       LEU  67   0.061   2.808  -4.870
  491    HA   LEU  67           HA       LEU  67  -0.018   2.156  -7.730
  492    HB2  LEU  67           HB2      LEU  67   1.839   1.063  -5.664
  493    HB3  LEU  67           HB1      LEU  67   1.215  -0.054  -6.851
  494    HG   LEU  67           HG       LEU  67   2.217   1.329  -8.649
  495   HD11  LEU  67          HD11      LEU  67   2.281   3.495  -7.530
  496   HD12  LEU  67          HD12      LEU  67   3.829   3.036  -8.217
  497   HD13  LEU  67          HD13      LEU  67   3.587   2.936  -6.482
  498   HD21  LEU  67          HD21      LEU  67   4.543   0.695  -8.213
  499   HD22  LEU  67          HD22      LEU  67   3.400  -0.589  -7.833
  500   HD23  LEU  67          HD23      LEU  67   4.120   0.361  -6.531
  501    H    THR  68           HN       THR  68  -1.787   1.124  -8.217
  502    HA   THR  68           HA       THR  68  -3.349  -0.123  -6.128
  503    HB   THR  68           HB       THR  68  -3.955   0.213  -9.069
  504    HG1  THR  68           HG1      THR  68  -5.306   1.772  -7.255
  505   HG21  THR  68          HG21      THR  68  -6.278  -0.120  -8.354
  506   HG22  THR  68          HG22      THR  68  -5.729  -0.363  -6.695
  507   HG23  THR  68          HG23      THR  68  -5.275  -1.515  -7.949
  508    H    ASN  69           HN       ASN  69  -2.848  -2.150  -5.666
  509    HA   ASN  69           HA       ASN  69  -2.353  -4.325  -5.799
  510    HB2  ASN  69           HB2      ASN  69  -4.488  -4.471  -6.866
  511    HB3  ASN  69           HB1      ASN  69  -3.795  -4.037  -8.426
  512   HD21  ASN  69          HD21      ASN  69  -4.567  -5.824  -9.399
  513   HD22  ASN  69          HD22      ASN  69  -4.021  -7.431  -9.112
  514    HA   PRO  70           HA       PRO  70   1.341  -4.543  -8.400
  515    HB2  PRO  70           HB2      PRO  70   3.221  -3.664  -6.779
  516    HB3  PRO  70           HB1      PRO  70   2.132  -2.500  -7.540
  517    HG2  PRO  70           HG2      PRO  70   2.167  -3.515  -4.747
  518    HG3  PRO  70           HG1      PRO  70   1.723  -1.898  -5.331
  519    HD2  PRO  70           HD2      PRO  70  -0.024  -4.073  -4.701
  520    HD3  PRO  70           HD1      PRO  70  -0.474  -2.524  -5.447
  521    H    SER  71           HN       SER  71   3.274  -6.023  -7.940
  522    HA   SER  71           HA       SER  71   2.529  -8.095  -6.071
  523    HB2  SER  71           HB2      SER  71   3.527  -8.588  -8.377
  524    HB3  SER  71           HB1      SER  71   5.040  -7.917  -7.758
  525    HG   SER  71           HG       SER  71   5.423  -9.800  -7.063
  526    H    ALA  72           HN       ALA  72   4.290  -8.895  -4.543
  527    HA   ALA  72           HA       ALA  72   4.989  -6.869  -2.720
  528    HB1  ALA  72           HB1      ALA  72   6.113  -9.633  -2.996
  529    HB2  ALA  72           HB2      ALA  72   4.664  -9.170  -2.092
  530    HB3  ALA  72           HB3      ALA  72   6.255  -8.607  -1.562
  531    H    ASP  73           HN       ASP  73   6.735  -8.356  -5.320
  532    HA   ASP  73           HA       ASP  73   9.399  -7.689  -4.874
  533    HB2  ASP  73           HB2      ASP  73   8.051  -7.505  -7.563
  534    HB3  ASP  73           HB1      ASP  73   9.706  -7.983  -7.216
  535    H    GLU  74           HN       GLU  74   6.755  -5.912  -6.261
  536    HA   GLU  74           HA       GLU  74   8.203  -3.683  -7.262
  537    HB2  GLU  74           HB2      GLU  74   5.306  -3.843  -6.487
  538    HB3  GLU  74           HB1      GLU  74   6.017  -2.702  -7.610
  539    HG2  GLU  74           HG2      GLU  74   5.683  -5.672  -7.981
  540    HG3  GLU  74           HG1      GLU  74   4.836  -4.380  -8.827
  541    H    VAL  75           HN       VAL  75   6.125  -4.189  -4.498
  542    HA   VAL  75           HA       VAL  75   6.349  -1.622  -3.409
  543    HB   VAL  75           HB       VAL  75   5.740  -4.205  -1.956
  544   HG11  VAL  75          HG11      VAL  75   5.068  -1.352  -1.241
  545   HG12  VAL  75          HG12      VAL  75   6.262  -2.368  -0.437
  546   HG13  VAL  75          HG13      VAL  75   4.551  -2.787  -0.356
  547   HG21  VAL  75          HG21      VAL  75   4.269  -3.886  -3.863
  548   HG22  VAL  75          HG22      VAL  75   3.885  -2.254  -3.317
  549   HG23  VAL  75          HG23      VAL  75   3.383  -3.645  -2.360
  550    H    LYS  76           HN       LYS  76   8.185  -4.556  -2.839
  551    HA   LYS  76           HA       LYS  76   9.662  -3.670  -0.624
  552    HB2  LYS  76           HB2      LYS  76   9.355  -6.005  -1.333
  553    HB3  LYS  76           HB1      LYS  76  10.389  -5.709  -2.719
  554    HG2  LYS  76           HG2      LYS  76  12.268  -5.313  -1.227
  555    HG3  LYS  76           HG1      LYS  76  11.214  -5.572   0.171
  556    HD2  LYS  76           HD2      LYS  76  10.703  -7.828  -0.671
  557    HD3  LYS  76           HD1      LYS  76  11.827  -7.558  -2.001
  558    HE2  LYS  76           HE2      LYS  76  13.654  -7.328  -0.429
  559    HE3  LYS  76           HE1      LYS  76  12.536  -7.523   0.922
  560    HZ1  LYS  76           HZ1      LYS  76  13.601  -9.604   0.478
  561    HZ2  LYS  76           HZ2      LYS  76  13.175  -9.550  -1.146
  562    HZ3  LYS  76           HZ3      LYS  76  11.977  -9.728   0.035
  563    H    ALA  77           HN       ALA  77  10.275  -3.412  -4.087
  564    HA   ALA  77           HA       ALA  77  12.898  -2.214  -3.685
  565    HB1  ALA  77           HB1      ALA  77  12.445  -3.665  -5.639
  566    HB2  ALA  77           HB2      ALA  77  12.956  -2.048  -6.124
  567    HB3  ALA  77           HB3      ALA  77  11.253  -2.500  -6.210
  568    H    LYS  78           HN       LYS  78   9.653  -1.106  -4.019
  569    HA   LYS  78           HA       LYS  78  10.571   1.567  -4.571
  570    HB2  LYS  78           HB2      LYS  78   7.779   0.599  -3.935
  571    HB3  LYS  78           HB1      LYS  78   8.191   2.246  -4.387
  572    HG2  LYS  78           HG2      LYS  78   8.537  -0.205  -6.108
  573    HG3  LYS  78           HG1      LYS  78   7.279   1.018  -6.277
  574    HD2  LYS  78           HD2      LYS  78   8.949   2.701  -6.824
  575    HD3  LYS  78           HD1      LYS  78  10.248   1.537  -6.562
  576    HE2  LYS  78           HE2      LYS  78   9.351   0.149  -8.370
  577    HE3  LYS  78           HE1      LYS  78   8.091   1.347  -8.657
  578    HZ1  LYS  78           HZ1      LYS  78   9.968   1.534 -10.182
  579    HZ2  LYS  78           HZ2      LYS  78  11.008   1.869  -8.913
  580    HZ3  LYS  78           HZ3      LYS  78   9.763   2.938  -9.291
  581    H    LEU  79           HN       LEU  79   9.447  -0.266  -1.821
  582    HA   LEU  79           HA       LEU  79   9.090   1.716   0.057
  583    HB2  LEU  79           HB2      LEU  79   8.695  -0.803   0.405
  584    HB3  LEU  79           HB1      LEU  79  10.416  -0.948   0.539
  585    HG   LEU  79           HG       LEU  79  10.353   0.510   2.549
  586   HD11  LEU  79          HD11      LEU  79   7.374   0.210   2.249
  587   HD12  LEU  79          HD12      LEU  79   8.288   1.729   2.383
  588   HD13  LEU  79          HD13      LEU  79   8.172   0.639   3.743
  589   HD21  LEU  79          HD21      LEU  79  10.524  -1.893   2.730
  590   HD22  LEU  79          HD22      LEU  79   8.775  -2.049   2.618
  591   HD23  LEU  79          HD23      LEU  79   9.503  -1.266   4.026
  592    H    VAL  80           HN       VAL  80  12.006   0.010  -0.868
  593    HA   VAL  80           HA       VAL  80  13.694   1.272   0.960
  594    HB   VAL  80           HB       VAL  80  15.594   0.377  -0.426
  595   HG11  VAL  80          HG11      VAL  80  14.562  -0.956   1.326
  596   HG12  VAL  80          HG12      VAL  80  15.100  -1.957  -0.020
  597   HG13  VAL  80          HG13      VAL  80  13.388  -1.567   0.162
  598   HG21  VAL  80          HG21      VAL  80  15.059  -1.117  -2.286
  599   HG22  VAL  80          HG22      VAL  80  14.631   0.564  -2.616
  600   HG23  VAL  80          HG23      VAL  80  13.374  -0.593  -2.177
  601    H    LYS  81           HN       LYS  81  12.884   2.198  -2.357
  602    HA   LYS  81           HA       LYS  81  14.872   4.264  -2.326
  603    HB2  LYS  81           HB2      LYS  81  14.037   4.928  -4.542
  604    HB3  LYS  81           HB1      LYS  81  14.323   3.205  -4.453
  605    HG2  LYS  81           HG2      LYS  81  12.281   3.258  -5.605
  606    HG3  LYS  81           HG1      LYS  81  11.787   3.083  -3.936
  607    HD2  LYS  81           HD2      LYS  81  10.392   4.705  -5.043
  608    HD3  LYS  81           HD1      LYS  81  11.366   5.492  -3.808
  609    HE2  LYS  81           HE2      LYS  81  12.873   6.361  -5.502
  610    HE3  LYS  81           HE1      LYS  81  12.011   5.477  -6.760
  611    HZ1  LYS  81           HZ1      LYS  81  10.864   7.666  -5.095
  612    HZ2  LYS  81           HZ2      LYS  81  10.047   6.825  -6.302
  613    HZ3  LYS  81           HZ3      LYS  81  11.348   7.802  -6.699
  614    H    ILE  82           HN       ILE  82  11.575   4.065  -1.352
  615    HA   ILE  82           HA       ILE  82  11.343   6.927  -1.389
  616    HB   ILE  82           HB       ILE  82   9.070   6.698  -0.554
  617   HG12  ILE  82          HG12      ILE  82   8.118   4.277  -0.340
  618   HG13  ILE  82          HG11      ILE  82   9.784   3.801  -0.058
  619   HG21  ILE  82          HG21      ILE  82   9.660   4.621  -2.657
  620   HG22  ILE  82          HG22      ILE  82   9.499   6.336  -2.911
  621   HG23  ILE  82          HG23      ILE  82   8.097   5.409  -2.396
  622   HD11  ILE  82          HD11      ILE  82   8.551   4.038   2.027
  623   HD12  ILE  82          HD12      ILE  82   8.170   5.713   1.628
  624   HD13  ILE  82          HD13      ILE  82   9.842   5.236   1.926
  625    H    ALA  83           HN       ALA  83  12.274   4.498   0.824
  626    HA   ALA  83           HA       ALA  83  12.168   6.142   3.154
  627    HB1  ALA  83           HB1      ALA  83  13.788   3.644   2.608
  628    HB2  ALA  83           HB2      ALA  83  12.171   3.689   3.310
  629    HB3  ALA  83           HB3      ALA  83  13.533   4.383   4.190
  630    H    GLY  84           HN       GLY  84  14.411   5.589   0.567
  631    HA2  GLY  84           HA2      GLY  84  15.739   7.801   0.414
  632    HA3  GLY  84           HA1      GLY  84  16.453   7.180   1.899
  633    H    LEU  85           HN       LEU  85  18.285   6.235   1.596
  634    HA   LEU  85           HA       LEU  85  18.764   4.636  -0.836
  635    HB2  LEU  85           HB2      LEU  85  20.677   6.512   0.589
  636    HB3  LEU  85           HB1      LEU  85  21.101   5.467  -0.751
  637    HG   LEU  85           HG       LEU  85  19.163   7.776  -0.893
  638   HD11  LEU  85          HD11      LEU  85  20.906   8.866  -2.220
  639   HD12  LEU  85          HD12      LEU  85  21.997   7.519  -1.874
  640   HD13  LEU  85          HD13      LEU  85  21.427   8.551  -0.566
  641   HD21  LEU  85          HD21      LEU  85  20.283   5.988  -3.053
  642   HD22  LEU  85          HD22      LEU  85  19.281   7.416  -3.313
  643   HD23  LEU  85          HD23      LEU  85  18.612   6.014  -2.483
  644    H    GLU  86           HN       GLU  86  17.770   4.032   1.654
  645    HA   GLU  86           HA       GLU  86  19.779   3.143   3.502
  646    HB2  GLU  86           HB2      GLU  86  16.880   2.379   3.602
  647    HB3  GLU  86           HB1      GLU  86  17.994   2.653   4.928
  648    HG2  GLU  86           HG2      GLU  86  16.690   4.730   3.176
  649    HG3  GLU  86           HG1      GLU  86  16.404   4.438   4.885
  650    H    HIS  87           HN       HIS  87  17.217   1.599   1.635
  651    HA   HIS  87           HA       HIS  87  16.783  -0.466   0.933
  652    HB2  HIS  87           HB2      HIS  87  18.789   0.134  -0.506
  653    HB3  HIS  87           HB1      HIS  87  19.781  -0.775   0.625
  654    HD1  HIS  87           HD1      HIS  87  17.829  -1.158  -2.435
  655    HD2  HIS  87           HD2      HIS  87  19.095  -3.626   0.661
  656    HE1  HIS  87           HE1      HIS  87  17.613  -3.508  -3.286
  657    H    HIS  88           HN       HIS  88  15.978  -1.072   2.990
  658    HA   HIS  88           HA       HIS  88  17.691  -3.051   4.312
  659    HB2  HIS  88           HB2      HIS  88  15.335  -1.531   5.487
  660    HB3  HIS  88           HB1      HIS  88  16.277  -2.750   6.322
  661    HD1  HIS  88           HD1      HIS  88  15.937   0.746   6.288
  662    HD2  HIS  88           HD2      HIS  88  19.218  -1.803   6.239
  663    HE1  HIS  88           HE1      HIS  88  17.875   2.079   7.178
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1   6.100   8.342  15.088
    2    H2   MET   1           HT2      MET   1   5.544   9.581  16.084
    3    H3   MET   1           HT3      MET   1   6.237   9.935  14.581
    4    HA   MET   1           HA       MET   1   3.795   8.394  14.962
    5    HB2  MET   1           HB2      MET   1   4.207  11.308  14.334
    6    HB3  MET   1           HB1      MET   1   2.744  10.472  13.844
    7    HG2  MET   1           HG2      MET   1   2.395  11.665  15.936
    8    HG3  MET   1           HG1      MET   1   2.252   9.930  16.165
    9    HE1  MET   1           HE1      MET   1   2.419  10.175  18.771
   10    HE2  MET   1           HE2      MET   1   2.513  11.928  18.588
   11    HE3  MET   1           HE3      MET   1   3.683  11.083  19.600
   12    H    VAL   2           HN       VAL   2   2.512   8.571  12.761
   13    HA   VAL   2           HA       VAL   2   2.330   7.808  10.694
   14    HB   VAL   2           HB       VAL   2   5.151   8.861  10.190
   15   HG11  VAL   2          HG11      VAL   2   4.507   8.900   7.825
   16   HG12  VAL   2          HG12      VAL   2   2.949   8.192   8.241
   17   HG13  VAL   2          HG13      VAL   2   4.431   7.266   8.490
   18   HG21  VAL   2          HG21      VAL   2   4.057  10.852   9.246
   19   HG22  VAL   2          HG22      VAL   2   3.669  10.648  10.956
   20   HG23  VAL   2          HG23      VAL   2   2.487  10.207   9.726
   21    H    THR   3           HN       THR   3   5.787   7.217  11.253
   22    HA   THR   3           HA       THR   3   7.027   5.439  11.619
   23    HB   THR   3           HB       THR   3   4.461   3.926  12.180
   24    HG1  THR   3           HG1      THR   3   4.444   5.053  13.965
   25   HG21  THR   3          HG21      THR   3   6.431   2.463  11.861
   26   HG22  THR   3          HG22      THR   3   5.915   2.476  13.550
   27   HG23  THR   3          HG23      THR   3   7.321   3.415  13.048
   28    H    ALA   4           HN       ALA   4   4.284   4.558   9.567
   29    HA   ALA   4           HA       ALA   4   6.059   2.780   8.059
   30    HB1  ALA   4           HB1      ALA   4   3.923   1.833   8.808
   31    HB2  ALA   4           HB2      ALA   4   4.039   1.877   7.049
   32    HB3  ALA   4           HB3      ALA   4   3.064   3.077   7.899
   33    H    ALA   5           HN       ALA   5   6.397   3.022   5.888
   34    HA   ALA   5           HA       ALA   5   5.934   5.683   4.827
   35    HB1  ALA   5           HB1      ALA   5   7.506   5.014   3.067
   36    HB2  ALA   5           HB2      ALA   5   7.535   3.368   3.707
   37    HB3  ALA   5           HB3      ALA   5   8.180   4.695   4.660
   38    H    LEU   6           HN       LEU   6   4.770   2.494   4.573
   39    HA   LEU   6           HA       LEU   6   3.322   2.966   2.079
   40    HB2  LEU   6           HB2      LEU   6   3.538   0.564   3.866
   41    HB3  LEU   6           HB1      LEU   6   2.361   0.668   2.588
   42    HG   LEU   6           HG       LEU   6   4.244   0.805   0.967
   43   HD11  LEU   6          HD11      LEU   6   5.888   0.111   3.390
   44   HD12  LEU   6          HD12      LEU   6   6.000   1.611   2.466
   45   HD13  LEU   6          HD13      LEU   6   6.446   0.070   1.722
   46   HD21  LEU   6          HD21      LEU   6   4.763  -1.561   1.137
   47   HD22  LEU   6          HD22      LEU   6   3.053  -1.229   1.397
   48   HD23  LEU   6          HD23      LEU   6   4.105  -1.580   2.771
   49    H    THR   7           HN       THR   7   1.326   3.683   2.092
   50    HA   THR   7           HA       THR   7  -0.323   3.145   4.444
   51    HB   THR   7           HB       THR   7  -0.620   5.375   2.398
   52    HG1  THR   7           HG1      THR   7   0.909   5.054   4.653
   53   HG21  THR   7          HG21      THR   7  -1.902   4.939   5.113
   54   HG22  THR   7          HG22      THR   7  -2.708   4.736   3.558
   55   HG23  THR   7          HG23      THR   7  -2.160   6.333   4.067
   56    H    ILE   8           HN       ILE   8  -1.586   1.466   3.952
   57    HA   ILE   8           HA       ILE   8  -2.279   1.021   1.128
   58    HB   ILE   8           HB       ILE   8  -1.976  -1.003   3.365
   59   HG12  ILE   8          HG12      ILE   8  -0.387  -0.546   0.837
   60   HG13  ILE   8          HG11      ILE   8   0.156  -0.226   2.481
   61   HG21  ILE   8          HG21      ILE   8  -3.816  -1.618   1.908
   62   HG22  ILE   8          HG22      ILE   8  -2.465  -2.732   1.703
   63   HG23  ILE   8          HG23      ILE   8  -2.780  -1.493   0.483
   64   HD11  ILE   8          HD11      ILE   8  -0.496  -2.915   1.313
   65   HD12  ILE   8          HD12      ILE   8   0.037  -2.615   2.968
   66   HD13  ILE   8          HD13      ILE   8   1.115  -2.270   1.616
   67    H    TYR   9           HN       TYR   9  -4.305   0.864   0.587
   68    HA   TYR   9           HA       TYR   9  -6.242   1.458   2.612
   69    HB2  TYR   9           HB2      TYR   9  -6.482   1.259  -0.399
   70    HB3  TYR   9           HB1      TYR   9  -7.769   1.801   0.671
   71    HD1  TYR   9           HD1      TYR   9  -4.509   2.672  -0.795
   72    HD2  TYR   9           HD2      TYR   9  -7.688   4.027   1.674
   73    HE1  TYR   9           HE1      TYR   9  -3.604   4.948  -0.904
   74    HE2  TYR   9           HE2      TYR   9  -6.792   6.324   1.560
   75    HH   TYR   9           HH       TYR   9  -4.632   7.411   1.147
   76    H    THR  10           HN       THR  10  -7.485  -0.058   3.586
   77    HA   THR  10           HA       THR  10  -7.892  -2.608   2.225
   78    HB   THR  10           HB       THR  10  -7.552  -3.705   4.469
   79    HG1  THR  10           HG1      THR  10  -6.480  -2.574   6.044
   80   HG21  THR  10          HG21      THR  10  -5.823  -3.875   2.710
   81   HG22  THR  10          HG22      THR  10  -5.100  -3.799   4.317
   82   HG23  THR  10          HG23      THR  10  -5.110  -2.367   3.287
   83    H    THR  11           HN       THR  11  -9.378  -3.939   3.798
   84    HA   THR  11           HA       THR  11 -11.344  -2.339   5.202
   85    HB   THR  11           HB       THR  11 -12.060  -4.607   3.276
   86    HG1  THR  11           HG1      THR  11 -11.417  -2.081   2.742
   87   HG21  THR  11          HG21      THR  11 -13.659  -4.217   5.107
   88   HG22  THR  11          HG22      THR  11 -14.357  -3.767   3.551
   89   HG23  THR  11          HG23      THR  11 -13.776  -2.518   4.650
   90    H    SER  12           HN       SER  12 -12.213  -3.650   6.907
   91    HA   SER  12           HA       SER  12 -10.631  -5.489   8.133
   92    HB2  SER  12           HB2      SER  12 -12.801  -6.215   9.276
   93    HB3  SER  12           HB1      SER  12 -12.398  -4.497   9.348
   94    HG   SER  12           HG       SER  12 -13.992  -4.021   7.950
   95    H    TRP  13           HN       TRP  13 -13.229  -6.189   5.820
   96    HA   TRP  13           HA       TRP  13 -12.066  -8.855   5.521
   97    HB2  TRP  13           HB2      TRP  13 -14.187  -9.631   4.635
   98    HB3  TRP  13           HB1      TRP  13 -14.444  -8.900   6.221
   99    HD1  TRP  13           HD1      TRP  13 -15.079  -8.341   2.509
  100    HE1  TRP  13           HE1      TRP  13 -16.898  -6.615   2.226
  101    HE3  TRP  13           HE3      TRP  13 -15.671  -6.998   7.393
  102    HZ2  TRP  13           HZ2      TRP  13 -18.456  -4.908   3.836
  103    HZ3  TRP  13           HZ3      TRP  13 -17.375  -5.305   7.932
  104    HH2  TRP  13           HH2      TRP  13 -18.729  -4.291   6.188
  105    H    CYS  14           HN       CYS  14 -11.049  -9.342   3.708
  106    HA   CYS  14           HA       CYS  14 -11.940  -8.372   1.210
  107    HB2  CYS  14           HB2      CYS  14 -10.545  -6.420   2.026
  108    HB3  CYS  14           HB1      CYS  14  -9.161  -7.511   2.046
  109    H    GLY  15           HN       GLY  15 -11.228  -9.700  -0.411
  110    HA2  GLY  15           HA2      GLY  15  -9.702 -12.020   0.487
  111    HA3  GLY  15           HA1      GLY  15 -10.672 -11.909  -0.979
  112    H    TYR  16           HN       TYR  16  -9.750  -9.671  -2.124
  113    HA   TYR  16           HA       TYR  16  -7.379 -10.680  -3.317
  114    HB2  TYR  16           HB2      TYR  16  -9.166  -9.600  -4.630
  115    HB3  TYR  16           HB1      TYR  16  -8.836  -8.078  -3.814
  116    HD1  TYR  16           HD2      TYR  16  -7.112 -10.676  -5.853
  117    HD2  TYR  16           HD1      TYR  16  -7.410  -6.568  -4.833
  118    HE1  TYR  16           HE2      TYR  16  -5.426 -10.141  -7.553
  119    HE2  TYR  16           HE1      TYR  16  -5.721  -6.019  -6.534
  120    HH   TYR  16           HH       TYR  16  -3.899  -7.104  -7.730
  121    H    CYS  17           HN       CYS  17  -8.080  -8.054  -1.076
  122    HA   CYS  17           HA       CYS  17  -5.666  -6.677  -1.239
  123    HB2  CYS  17           HB2      CYS  17  -7.273  -7.056   1.290
  124    HB3  CYS  17           HB1      CYS  17  -6.228  -5.701   0.886
  125    H    LEU  18           HN       LEU  18  -6.631  -9.546   0.533
  126    HA   LEU  18           HA       LEU  18  -4.531  -9.646   2.394
  127    HB2  LEU  18           HB2      LEU  18  -6.738 -10.761   2.558
  128    HB3  LEU  18           HB1      LEU  18  -6.178 -11.929   1.376
  129    HG   LEU  18           HG       LEU  18  -4.409 -12.650   2.913
  130   HD11  LEU  18          HD11      LEU  18  -5.655 -10.660   4.820
  131   HD12  LEU  18          HD12      LEU  18  -4.022 -10.582   4.144
  132   HD13  LEU  18          HD13      LEU  18  -4.460 -11.878   5.247
  133   HD21  LEU  18          HD21      LEU  18  -6.581 -13.713   2.919
  134   HD22  LEU  18          HD22      LEU  18  -7.116 -12.546   4.137
  135   HD23  LEU  18          HD23      LEU  18  -5.844 -13.717   4.531
  136    H    ARG  19           HN       ARG  19  -4.822 -10.721  -0.883
  137    HA   ARG  19           HA       ARG  19  -2.806 -12.621  -1.191
  138    HB2  ARG  19           HB2      ARG  19  -4.347 -12.037  -2.981
  139    HB3  ARG  19           HB1      ARG  19  -3.719 -10.404  -3.033
  140    HG2  ARG  19           HG2      ARG  19  -1.517 -11.377  -3.779
  141    HG3  ARG  19           HG1      ARG  19  -2.342 -12.933  -3.926
  142    HD2  ARG  19           HD2      ARG  19  -3.926 -11.963  -5.505
  143    HD3  ARG  19           HD1      ARG  19  -3.158 -10.391  -5.334
  144    HE   ARG  19           HE       ARG  19  -1.540 -12.622  -6.314
  145   HH11  ARG  19          HH11      ARG  19  -3.146  -9.512  -7.044
  146   HH12  ARG  19          HH12      ARG  19  -2.423  -9.388  -8.569
  147   HH21  ARG  19          HH21      ARG  19  -0.592 -12.367  -8.418
  148   HH22  ARG  19          HH22      ARG  19  -0.947 -10.997  -9.366
  149    H    LEU  20           HN       LEU  20  -2.594  -9.111  -1.552
  150    HA   LEU  20           HA       LEU  20   0.233  -9.187  -1.871
  151    HB2  LEU  20           HB2      LEU  20  -1.049  -7.540  -3.079
  152    HB3  LEU  20           HB1      LEU  20  -1.747  -6.931  -1.600
  153    HG   LEU  20           HG       LEU  20   0.634  -6.179  -1.000
  154   HD11  LEU  20          HD11      LEU  20   1.053  -6.714  -3.936
  155   HD12  LEU  20          HD12      LEU  20   2.081  -7.251  -2.578
  156   HD13  LEU  20          HD13      LEU  20   1.981  -5.572  -3.008
  157   HD21  LEU  20          HD21      LEU  20  -0.895  -4.923  -3.248
  158   HD22  LEU  20          HD22      LEU  20   0.377  -4.120  -2.317
  159   HD23  LEU  20          HD23      LEU  20  -1.112  -4.635  -1.520
  160    H    LYS  21           HN       LYS  21  -2.066  -8.375   0.610
  161    HA   LYS  21           HA       LYS  21  -0.513  -6.994   2.459
  162    HB2  LYS  21           HB2      LYS  21  -3.050  -7.430   2.328
  163    HB3  LYS  21           HB1      LYS  21  -2.693  -8.905   3.208
  164    HG2  LYS  21           HG2      LYS  21  -1.757  -7.594   5.030
  165    HG3  LYS  21           HG1      LYS  21  -2.117  -6.111   4.146
  166    HD2  LYS  21           HD2      LYS  21  -4.520  -6.840   4.110
  167    HD3  LYS  21           HD1      LYS  21  -4.070  -8.132   5.225
  168    HE2  LYS  21           HE2      LYS  21  -3.780  -5.167   5.696
  169    HE3  LYS  21           HE1      LYS  21  -4.998  -6.220   6.402
  170    HZ1  LYS  21           HZ1      LYS  21  -2.064  -6.477   6.898
  171    HZ2  LYS  21           HZ2      LYS  21  -3.303  -7.355   7.634
  172    HZ3  LYS  21           HZ3      LYS  21  -3.191  -5.693   7.881
  173    H    THR  22           HN       THR  22  -1.079 -10.484   2.129
  174    HA   THR  22           HA       THR  22   0.391 -11.176   4.467
  175    HB   THR  22           HB       THR  22  -0.298 -13.003   2.137
  176    HG1  THR  22           HG1      THR  22  -2.203 -12.074   2.782
  177   HG21  THR  22          HG21      THR  22   1.241 -13.926   3.830
  178   HG22  THR  22          HG22      THR  22  -0.322 -14.745   3.870
  179   HG23  THR  22          HG23      THR  22   0.077 -13.543   5.098
  180    H    ALA  23           HN       ALA  23   1.169 -10.751   1.081
  181    HA   ALA  23           HA       ALA  23   3.669 -12.075   1.014
  182    HB1  ALA  23           HB1      ALA  23   4.055 -10.794  -1.038
  183    HB2  ALA  23           HB2      ALA  23   2.676  -9.766  -0.658
  184    HB3  ALA  23           HB3      ALA  23   2.424 -11.468  -1.025
  185    H    LEU  24           HN       LEU  24   2.697  -8.737   1.512
  186    HA   LEU  24           HA       LEU  24   5.276  -7.651   1.753
  187    HB2  LEU  24           HB2      LEU  24   2.709  -6.639   2.968
  188    HB3  LEU  24           HB1      LEU  24   4.164  -5.703   2.726
  189    HG   LEU  24           HG       LEU  24   2.356  -6.808   0.589
  190   HD11  LEU  24          HD11      LEU  24   2.988  -4.000   1.429
  191   HD12  LEU  24          HD12      LEU  24   1.477  -4.868   1.699
  192   HD13  LEU  24          HD13      LEU  24   1.983  -4.462   0.057
  193   HD21  LEU  24          HD21      LEU  24   4.661  -6.938  -0.172
  194   HD22  LEU  24          HD22      LEU  24   4.920  -5.256   0.293
  195   HD23  LEU  24          HD23      LEU  24   3.804  -5.647  -1.015
  196    H    THR  25           HN       THR  25   2.993  -8.813   4.168
  197    HA   THR  25           HA       THR  25   4.497  -8.192   6.435
  198    HB   THR  25           HB       THR  25   2.576 -10.515   6.083
  199    HG1  THR  25           HG1      THR  25   1.402  -8.705   5.534
  200   HG21  THR  25          HG21      THR  25   3.355  -8.911   8.531
  201   HG22  THR  25          HG22      THR  25   3.881 -10.555   8.181
  202   HG23  THR  25          HG23      THR  25   2.177 -10.222   8.489
  203    H    ALA  26           HN       ALA  26   4.561 -11.021   4.301
  204    HA   ALA  26           HA       ALA  26   6.377 -12.535   5.905
  205    HB1  ALA  26           HB1      ALA  26   4.821 -13.612   4.364
  206    HB2  ALA  26           HB2      ALA  26   6.490 -14.031   3.969
  207    HB3  ALA  26           HB3      ALA  26   5.623 -12.837   3.000
  208    H    ASN  27           HN       ASN  27   6.720 -10.002   3.649
  209    HA   ASN  27           HA       ASN  27   9.538 -10.594   3.106
  210    HB2  ASN  27           HB2      ASN  27   7.460  -9.271   1.635
  211    HB3  ASN  27           HB1      ASN  27   8.704  -8.106   2.002
  212   HD21  ASN  27          HD21      ASN  27   8.009 -11.058   0.313
  213   HD22  ASN  27          HD22      ASN  27   9.442 -11.056  -0.639
  214    H    ARG  28           HN       ARG  28   8.064  -9.423   5.619
  215    HA   ARG  28           HA       ARG  28   8.529  -8.060   7.358
  216    HB2  ARG  28           HB2      ARG  28  11.233  -7.872   6.014
  217    HB3  ARG  28           HB1      ARG  28  10.872  -7.070   7.530
  218    HG2  ARG  28           HG2      ARG  28  10.369  -9.278   8.525
  219    HG3  ARG  28           HG1      ARG  28  10.858 -10.036   7.007
  220    HD2  ARG  28           HD2      ARG  28  13.085  -9.120   7.227
  221    HD3  ARG  28           HD1      ARG  28  12.616  -8.237   8.680
  222    HE   ARG  28           HE       ARG  28  12.157 -11.024   8.929
  223   HH11  ARG  28          HH11      ARG  28  14.788  -8.623   9.123
  224   HH12  ARG  28          HH12      ARG  28  15.725  -9.551  10.199
  225   HH21  ARG  28          HH21      ARG  28  13.480 -12.268  10.399
  226   HH22  ARG  28          HH22      ARG  28  14.962 -11.620  10.965
  227    H    ILE  29           HN       ILE  29   7.335  -6.970   4.921
  228    HA   ILE  29           HA       ILE  29   8.298  -4.225   4.901
  229    HB   ILE  29           HB       ILE  29   6.121  -5.585   3.285
  230   HG12  ILE  29          HG12      ILE  29   8.906  -4.705   2.429
  231   HG13  ILE  29          HG11      ILE  29   8.404  -6.351   2.743
  232   HG21  ILE  29          HG21      ILE  29   7.249  -2.800   3.050
  233   HG22  ILE  29          HG22      ILE  29   5.623  -3.232   3.558
  234   HG23  ILE  29          HG23      ILE  29   6.138  -3.539   1.894
  235   HD11  ILE  29          HD11      ILE  29   7.335  -4.562   0.574
  236   HD12  ILE  29          HD12      ILE  29   6.863  -6.238   0.863
  237   HD13  ILE  29          HD13      ILE  29   8.516  -5.856   0.375
  238    H    ALA  30           HN       ALA  30   7.449  -2.796   6.256
  239    HA   ALA  30           HA       ALA  30   5.023  -3.430   7.698
  240    HB1  ALA  30           HB1      ALA  30   6.959  -2.517   8.909
  241    HB2  ALA  30           HB2      ALA  30   5.548  -1.465   9.031
  242    HB3  ALA  30           HB3      ALA  30   6.863  -1.055   7.926
  243    H    TYR  31           HN       TYR  31   3.180  -2.109   7.663
  244    HA   TYR  31           HA       TYR  31   2.985  -0.004   5.725
  245    HB2  TYR  31           HB2      TYR  31   1.096  -1.117   4.528
  246    HB3  TYR  31           HB1      TYR  31   2.649  -1.895   4.255
  247    HD1  TYR  31           HD1      TYR  31   3.086  -4.129   5.149
  248    HD2  TYR  31           HD2      TYR  31  -0.681  -2.247   5.761
  249    HE1  TYR  31           HE1      TYR  31   2.128  -6.280   5.832
  250    HE2  TYR  31           HE2      TYR  31  -1.646  -4.409   6.446
  251    HH   TYR  31           HH       TYR  31   0.308  -7.146   7.099
  252    H    ASP  32           HN       ASP  32   1.174   1.277   6.091
  253    HA   ASP  32           HA       ASP  32  -0.303   0.561   8.514
  254    HB2  ASP  32           HB2      ASP  32   1.051   2.687   8.566
  255    HB3  ASP  32           HB1      ASP  32   0.029   3.299   7.266
  256    H    GLU  33           HN       GLU  33  -2.286  -0.143   8.095
  257    HA   GLU  33           HA       GLU  33  -3.383   0.431   5.489
  258    HB2  GLU  33           HB2      GLU  33  -5.036  -1.291   5.976
  259    HB3  GLU  33           HB1      GLU  33  -3.405  -1.880   6.198
  260    HG2  GLU  33           HG2      GLU  33  -3.693  -1.612   8.638
  261    HG3  GLU  33           HG1      GLU  33  -5.367  -1.139   8.350
  262    H    VAL  34           HN       VAL  34  -5.440   1.263   5.165
  263    HA   VAL  34           HA       VAL  34  -5.896   3.448   7.033
  264    HB   VAL  34           HB       VAL  34  -7.210   3.197   4.327
  265   HG11  VAL  34          HG11      VAL  34  -6.574   5.593   5.987
  266   HG12  VAL  34          HG12      VAL  34  -8.163   4.861   5.702
  267   HG13  VAL  34          HG13      VAL  34  -7.279   5.598   4.368
  268   HG21  VAL  34          HG21      VAL  34  -5.364   4.503   3.395
  269   HG22  VAL  34          HG22      VAL  34  -4.807   2.940   3.996
  270   HG23  VAL  34          HG23      VAL  34  -4.520   4.402   4.940
  271    H    ASP  35           HN       ASP  35  -7.850   4.139   7.686
  272    HA   ASP  35           HA       ASP  35  -9.713   2.216   8.674
  273    HB2  ASP  35           HB2      ASP  35  -8.761   4.099  10.026
  274    HB3  ASP  35           HB1      ASP  35  -9.672   5.229   9.040
  275    H    ILE  36           HN       ILE  36  -9.705   3.402   5.706
  276    HA   ILE  36           HA       ILE  36 -11.755   5.147   5.102
  277    HB   ILE  36           HB       ILE  36 -11.967   4.219   2.849
  278   HG12  ILE  36          HG12      ILE  36  -9.958   2.130   3.587
  279   HG13  ILE  36          HG11      ILE  36 -11.688   1.793   3.693
  280   HG21  ILE  36          HG21      ILE  36 -10.138   5.728   3.326
  281   HG22  ILE  36          HG22      ILE  36  -9.666   4.532   2.137
  282   HG23  ILE  36          HG23      ILE  36  -9.122   4.372   3.809
  283   HD11  ILE  36          HD11      ILE  36 -11.946   2.215   1.317
  284   HD12  ILE  36          HD12      ILE  36 -10.688   1.014   1.546
  285   HD13  ILE  36          HD13      ILE  36 -10.269   2.699   1.187
  286    H    GLU  37           HN       GLU  37 -12.429   1.819   6.002
  287    HA   GLU  37           HA       GLU  37 -14.999   1.841   4.739
  288    HB2  GLU  37           HB2      GLU  37 -15.383  -0.268   5.828
  289    HB3  GLU  37           HB1      GLU  37 -13.714  -0.208   5.273
  290    HG2  GLU  37           HG2      GLU  37 -13.076   0.444   7.618
  291    HG3  GLU  37           HG1      GLU  37 -14.733   0.071   8.073
  292    H    HIS  38           HN       HIS  38 -13.680   3.015   7.582
  293    HA   HIS  38           HA       HIS  38 -16.286   3.635   8.764
  294    HB2  HIS  38           HB2      HIS  38 -14.851   2.301  10.190
  295    HB3  HIS  38           HB1      HIS  38 -13.510   3.397   9.928
  296    HD1  HIS  38           HD1      HIS  38 -13.111   4.893  11.787
  297    HD2  HIS  38           HD2      HIS  38 -17.077   3.726  11.579
  298    HE1  HIS  38           HE1      HIS  38 -14.248   5.894  13.847
  299    H    ASN  39           HN       ASN  39 -13.190   4.913   7.698
  300    HA   ASN  39           HA       ASN  39 -13.911   7.678   8.341
  301    HB2  ASN  39           HB2      ASN  39 -11.578   6.934   8.656
  302    HB3  ASN  39           HB1      ASN  39 -11.464   6.607   6.931
  303   HD21  ASN  39          HD21      ASN  39 -10.033   8.074   6.326
  304   HD22  ASN  39          HD22      ASN  39 -10.080   9.763   6.584
  305    H    ARG  40           HN       ARG  40 -15.187   8.745   6.962
  306    HA   ARG  40           HA       ARG  40 -15.529   7.865   4.265
  307    HB2  ARG  40           HB2      ARG  40 -17.049   9.756   3.951
  308    HB3  ARG  40           HB1      ARG  40 -17.415   8.904   5.442
  309    HG2  ARG  40           HG2      ARG  40 -16.387  10.647   6.752
  310    HG3  ARG  40           HG1      ARG  40 -15.818  11.456   5.297
  311    HD2  ARG  40           HD2      ARG  40 -18.719  11.002   5.980
  312    HD3  ARG  40           HD1      ARG  40 -17.844  12.493   6.312
  313    HE   ARG  40           HE       ARG  40 -17.667  11.730   3.571
  314   HH11  ARG  40          HH11      ARG  40 -19.870  13.247   5.862
  315   HH12  ARG  40          HH12      ARG  40 -20.622  14.235   4.698
  316   HH21  ARG  40          HH21      ARG  40 -18.673  13.064   2.005
  317   HH22  ARG  40          HH22      ARG  40 -19.919  14.154   2.449
  318    H    ALA  41           HN       ALA  41 -13.499  10.252   5.774
  319    HA   ALA  41           HA       ALA  41 -13.172  11.792   3.448
  320    HB1  ALA  41           HB1      ALA  41 -12.802  12.753   5.656
  321    HB2  ALA  41           HB2      ALA  41 -11.419  13.011   4.596
  322    HB3  ALA  41           HB3      ALA  41 -11.349  11.789   5.855
  323    H    ALA  42           HN       ALA  42 -11.111   9.270   4.763
  324    HA   ALA  42           HA       ALA  42  -9.308   9.569   2.551
  325    HB1  ALA  42           HB1      ALA  42  -9.517   7.297   4.530
  326    HB2  ALA  42           HB2      ALA  42  -8.479   8.713   4.685
  327    HB3  ALA  42           HB3      ALA  42  -8.197   7.552   3.389
  328    H    ALA  43           HN       ALA  43 -12.206   7.791   3.146
  329    HA   ALA  43           HA       ALA  43 -11.947   5.853   1.099
  330    HB1  ALA  43           HB1      ALA  43 -13.583   5.727   2.930
  331    HB2  ALA  43           HB2      ALA  43 -14.358   5.577   1.347
  332    HB3  ALA  43           HB3      ALA  43 -14.445   7.102   2.245
  333    H    GLU  44           HN       GLU  44 -13.343   9.057   1.273
  334    HA   GLU  44           HA       GLU  44 -14.259   9.421  -1.324
  335    HB2  GLU  44           HB2      GLU  44 -14.706  10.879   0.604
  336    HB3  GLU  44           HB1      GLU  44 -13.028  11.370   0.624
  337    HG2  GLU  44           HG2      GLU  44 -13.310  12.452  -1.534
  338    HG3  GLU  44           HG1      GLU  44 -14.994  11.925  -1.573
  339    H    PHE  45           HN       PHE  45 -11.104   9.841   0.126
  340    HA   PHE  45           HA       PHE  45  -9.788  11.038  -2.052
  341    HB2  PHE  45           HB2      PHE  45  -8.937  11.148   0.255
  342    HB3  PHE  45           HB1      PHE  45  -8.629   9.416   0.227
  343    HD1  PHE  45           HD2      PHE  45  -7.606  12.669  -1.144
  344    HD2  PHE  45           HD1      PHE  45  -6.693   8.535  -0.801
  345    HE1  PHE  45           HE2      PHE  45  -5.366  13.103  -2.059
  346    HE2  PHE  45           HE1      PHE  45  -4.452   8.948  -1.726
  347    HZ   PHE  45           HZ       PHE  45  -3.783  11.248  -2.356
  348    H    VAL  46           HN       VAL  46 -10.385   7.681  -1.217
  349    HA   VAL  46           HA       VAL  46  -8.587   6.433  -2.980
  350    HB   VAL  46           HB       VAL  46 -11.339   5.437  -2.129
  351   HG11  VAL  46          HG11      VAL  46 -10.503   4.196  -4.057
  352   HG12  VAL  46          HG12      VAL  46 -10.485   3.188  -2.608
  353   HG13  VAL  46          HG13      VAL  46  -8.985   3.888  -3.213
  354   HG21  VAL  46          HG21      VAL  46 -10.152   4.175  -0.411
  355   HG22  VAL  46          HG22      VAL  46  -9.895   5.912  -0.226
  356   HG23  VAL  46          HG23      VAL  46  -8.631   4.903  -0.924
  357    H    GLY  47           HN       GLY  47 -11.738   7.828  -3.452
  358    HA2  GLY  47           HA2      GLY  47 -12.273   6.897  -6.056
  359    HA3  GLY  47           HA1      GLY  47 -12.972   8.323  -5.302
  360    H    SER  48           HN       SER  48 -10.056   9.259  -4.946
  361    HA   SER  48           HA       SER  48  -9.995  10.704  -7.425
  362    HB2  SER  48           HB2      SER  48  -9.523  11.872  -5.312
  363    HB3  SER  48           HB1      SER  48  -8.137  10.821  -5.033
  364    HG   SER  48           HG       SER  48  -7.643  11.762  -7.363
  365    H    VAL  49           HN       VAL  49  -8.389   7.929  -6.045
  366    HA   VAL  49           HA       VAL  49  -6.437   8.126  -8.191
  367    HB   VAL  49           HB       VAL  49  -5.094   6.365  -7.044
  368   HG11  VAL  49          HG11      VAL  49  -4.294   7.804  -5.220
  369   HG12  VAL  49          HG12      VAL  49  -5.733   8.810  -5.403
  370   HG13  VAL  49          HG13      VAL  49  -4.563   8.698  -6.717
  371   HG21  VAL  49          HG21      VAL  49  -6.834   5.238  -5.754
  372   HG22  VAL  49          HG22      VAL  49  -7.109   6.712  -4.822
  373   HG23  VAL  49          HG23      VAL  49  -5.568   5.864  -4.689
  374    H    ASN  50           HN       ASN  50  -9.174   6.253  -7.287
  375    HA   ASN  50           HA       ASN  50  -8.967   4.985  -9.863
  376    HB2  ASN  50           HB2      ASN  50  -9.523   2.721  -9.038
  377    HB3  ASN  50           HB1      ASN  50  -7.958   3.247  -8.446
  378   HD21  ASN  50          HD21      ASN  50  -7.661   3.445  -6.276
  379   HD22  ASN  50          HD22      ASN  50  -8.832   2.979  -5.098
  380    H    GLY  51           HN       GLY  51 -11.009   4.138 -10.610
  381    HA2  GLY  51           HA2      GLY  51 -13.320   5.005  -9.059
  382    HA3  GLY  51           HA1      GLY  51 -13.075   5.724 -10.649
  383    H    GLY  52           HN       GLY  52 -15.353   4.398 -10.275
  384    HA2  GLY  52           HA2      GLY  52 -16.597   2.872 -11.516
  385    HA3  GLY  52           HA1      GLY  52 -15.095   2.139 -12.087
  386    H    ASN  53           HN       ASN  53 -13.970   0.773 -10.717
  387    HA   ASN  53           HA       ASN  53 -15.601  -0.485  -8.618
  388    HB2  ASN  53           HB2      ASN  53 -13.227  -1.527 -10.198
  389    HB3  ASN  53           HB1      ASN  53 -13.888  -2.351  -8.800
  390   HD21  ASN  53          HD21      ASN  53 -15.803  -3.446  -8.993
  391   HD22  ASN  53          HD22      ASN  53 -16.538  -3.798 -10.508
  392    H    ARG  54           HN       ARG  54 -14.988  -0.015  -6.570
  393    HA   ARG  54           HA       ARG  54 -12.710   1.591  -6.177
  394    HB2  ARG  54           HB2      ARG  54 -14.596   1.807  -4.628
  395    HB3  ARG  54           HB1      ARG  54 -14.381   0.140  -4.105
  396    HG2  ARG  54           HG2      ARG  54 -12.293   0.652  -3.091
  397    HG3  ARG  54           HG1      ARG  54 -12.300   2.276  -3.774
  398    HD2  ARG  54           HD2      ARG  54 -12.943   2.297  -1.427
  399    HD3  ARG  54           HD1      ARG  54 -14.247   2.841  -2.474
  400    HE   ARG  54           HE       ARG  54 -14.433   0.054  -1.883
  401   HH11  ARG  54          HH11      ARG  54 -15.255   3.300  -0.772
  402   HH12  ARG  54          HH12      ARG  54 -16.372   2.805   0.387
  403   HH21  ARG  54          HH21      ARG  54 -16.041  -0.675  -0.346
  404   HH22  ARG  54          HH22      ARG  54 -16.841   0.457   0.653
  405    H    THR  55           HN       THR  55 -10.845   0.915  -6.495
  406    HA   THR  55           HA       THR  55 -10.041  -1.800  -6.112
  407    HB   THR  55           HB       THR  55  -8.332   0.637  -6.649
  408    HG1  THR  55           HG1      THR  55 -10.297  -0.086  -8.112
  409   HG21  THR  55          HG21      THR  55  -8.011  -2.305  -7.231
  410   HG22  THR  55          HG22      THR  55  -7.101  -1.376  -6.038
  411   HG23  THR  55          HG23      THR  55  -6.889  -1.052  -7.761
  412    H    VAL  56           HN       VAL  56  -9.703  -2.467  -4.080
  413    HA   VAL  56           HA       VAL  56  -9.373  -0.505  -2.052
  414    HB   VAL  56           HB       VAL  56  -9.085  -3.423  -1.515
  415   HG11  VAL  56          HG11      VAL  56 -10.022  -1.107   0.161
  416   HG12  VAL  56          HG12      VAL  56  -8.411  -1.758   0.170
  417   HG13  VAL  56          HG13      VAL  56  -9.767  -2.761   0.740
  418   HG21  VAL  56          HG21      VAL  56 -11.430  -3.483  -1.012
  419   HG22  VAL  56          HG22      VAL  56 -11.191  -3.023  -2.721
  420   HG23  VAL  56          HG23      VAL  56 -11.587  -1.793  -1.505
  421    HA   PRO  57           HA       PRO  57  -5.517  -2.652  -1.052
  422    HB2  PRO  57           HB2      PRO  57  -3.970  -4.230  -2.652
  423    HB3  PRO  57           HB1      PRO  57  -5.337  -4.804  -1.682
  424    HG2  PRO  57           HG2      PRO  57  -5.320  -3.944  -4.557
  425    HG3  PRO  57           HG1      PRO  57  -5.963  -5.447  -3.857
  426    HD2  PRO  57           HD2      PRO  57  -7.551  -3.381  -4.399
  427    HD3  PRO  57           HD1      PRO  57  -7.749  -4.448  -2.961
  428    H    THR  58           HN       THR  58  -5.693  -0.371  -2.441
  429    HA   THR  58           HA       THR  58  -3.617   0.286  -4.275
  430    HB   THR  58           HB       THR  58  -5.719   1.847  -2.742
  431    HG1  THR  58           HG1      THR  58  -6.937   0.884  -4.165
  432   HG21  THR  58          HG21      THR  58  -3.847   3.321  -3.459
  433   HG22  THR  58          HG22      THR  58  -5.321   3.654  -4.374
  434   HG23  THR  58          HG23      THR  58  -4.023   2.716  -5.110
  435    H    VAL  59           HN       VAL  59  -1.717   1.314  -3.639
  436    HA   VAL  59           HA       VAL  59  -1.414   1.806  -0.775
  437    HB   VAL  59           HB       VAL  59  -0.177  -0.229  -1.349
  438   HG11  VAL  59          HG11      VAL  59   1.145   1.447  -3.416
  439   HG12  VAL  59          HG12      VAL  59   0.103   0.056  -3.683
  440   HG13  VAL  59          HG13      VAL  59   1.700  -0.161  -2.933
  441   HG21  VAL  59          HG21      VAL  59   2.082   0.404  -0.615
  442   HG22  VAL  59          HG22      VAL  59   0.853   1.250   0.326
  443   HG23  VAL  59          HG23      VAL  59   1.718   2.094  -0.954
  444    H    LYS  60           HN       LYS  60  -0.569   3.648  -0.199
  445    HA   LYS  60           HA       LYS  60   0.484   5.430  -2.275
  446    HB2  LYS  60           HB2      LYS  60  -1.613   6.227  -1.221
  447    HB3  LYS  60           HB1      LYS  60  -0.838   6.124   0.353
  448    HG2  LYS  60           HG2      LYS  60   0.739   7.859  -0.270
  449    HG3  LYS  60           HG1      LYS  60   0.062   7.921  -1.897
  450    HD2  LYS  60           HD2      LYS  60  -0.839   9.754  -0.638
  451    HD3  LYS  60           HD1      LYS  60  -2.114   8.565  -0.899
  452    HE2  LYS  60           HE2      LYS  60  -2.248   9.375   1.362
  453    HE3  LYS  60           HE1      LYS  60  -1.711   7.700   1.402
  454    HZ1  LYS  60           HZ1      LYS  60   0.003  10.097   1.658
  455    HZ2  LYS  60           HZ2      LYS  60   0.595   8.539   1.704
  456    HZ3  LYS  60           HZ3      LYS  60  -0.451   9.103   2.924
  457    H    PHE  61           HN       PHE  61   2.507   6.045  -2.026
  458    HA   PHE  61           HA       PHE  61   3.894   5.211   0.392
  459    HB2  PHE  61           HB2      PHE  61   4.920   5.900  -2.368
  460    HB3  PHE  61           HB1      PHE  61   5.959   5.577  -0.990
  461    HD1  PHE  61           HD1      PHE  61   3.578   4.058  -3.374
  462    HD2  PHE  61           HD2      PHE  61   6.302   3.399  -0.184
  463    HE1  PHE  61           HE1      PHE  61   3.510   1.618  -3.804
  464    HE2  PHE  61           HE2      PHE  61   6.226   1.012  -0.587
  465    HZ   PHE  61           HZ       PHE  61   4.825   0.104  -2.419
  466    H    ALA  62           HN       ALA  62   5.341   6.599   1.381
  467    HA   ALA  62           HA       ALA  62   4.336   9.160   1.903
  468    HB1  ALA  62           HB1      ALA  62   6.191   9.422   3.412
  469    HB2  ALA  62           HB2      ALA  62   7.044   8.083   2.644
  470    HB3  ALA  62           HB3      ALA  62   5.550   7.782   3.531
  471    H    ASP  63           HN       ASP  63   6.279   8.257  -0.681
  472    HA   ASP  63           HA       ASP  63   7.683  10.801  -0.914
  473    HB2  ASP  63           HB2      ASP  63   8.813   9.826  -2.770
  474    HB3  ASP  63           HB1      ASP  63   8.681   8.542  -1.572
  475    H    GLY  64           HN       GLY  64   4.723   9.409  -1.761
  476    HA2  GLY  64           HA2      GLY  64   3.006  10.879  -2.630
  477    HA3  GLY  64           HA1      GLY  64   4.228  11.582  -3.680
  478    H    SER  65           HN       SER  65   4.787   8.299  -3.656
  479    HA   SER  65           HA       SER  65   3.556   8.036  -6.228
  480    HB2  SER  65           HB2      SER  65   5.140   6.060  -4.573
  481    HB3  SER  65           HB1      SER  65   4.584   5.776  -6.218
  482    HG   SER  65           HG       SER  65   6.529   7.591  -5.263
  483    H    THR  66           HN       THR  66   1.587   7.105  -6.621
  484    HA   THR  66           HA       THR  66   0.500   5.393  -4.509
  485    HB   THR  66           HB       THR  66  -1.685   5.786  -5.819
  486    HG1  THR  66           HG1      THR  66  -0.597   6.747  -7.621
  487   HG21  THR  66          HG21      THR  66  -2.193   7.877  -4.659
  488   HG22  THR  66          HG22      THR  66  -0.473   8.156  -4.374
  489   HG23  THR  66          HG23      THR  66  -1.292   6.787  -3.611
  490    H    LEU  67           HN       LEU  67   0.008   3.360  -5.087
  491    HA   LEU  67           HA       LEU  67   0.349   2.635  -7.893
  492    HB2  LEU  67           HB2      LEU  67   1.664   1.383  -5.496
  493    HB3  LEU  67           HB1      LEU  67   1.256   0.378  -6.863
  494    HG   LEU  67           HG       LEU  67   2.709   1.821  -8.287
  495   HD11  LEU  67          HD11      LEU  67   2.744   3.868  -7.083
  496   HD12  LEU  67          HD12      LEU  67   4.377   3.273  -7.330
  497   HD13  LEU  67          HD13      LEU  67   3.628   3.148  -5.745
  498   HD21  LEU  67          HD21      LEU  67   4.057   0.450  -5.969
  499   HD22  LEU  67          HD22      LEU  67   4.849   0.936  -7.463
  500   HD23  LEU  67          HD23      LEU  67   3.564  -0.264  -7.502
  501    H    THR  68           HN       THR  68  -1.404   1.818  -8.643
  502    HA   THR  68           HA       THR  68  -3.404   0.742  -6.824
  503    HB   THR  68           HB       THR  68  -3.660   1.415  -9.779
  504    HG1  THR  68           HG1      THR  68  -3.201   3.385  -8.917
  505   HG21  THR  68          HG21      THR  68  -5.695   1.242  -7.542
  506   HG22  THR  68          HG22      THR  68  -5.451   0.029  -8.797
  507   HG23  THR  68          HG23      THR  68  -6.043   1.636  -9.226
  508    H    ASN  69           HN       ASN  69  -3.345  -1.409  -6.565
  509    HA   ASN  69           HA       ASN  69  -2.825  -3.569  -6.746
  510    HB2  ASN  69           HB2      ASN  69  -3.803  -3.182  -9.574
  511    HB3  ASN  69           HB1      ASN  69  -3.342  -4.744  -8.934
  512   HD21  ASN  69          HD21      ASN  69  -5.827  -4.002  -9.969
  513   HD22  ASN  69          HD22      ASN  69  -7.004  -4.223  -8.730
  514    HA   PRO  70           HA       PRO  70   1.272  -3.404  -8.721
  515    HB2  PRO  70           HB2      PRO  70   2.828  -2.873  -6.686
  516    HB3  PRO  70           HB1      PRO  70   1.832  -1.573  -7.364
  517    HG2  PRO  70           HG2      PRO  70   1.362  -3.240  -4.923
  518    HG3  PRO  70           HG1      PRO  70   1.177  -1.479  -5.108
  519    HD2  PRO  70           HD2      PRO  70  -0.900  -3.336  -5.294
  520    HD3  PRO  70           HD1      PRO  70  -0.926  -1.701  -5.981
  521    H    SER  71           HN       SER  71   3.102  -4.884  -8.265
  522    HA   SER  71           HA       SER  71   2.304  -7.264  -6.809
  523    HB2  SER  71           HB2      SER  71   3.382  -7.433  -9.102
  524    HB3  SER  71           HB1      SER  71   4.829  -6.707  -8.389
  525    HG   SER  71           HG       SER  71   5.328  -8.745  -8.058
  526    H    ALA  72           HN       ALA  72   3.889  -8.163  -5.272
  527    HA   ALA  72           HA       ALA  72   4.677  -6.364  -3.268
  528    HB1  ALA  72           HB1      ALA  72   5.827  -8.282  -2.266
  529    HB2  ALA  72           HB2      ALA  72   5.686  -9.137  -3.808
  530    HB3  ALA  72           HB3      ALA  72   4.234  -8.745  -2.888
  531    H    ASP  73           HN       ASP  73   6.287  -7.616  -6.022
  532    HA   ASP  73           HA       ASP  73   8.987  -7.062  -5.593
  533    HB2  ASP  73           HB2      ASP  73   7.440  -6.728  -8.169
  534    HB3  ASP  73           HB1      ASP  73   9.183  -6.854  -8.036
  535    H    GLU  74           HN       GLU  74   6.464  -5.051  -6.971
  536    HA   GLU  74           HA       GLU  74   8.014  -2.764  -7.518
  537    HB2  GLU  74           HB2      GLU  74   5.050  -3.064  -7.068
  538    HB3  GLU  74           HB1      GLU  74   5.831  -1.645  -7.749
  539    HG2  GLU  74           HG2      GLU  74   5.865  -4.401  -8.939
  540    HG3  GLU  74           HG1      GLU  74   4.839  -3.061  -9.459
  541    H    VAL  75           HN       VAL  75   5.960  -3.717  -4.862
  542    HA   VAL  75           HA       VAL  75   6.036  -1.319  -3.409
  543    HB   VAL  75           HB       VAL  75   5.671  -4.154  -2.397
  544   HG11  VAL  75          HG11      VAL  75   4.567  -3.137  -0.476
  545   HG12  VAL  75          HG12      VAL  75   4.970  -1.532  -1.087
  546   HG13  VAL  75          HG13      VAL  75   6.254  -2.633  -0.587
  547   HG21  VAL  75          HG21      VAL  75   4.016  -3.558  -4.072
  548   HG22  VAL  75          HG22      VAL  75   3.643  -2.069  -3.203
  549   HG23  VAL  75          HG23      VAL  75   3.267  -3.631  -2.477
  550    H    LYS  76           HN       LYS  76   7.954  -4.271  -3.127
  551    HA   LYS  76           HA       LYS  76   9.634  -3.456  -1.050
  552    HB2  LYS  76           HB2      LYS  76   9.354  -5.764  -1.763
  553    HB3  LYS  76           HB1      LYS  76  10.129  -5.419  -3.308
  554    HG2  LYS  76           HG2      LYS  76  12.204  -4.919  -2.063
  555    HG3  LYS  76           HG1      LYS  76  11.401  -5.430  -0.567
  556    HD2  LYS  76           HD2      LYS  76  10.965  -7.631  -1.669
  557    HD3  LYS  76           HD1      LYS  76  11.933  -7.087  -3.037
  558    HE2  LYS  76           HE2      LYS  76  13.370  -8.410  -1.686
  559    HE3  LYS  76           HE1      LYS  76  13.820  -6.735  -1.409
  560    HZ1  LYS  76           HZ1      LYS  76  12.014  -8.265   0.373
  561    HZ2  LYS  76           HZ2      LYS  76  12.671  -6.744   0.692
  562    HZ3  LYS  76           HZ3      LYS  76  13.658  -8.101   0.638
  563    H    ALA  77           HN       ALA  77   9.979  -3.188  -4.572
  564    HA   ALA  77           HA       ALA  77  12.595  -2.072  -4.577
  565    HB1  ALA  77           HB1      ALA  77  10.424  -1.866  -6.663
  566    HB2  ALA  77           HB2      ALA  77  11.626  -3.156  -6.546
  567    HB3  ALA  77           HB3      ALA  77  12.131  -1.504  -6.905
  568    H    LYS  78           HN       LYS  78   9.378  -0.606  -4.571
  569    HA   LYS  78           HA       LYS  78  10.238   2.081  -4.818
  570    HB2  LYS  78           HB2      LYS  78   7.873   1.428  -5.203
  571    HB3  LYS  78           HB1      LYS  78   7.744   0.939  -3.524
  572    HG2  LYS  78           HG2      LYS  78   6.653   3.027  -3.811
  573    HG3  LYS  78           HG1      LYS  78   8.078   3.242  -2.811
  574    HD2  LYS  78           HD2      LYS  78   7.888   5.094  -4.345
  575    HD3  LYS  78           HD1      LYS  78   9.272   4.113  -4.823
  576    HE2  LYS  78           HE2      LYS  78   8.008   3.117  -6.613
  577    HE3  LYS  78           HE1      LYS  78   6.530   3.897  -6.058
  578    HZ1  LYS  78           HZ1      LYS  78   7.615   5.050  -7.970
  579    HZ2  LYS  78           HZ2      LYS  78   8.917   5.411  -6.966
  580    HZ3  LYS  78           HZ3      LYS  78   7.395   6.011  -6.616
  581    H    LEU  79           HN       LEU  79   9.554  -0.005  -2.054
  582    HA   LEU  79           HA       LEU  79   9.807   1.900  -0.086
  583    HB2  LEU  79           HB2      LEU  79   8.948  -0.548   0.201
  584    HB3  LEU  79           HB1      LEU  79  10.609  -0.962   0.164
  585    HG   LEU  79           HG       LEU  79  11.080   0.169   2.206
  586   HD11  LEU  79          HD11      LEU  79   9.649   2.056   2.355
  587   HD12  LEU  79          HD12      LEU  79   9.203   0.967   3.654
  588   HD13  LEU  79          HD13      LEU  79   8.214   1.035   2.213
  589   HD21  LEU  79          HD21      LEU  79   8.704  -1.639   2.359
  590   HD22  LEU  79          HD22      LEU  79   9.767  -1.256   3.714
  591   HD23  LEU  79          HD23      LEU  79  10.396  -2.129   2.315
  592    H    VAL  80           HN       VAL  80  12.227  -0.342  -1.382
  593    HA   VAL  80           HA       VAL  80  14.267   0.566   0.325
  594    HB   VAL  80           HB       VAL  80  15.861  -0.669  -1.137
  595   HG11  VAL  80          HG11      VAL  80  14.768  -1.809   0.683
  596   HG12  VAL  80          HG12      VAL  80  14.948  -2.897  -0.689
  597   HG13  VAL  80          HG13      VAL  80  13.379  -2.156  -0.339
  598   HG21  VAL  80          HG21      VAL  80  14.830  -0.331  -3.283
  599   HG22  VAL  80          HG22      VAL  80  13.406  -1.205  -2.716
  600   HG23  VAL  80          HG23      VAL  80  14.937  -2.071  -2.937
  601    H    LYS  81           HN       LYS  81  13.206   1.776  -2.759
  602    HA   LYS  81           HA       LYS  81  15.646   3.261  -3.088
  603    HB2  LYS  81           HB2      LYS  81  14.711   4.251  -5.065
  604    HB3  LYS  81           HB1      LYS  81  14.354   2.538  -5.080
  605    HG2  LYS  81           HG2      LYS  81  12.077   3.016  -4.344
  606    HG3  LYS  81           HG1      LYS  81  12.444   4.740  -4.349
  607    HD2  LYS  81           HD2      LYS  81  12.620   2.937  -6.760
  608    HD3  LYS  81           HD1      LYS  81  11.253   3.986  -6.394
  609    HE2  LYS  81           HE2      LYS  81  14.086   4.969  -6.839
  610    HE3  LYS  81           HE1      LYS  81  12.843   4.920  -8.078
  611    HZ1  LYS  81           HZ1      LYS  81  11.509   6.427  -6.748
  612    HZ2  LYS  81           HZ2      LYS  81  12.985   7.101  -7.134
  613    HZ3  LYS  81           HZ3      LYS  81  12.719   6.542  -5.572
  614    H    ILE  82           HN       ILE  82  12.455   3.905  -1.762
  615    HA   ILE  82           HA       ILE  82  13.151   6.671  -1.541
  616    HB   ILE  82           HB       ILE  82  10.953   7.062  -0.461
  617   HG12  ILE  82          HG12      ILE  82   9.217   5.143  -0.736
  618   HG13  ILE  82          HG11      ILE  82  10.603   4.070  -0.775
  619   HG21  ILE  82          HG21      ILE  82  10.859   5.591  -3.071
  620   HG22  ILE  82          HG22      ILE  82  11.165   7.309  -2.816
  621   HG23  ILE  82          HG23      ILE  82   9.583   6.633  -2.442
  622   HD11  ILE  82          HD11      ILE  82  11.217   4.798   1.477
  623   HD12  ILE  82          HD12      ILE  82   9.579   4.138   1.421
  624   HD13  ILE  82          HD13      ILE  82   9.824   5.883   1.498
  625    H    ALA  83           HN       ALA  83  13.372   3.915   0.428
  626    HA   ALA  83           HA       ALA  83  13.873   5.481   2.805
  627    HB1  ALA  83           HB1      ALA  83  14.437   3.334   3.853
  628    HB2  ALA  83           HB2      ALA  83  14.340   2.539   2.281
  629    HB3  ALA  83           HB3      ALA  83  12.891   3.235   3.006
  630    H    GLY  84           HN       GLY  84  15.657   3.951   0.234
  631    HA2  GLY  84           HA2      GLY  84  17.768   4.502  -0.530
  632    HA3  GLY  84           HA1      GLY  84  18.030   5.452   0.929
  633    H    LEU  85           HN       LEU  85  17.847   3.978   2.910
  634    HA   LEU  85           HA       LEU  85  19.391   1.510   2.584
  635    HB2  LEU  85           HB2      LEU  85  19.954   3.762   4.543
  636    HB3  LEU  85           HB1      LEU  85  20.757   2.209   4.544
  637    HG   LEU  85           HG       LEU  85  20.961   4.268   2.343
  638   HD11  LEU  85          HD11      LEU  85  23.248   4.568   3.148
  639   HD12  LEU  85          HD12      LEU  85  22.918   3.472   4.488
  640   HD13  LEU  85          HD13      LEU  85  22.060   5.008   4.372
  641   HD21  LEU  85          HD21      LEU  85  22.425   1.653   2.747
  642   HD22  LEU  85          HD22      LEU  85  22.775   2.843   1.496
  643   HD23  LEU  85          HD23      LEU  85  21.232   1.990   1.494
  644    H    GLU  86           HN       GLU  86  19.544   1.291   5.500
  645    HA   GLU  86           HA       GLU  86  18.457   0.670   7.331
  646    HB2  GLU  86           HB2      GLU  86  17.317   2.902   7.184
  647    HB3  GLU  86           HB1      GLU  86  16.030   2.142   6.266
  648    HG2  GLU  86           HG2      GLU  86  15.378   2.427   8.582
  649    HG3  GLU  86           HG1      GLU  86  15.506   0.715   8.177
  650    H    HIS  87           HN       HIS  87  15.760   0.552   5.046
  651    HA   HIS  87           HA       HIS  87  15.183  -2.185   5.856
  652    HB2  HIS  87           HB2      HIS  87  13.424  -0.398   5.174
  653    HB3  HIS  87           HB1      HIS  87  13.947  -0.711   3.522
  654    HD1  HIS  87           HD1      HIS  87  11.700  -2.007   6.143
  655    HD2  HIS  87           HD2      HIS  87  13.389  -3.380   2.603
  656    HE1  HIS  87           HE1      HIS  87  10.432  -4.078   5.521
  657    H    HIS  88           HN       HIS  88  16.799  -0.447   3.458
  658    HA   HIS  88           HA       HIS  88  17.278  -2.720   1.724
  659    HB2  HIS  88           HB2      HIS  88  16.742  -0.567   0.669
  660    HB3  HIS  88           HB1      HIS  88  18.025   0.216   1.560
  661    HD1  HIS  88           HD1      HIS  88  19.736   0.846  -0.094
  662    HD2  HIS  88           HD2      HIS  88  18.222  -2.939  -0.842
  663    HE1  HIS  88           HE1      HIS  88  21.063  -0.059  -2.043
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1   2.752   5.078   6.267
    2    H2   MET   1           HT2      MET   1   1.114   5.177   6.599
    3    H3   MET   1           HT3      MET   1   2.225   4.898   7.854
    4    HA   MET   1           HA       MET   1   2.124   7.253   6.104
    5    HB2  MET   1           HB2      MET   1   1.294   8.533   8.147
    6    HB3  MET   1           HB1      MET   1   0.133   7.511   7.336
    7    HG2  MET   1           HG2      MET   1   0.475   5.796   9.109
    8    HG3  MET   1           HG1      MET   1   1.561   6.896   9.939
    9    HE1  MET   1           HE1      MET   1  -0.850   9.832  10.917
   10    HE2  MET   1           HE2      MET   1   0.027   9.728   9.393
   11    HE3  MET   1           HE3      MET   1   0.820   9.258  10.895
   12    H    VAL   2           HN       VAL   2   3.122   6.962   9.519
   13    HA   VAL   2           HA       VAL   2   5.748   7.959   8.675
   14    HB   VAL   2           HB       VAL   2   4.205   8.803  11.149
   15   HG11  VAL   2          HG11      VAL   2   6.891   9.712  10.129
   16   HG12  VAL   2          HG12      VAL   2   6.597   8.634  11.486
   17   HG13  VAL   2          HG13      VAL   2   6.064  10.323  11.576
   18   HG21  VAL   2          HG21      VAL   2   4.149  11.043  10.134
   19   HG22  VAL   2          HG22      VAL   2   3.299   9.848   9.147
   20   HG23  VAL   2          HG23      VAL   2   4.911  10.387   8.682
   21    H    THR   3           HN       THR   3   3.756   6.357  11.139
   22    HA   THR   3           HA       THR   3   5.649   5.334  12.778
   23    HB   THR   3           HB       THR   3   3.654   3.581  12.902
   24    HG1  THR   3           HG1      THR   3   2.323   4.061  11.296
   25   HG21  THR   3          HG21      THR   3   2.462   5.181  14.321
   26   HG22  THR   3          HG22      THR   3   3.371   6.504  13.600
   27   HG23  THR   3          HG23      THR   3   4.201   5.305  14.592
   28    H    ALA   4           HN       ALA   4   4.166   3.982   9.832
   29    HA   ALA   4           HA       ALA   4   6.618   2.487   9.499
   30    HB1  ALA   4           HB1      ALA   4   5.304   0.873   8.137
   31    HB2  ALA   4           HB2      ALA   4   3.833   1.754   8.549
   32    HB3  ALA   4           HB3      ALA   4   4.747   0.924   9.809
   33    H    ALA   5           HN       ALA   5   7.411   2.531   7.351
   34    HA   ALA   5           HA       ALA   5   7.265   5.087   6.240
   35    HB1  ALA   5           HB1      ALA   5   8.430   2.603   5.007
   36    HB2  ALA   5           HB2      ALA   5   9.259   3.697   6.113
   37    HB3  ALA   5           HB3      ALA   5   8.765   4.259   4.516
   38    H    LEU   6           HN       LEU   6   5.248   2.391   5.595
   39    HA   LEU   6           HA       LEU   6   4.523   3.524   2.985
   40    HB2  LEU   6           HB2      LEU   6   5.395   1.133   3.200
   41    HB3  LEU   6           HB1      LEU   6   3.857   0.777   3.963
   42    HG   LEU   6           HG       LEU   6   2.711   1.432   1.936
   43   HD11  LEU   6          HD11      LEU   6   4.081   1.734  -0.082
   44   HD12  LEU   6          HD12      LEU   6   5.523   1.781   0.943
   45   HD13  LEU   6          HD13      LEU   6   4.289   3.037   1.085
   46   HD21  LEU   6          HD21      LEU   6   4.901  -0.621   1.632
   47   HD22  LEU   6          HD22      LEU   6   3.474  -0.496   0.610
   48   HD23  LEU   6          HD23      LEU   6   3.296  -0.895   2.314
   49    H    THR   7           HN       THR   7   2.317   3.761   2.442
   50    HA   THR   7           HA       THR   7   0.377   3.543   4.630
   51    HB   THR   7           HB       THR   7   0.575   5.563   2.380
   52    HG1  THR   7           HG1      THR   7   0.513   6.954   4.379
   53   HG21  THR   7          HG21      THR   7  -1.776   4.998   2.769
   54   HG22  THR   7          HG22      THR   7  -1.444   6.623   3.351
   55   HG23  THR   7          HG23      THR   7  -1.593   5.290   4.492
   56    H    ILE   8           HN       ILE   8  -1.103   1.992   4.186
   57    HA   ILE   8           HA       ILE   8  -1.733   1.486   1.369
   58    HB   ILE   8           HB       ILE   8  -1.595  -0.534   3.623
   59   HG12  ILE   8          HG12      ILE   8  -0.061  -0.287   1.032
   60   HG13  ILE   8          HG11      ILE   8   0.578  -0.027   2.650
   61   HG21  ILE   8          HG21      ILE   8  -2.549  -0.956   0.788
   62   HG22  ILE   8          HG22      ILE   8  -3.535  -0.970   2.249
   63   HG23  ILE   8          HG23      ILE   8  -2.314  -2.223   2.003
   64   HD11  ILE   8          HD11      ILE   8   1.253  -2.185   1.774
   65   HD12  ILE   8          HD12      ILE   8  -0.434  -2.643   1.545
   66   HD13  ILE   8          HD13      ILE   8   0.194  -2.393   3.167
   67    H    TYR   9           HN       TYR   9  -3.751   1.639   0.804
   68    HA   TYR   9           HA       TYR   9  -5.793   2.044   2.836
   69    HB2  TYR   9           HB2      TYR   9  -5.817   2.381  -0.181
   70    HB3  TYR   9           HB1      TYR   9  -7.174   2.751   0.864
   71    HD1  TYR   9           HD2      TYR   9  -7.080   4.705   2.363
   72    HD2  TYR   9           HD1      TYR   9  -3.931   3.890  -0.369
   73    HE1  TYR   9           HE2      TYR   9  -6.244   7.000   2.654
   74    HE2  TYR   9           HE1      TYR   9  -3.081   6.176  -0.078
   75    HH   TYR   9           HH       TYR   9  -4.190   8.480   0.639
   76    H    THR  10           HN       THR  10  -7.217   0.385   3.332
   77    HA   THR  10           HA       THR  10  -7.732  -1.680   1.402
   78    HB   THR  10           HB       THR  10  -7.316  -3.439   3.254
   79    HG1  THR  10           HG1      THR  10  -6.656  -1.584   4.713
   80   HG21  THR  10          HG21      THR  10  -6.067  -3.488   1.180
   81   HG22  THR  10          HG22      THR  10  -4.964  -3.777   2.543
   82   HG23  THR  10          HG23      THR  10  -5.022  -2.197   1.773
   83    H    THR  11           HN       THR  11  -9.233  -3.390   2.487
   84    HA   THR  11           HA       THR  11 -10.950  -2.220   4.514
   85    HB   THR  11           HB       THR  11 -11.906  -3.787   2.029
   86    HG1  THR  11           HG1      THR  11 -11.160  -1.252   2.310
   87   HG21  THR  11          HG21      THR  11 -14.099  -3.026   2.724
   88   HG22  THR  11          HG22      THR  11 -13.389  -2.154   4.082
   89   HG23  THR  11          HG23      THR  11 -13.340  -3.915   4.043
   90    H    SER  12           HN       SER  12 -11.815  -3.961   5.931
   91    HA   SER  12           HA       SER  12  -9.996  -6.149   6.191
   92    HB2  SER  12           HB2      SER  12 -11.506  -6.903   8.025
   93    HB3  SER  12           HB1      SER  12 -11.091  -5.198   8.183
   94    HG   SER  12           HG       SER  12 -13.099  -4.681   7.247
   95    H    TRP  13           HN       TRP  13 -13.061  -5.650   4.769
   96    HA   TRP  13           HA       TRP  13 -13.286  -8.399   3.723
   97    HB2  TRP  13           HB2      TRP  13 -15.523  -7.873   3.782
   98    HB3  TRP  13           HB1      TRP  13 -15.148  -6.285   4.414
   99    HD1  TRP  13           HD1      TRP  13 -14.975  -7.954   0.996
  100    HE1  TRP  13           HE1      TRP  13 -15.745  -6.442  -0.677
  101    HE3  TRP  13           HE3      TRP  13 -16.318  -4.141   4.098
  102    HZ2  TRP  13           HZ2      TRP  13 -17.029  -3.788  -0.817
  103    HZ3  TRP  13           HZ3      TRP  13 -17.368  -2.148   3.104
  104    HH2  TRP  13           HH2      TRP  13 -17.716  -1.980   0.692
  105    H    CYS  14           HN       CYS  14 -11.785  -8.925   2.626
  106    HA   CYS  14           HA       CYS  14 -11.565  -7.890  -0.034
  107    HB2  CYS  14           HB2      CYS  14  -9.371  -7.491   1.978
  108    HB3  CYS  14           HB1      CYS  14  -9.001  -7.843   0.299
  109    H    GLY  15           HN       GLY  15 -10.447  -9.415  -1.338
  110    HA2  GLY  15           HA2      GLY  15  -9.390 -11.777   0.072
  111    HA3  GLY  15           HA1      GLY  15 -10.009 -11.800  -1.589
  112    H    TYR  16           HN       TYR  16  -8.962 -10.132  -2.972
  113    HA   TYR  16           HA       TYR  16  -6.294 -10.608  -3.374
  114    HB2  TYR  16           HB2      TYR  16  -6.333  -8.781  -5.036
  115    HB3  TYR  16           HB1      TYR  16  -7.732  -9.824  -5.173
  116    HD1  TYR  16           HD2      TYR  16  -9.613  -8.665  -3.188
  117    HD2  TYR  16           HD1      TYR  16  -6.953  -6.686  -5.851
  118    HE1  TYR  16           HE2      TYR  16 -11.056  -6.717  -3.151
  119    HE2  TYR  16           HE1      TYR  16  -8.424  -4.710  -5.824
  120    HH   TYR  16           HH       TYR  16 -11.074  -4.487  -3.568
  121    H    CYS  17           HN       CYS  17  -7.674  -8.070  -1.374
  122    HA   CYS  17           HA       CYS  17  -5.321  -6.538  -1.059
  123    HB2  CYS  17           HB2      CYS  17  -7.374  -6.972   1.113
  124    HB3  CYS  17           HB1      CYS  17  -6.276  -5.638   0.960
  125    H    LEU  18           HN       LEU  18  -6.659  -9.329   0.681
  126    HA   LEU  18           HA       LEU  18  -4.853  -9.428   2.822
  127    HB2  LEU  18           HB2      LEU  18  -6.457 -11.575   1.517
  128    HB3  LEU  18           HB1      LEU  18  -5.615 -11.758   3.045
  129    HG   LEU  18           HG       LEU  18  -7.967  -9.960   2.462
  130   HD11  LEU  18          HD11      LEU  18  -7.566 -12.295   4.264
  131   HD12  LEU  18          HD12      LEU  18  -8.452 -12.306   2.733
  132   HD13  LEU  18          HD13      LEU  18  -9.064 -11.366   4.111
  133   HD21  LEU  18          HD21      LEU  18  -6.438  -8.811   3.996
  134   HD22  LEU  18          HD22      LEU  18  -6.375 -10.249   5.013
  135   HD23  LEU  18          HD23      LEU  18  -7.886  -9.358   4.839
  136    H    ARG  19           HN       ARG  19  -4.938 -11.003  -0.297
  137    HA   ARG  19           HA       ARG  19  -2.753 -12.703   0.021
  138    HB2  ARG  19           HB2      ARG  19  -3.856 -11.445  -2.492
  139    HB3  ARG  19           HB1      ARG  19  -2.695 -12.767  -2.467
  140    HG2  ARG  19           HG2      ARG  19  -4.275 -14.212  -1.367
  141    HG3  ARG  19           HG1      ARG  19  -5.426 -12.888  -1.206
  142    HD2  ARG  19           HD2      ARG  19  -5.631 -12.762  -3.613
  143    HD3  ARG  19           HD1      ARG  19  -4.452 -14.064  -3.810
  144    HE   ARG  19           HE       ARG  19  -6.308 -15.155  -2.214
  145   HH11  ARG  19          HH11      ARG  19  -6.565 -13.523  -5.355
  146   HH12  ARG  19          HH12      ARG  19  -7.939 -14.413  -5.840
  147   HH21  ARG  19          HH21      ARG  19  -8.215 -16.362  -2.926
  148   HH22  ARG  19          HH22      ARG  19  -8.875 -16.004  -4.455
  149    H    LEU  20           HN       LEU  20  -2.868  -9.363  -1.065
  150    HA   LEU  20           HA       LEU  20  -0.078  -9.290  -1.572
  151    HB2  LEU  20           HB2      LEU  20  -1.491  -7.733  -2.776
  152    HB3  LEU  20           HB1      LEU  20  -2.133  -7.101  -1.278
  153    HG   LEU  20           HG       LEU  20   0.205  -6.222  -0.809
  154   HD11  LEU  20          HD11      LEU  20   1.650  -7.317  -2.374
  155   HD12  LEU  20          HD12      LEU  20   1.523  -5.639  -2.840
  156   HD13  LEU  20          HD13      LEU  20   0.610  -6.841  -3.719
  157   HD21  LEU  20          HD21      LEU  20  -1.622  -4.781  -1.345
  158   HD22  LEU  20          HD22      LEU  20  -1.435  -5.121  -3.058
  159   HD23  LEU  20          HD23      LEU  20  -0.175  -4.221  -2.188
  160    H    LYS  21           HN       LYS  21  -2.228  -8.180   0.973
  161    HA   LYS  21           HA       LYS  21  -0.450  -6.802   2.585
  162    HB2  LYS  21           HB2      LYS  21  -2.853  -6.608   2.789
  163    HB3  LYS  21           HB1      LYS  21  -2.988  -8.286   3.269
  164    HG2  LYS  21           HG2      LYS  21  -1.931  -7.831   5.366
  165    HG3  LYS  21           HG1      LYS  21  -1.546  -6.197   4.854
  166    HD2  LYS  21           HD2      LYS  21  -4.375  -7.177   5.001
  167    HD3  LYS  21           HD1      LYS  21  -3.577  -6.437   6.408
  168    HE2  LYS  21           HE2      LYS  21  -3.171  -4.457   4.901
  169    HE3  LYS  21           HE1      LYS  21  -4.180  -5.262   3.701
  170    HZ1  LYS  21           HZ1      LYS  21  -6.006  -5.248   5.377
  171    HZ2  LYS  21           HZ2      LYS  21  -5.482  -3.697   4.969
  172    HZ3  LYS  21           HZ3      LYS  21  -4.982  -4.385   6.412
  173    H    THR  22           HN       THR  22  -1.312 -10.264   2.728
  174    HA   THR  22           HA       THR  22   0.448 -10.703   4.908
  175    HB   THR  22           HB       THR  22  -1.448 -12.262   4.499
  176    HG1  THR  22           HG1      THR  22   0.901 -12.870   5.329
  177   HG21  THR  22          HG21      THR  22   0.190 -13.207   2.130
  178   HG22  THR  22          HG22      THR  22  -1.363 -12.374   2.041
  179   HG23  THR  22          HG23      THR  22  -1.269 -13.988   2.744
  180    H    ALA  23           HN       ALA  23   0.844 -10.707   1.438
  181    HA   ALA  23           HA       ALA  23   3.332 -12.041   1.288
  182    HB1  ALA  23           HB1      ALA  23   1.941 -11.590  -0.698
  183    HB2  ALA  23           HB2      ALA  23   3.563 -10.918  -0.889
  184    HB3  ALA  23           HB3      ALA  23   2.213  -9.864  -0.476
  185    H    LEU  24           HN       LEU  24   2.404  -8.679   1.609
  186    HA   LEU  24           HA       LEU  24   4.993  -7.612   1.656
  187    HB2  LEU  24           HB2      LEU  24   2.524  -6.527   2.987
  188    HB3  LEU  24           HB1      LEU  24   3.949  -5.593   2.587
  189    HG   LEU  24           HG       LEU  24   1.904  -6.759   0.714
  190   HD11  LEU  24          HD11      LEU  24   2.800  -3.949   1.220
  191   HD12  LEU  24          HD12      LEU  24   1.288  -4.687   1.750
  192   HD13  LEU  24          HD13      LEU  24   1.603  -4.451   0.033
  193   HD21  LEU  24          HD21      LEU  24   3.191  -5.860  -1.143
  194   HD22  LEU  24          HD22      LEU  24   4.106  -7.100  -0.290
  195   HD23  LEU  24          HD23      LEU  24   4.478  -5.389  -0.039
  196    H    THR  25           HN       THR  25   2.902  -8.788   4.233
  197    HA   THR  25           HA       THR  25   4.659  -8.053   6.327
  198    HB   THR  25           HB       THR  25   2.549 -10.242   6.340
  199    HG1  THR  25           HG1      THR  25   1.569  -8.298   5.762
  200   HG21  THR  25          HG21      THR  25   3.729  -8.597   8.590
  201   HG22  THR  25          HG22      THR  25   4.095 -10.290   8.273
  202   HG23  THR  25          HG23      THR  25   2.467  -9.815   8.760
  203    H    ALA  26           HN       ALA  26   4.403 -10.911   4.270
  204    HA   ALA  26           HA       ALA  26   6.221 -12.559   5.733
  205    HB1  ALA  26           HB1      ALA  26   4.521 -13.450   4.181
  206    HB2  ALA  26           HB2      ALA  26   6.154 -14.004   3.802
  207    HB3  ALA  26           HB3      ALA  26   5.413 -12.719   2.844
  208    H    ASN  27           HN       ASN  27   6.510 -10.395   3.079
  209    HA   ASN  27           HA       ASN  27   9.292 -11.079   2.624
  210    HB2  ASN  27           HB2      ASN  27   7.296  -9.337   1.296
  211    HB3  ASN  27           HB1      ASN  27   8.972  -9.433   0.697
  212   HD21  ASN  27          HD21      ASN  27   6.462 -10.182  -0.604
  213   HD22  ASN  27          HD22      ASN  27   6.563 -11.863  -0.984
  214    H    ARG  28           HN       ARG  28   8.176  -9.519   4.955
  215    HA   ARG  28           HA       ARG  28   8.626  -7.809   6.283
  216    HB2  ARG  28           HB2      ARG  28  10.797  -8.928   6.409
  217    HB3  ARG  28           HB1      ARG  28  11.402  -7.901   5.107
  218    HG2  ARG  28           HG2      ARG  28  10.900  -5.919   6.530
  219    HG3  ARG  28           HG1      ARG  28  10.491  -7.020   7.837
  220    HD2  ARG  28           HD2      ARG  28  12.742  -7.881   7.858
  221    HD3  ARG  28           HD1      ARG  28  13.162  -6.887   6.460
  222    HE   ARG  28           HE       ARG  28  12.247  -5.683   8.973
  223   HH11  ARG  28          HH11      ARG  28  14.667  -5.922   6.412
  224   HH12  ARG  28          HH12      ARG  28  15.605  -4.627   6.966
  225   HH21  ARG  28          HH21      ARG  28  13.533  -3.850   9.716
  226   HH22  ARG  28          HH22      ARG  28  14.975  -3.464   8.887
  227    H    ILE  29           HN       ILE  29   7.144  -6.721   4.817
  228    HA   ILE  29           HA       ILE  29   8.389  -4.187   4.071
  229    HB   ILE  29           HB       ILE  29   5.911  -5.549   2.986
  230   HG12  ILE  29          HG12      ILE  29   8.505  -4.794   1.621
  231   HG13  ILE  29          HG11      ILE  29   8.078  -6.408   2.165
  232   HG21  ILE  29          HG21      ILE  29   7.023  -2.832   2.261
  233   HG22  ILE  29          HG22      ILE  29   5.559  -3.125   3.187
  234   HG23  ILE  29          HG23      ILE  29   5.651  -3.634   1.493
  235   HD11  ILE  29          HD11      ILE  29   7.757  -6.227  -0.195
  236   HD12  ILE  29          HD12      ILE  29   6.726  -4.811   0.013
  237   HD13  ILE  29          HD13      ILE  29   6.193  -6.392   0.587
  238    H    ALA  30           HN       ALA  30   7.820  -2.570   5.348
  239    HA   ALA  30           HA       ALA  30   5.818  -3.055   7.397
  240    HB1  ALA  30           HB1      ALA  30   8.018  -2.308   8.099
  241    HB2  ALA  30           HB2      ALA  30   6.793  -1.087   8.477
  242    HB3  ALA  30           HB3      ALA  30   7.853  -0.878   7.079
  243    H    TYR  31           HN       TYR  31   3.947  -1.892   7.552
  244    HA   TYR  31           HA       TYR  31   3.506   0.442   5.907
  245    HB2  TYR  31           HB2      TYR  31   1.596  -0.556   4.683
  246    HB3  TYR  31           HB1      TYR  31   3.138  -1.302   4.274
  247    HD1  TYR  31           HD2      TYR  31   3.643  -3.603   5.017
  248    HD2  TYR  31           HD1      TYR  31  -0.159  -1.837   5.778
  249    HE1  TYR  31           HE2      TYR  31   2.709  -5.825   5.533
  250    HE2  TYR  31           HE1      TYR  31  -1.084  -4.077   6.281
  251    HH   TYR  31           HH       TYR  31   0.926  -6.762   6.744
  252    H    ASP  32           HN       ASP  32   1.691   1.607   6.500
  253    HA   ASP  32           HA       ASP  32   0.178   0.602   8.831
  254    HB2  ASP  32           HB2      ASP  32   0.429   3.431   7.755
  255    HB3  ASP  32           HB1      ASP  32  -0.559   2.974   9.130
  256    H    GLU  33           HN       GLU  33  -2.041   0.334   8.498
  257    HA   GLU  33           HA       GLU  33  -2.892   0.985   5.786
  258    HB2  GLU  33           HB2      GLU  33  -4.667  -0.730   6.010
  259    HB3  GLU  33           HB1      GLU  33  -3.074  -1.380   6.275
  260    HG2  GLU  33           HG2      GLU  33  -3.372  -1.500   8.616
  261    HG3  GLU  33           HG1      GLU  33  -4.876  -0.582   8.525
  262    H    VAL  34           HN       VAL  34  -4.764   2.047   5.415
  263    HA   VAL  34           HA       VAL  34  -5.315   3.999   7.472
  264    HB   VAL  34           HB       VAL  34  -6.370   3.941   4.625
  265   HG11  VAL  34          HG11      VAL  34  -6.598   6.336   4.860
  266   HG12  VAL  34          HG12      VAL  34  -6.088   6.227   6.548
  267   HG13  VAL  34          HG13      VAL  34  -7.597   5.460   6.019
  268   HG21  VAL  34          HG21      VAL  34  -4.506   5.419   4.076
  269   HG22  VAL  34          HG22      VAL  34  -3.948   3.838   4.625
  270   HG23  VAL  34          HG23      VAL  34  -3.877   5.226   5.713
  271    H    ASP  35           HN       ASP  35  -7.423   4.717   8.027
  272    HA   ASP  35           HA       ASP  35  -9.094   2.674   9.070
  273    HB2  ASP  35           HB2      ASP  35  -9.800   5.596   8.996
  274    HB3  ASP  35           HB1      ASP  35 -10.281   4.382  10.164
  275    H    ILE  36           HN       ILE  36  -9.105   3.766   6.007
  276    HA   ILE  36           HA       ILE  36 -11.410   5.089   5.367
  277    HB   ILE  36           HB       ILE  36 -11.317   4.226   3.087
  278   HG12  ILE  36          HG12      ILE  36  -8.882   2.677   3.642
  279   HG13  ILE  36          HG11      ILE  36 -10.391   1.920   4.151
  280   HG21  ILE  36          HG21      ILE  36  -8.618   4.874   4.251
  281   HG22  ILE  36          HG22      ILE  36  -9.868   6.045   3.843
  282   HG23  ILE  36          HG23      ILE  36  -9.116   5.088   2.569
  283   HD11  ILE  36          HD11      ILE  36 -11.272   2.075   1.908
  284   HD12  ILE  36          HD12      ILE  36  -9.728   1.238   1.868
  285   HD13  ILE  36          HD13      ILE  36  -9.847   2.927   1.360
  286    H    GLU  37           HN       GLU  37 -11.428   1.661   6.101
  287    HA   GLU  37           HA       GLU  37 -13.888   1.029   4.847
  288    HB2  GLU  37           HB2      GLU  37 -12.368  -0.673   5.786
  289    HB3  GLU  37           HB1      GLU  37 -12.712  -0.081   7.405
  290    HG2  GLU  37           HG2      GLU  37 -15.073  -0.690   7.098
  291    HG3  GLU  37           HG1      GLU  37 -14.682  -1.364   5.521
  292    H    HIS  38           HN       HIS  38 -13.035   2.356   7.956
  293    HA   HIS  38           HA       HIS  38 -15.822   2.693   8.713
  294    HB2  HIS  38           HB2      HIS  38 -14.264   1.735  10.381
  295    HB3  HIS  38           HB1      HIS  38 -13.268   3.175  10.268
  296    HD1  HIS  38           HD1      HIS  38 -16.484   1.912  11.764
  297    HD2  HIS  38           HD2      HIS  38 -14.213   5.387  11.643
  298    HE1  HIS  38           HE1      HIS  38 -17.429   3.422  13.526
  299    H    ASN  39           HN       ASN  39 -12.885   4.521   8.048
  300    HA   ASN  39           HA       ASN  39 -14.271   7.029   8.487
  301    HB2  ASN  39           HB2      ASN  39 -11.943   6.909   9.177
  302    HB3  ASN  39           HB1      ASN  39 -11.459   6.541   7.520
  303   HD21  ASN  39          HD21      ASN  39 -10.313   8.291   7.063
  304   HD22  ASN  39          HD22      ASN  39 -10.816   9.914   7.162
  305    H    ARG  40           HN       ARG  40 -15.568   7.698   7.065
  306    HA   ARG  40           HA       ARG  40 -15.360   7.003   4.310
  307    HB2  ARG  40           HB2      ARG  40 -17.432   8.295   4.005
  308    HB3  ARG  40           HB1      ARG  40 -17.553   7.187   5.355
  309    HG2  ARG  40           HG2      ARG  40 -18.580   9.070   6.219
  310    HG3  ARG  40           HG1      ARG  40 -16.923   9.294   6.770
  311    HD2  ARG  40           HD2      ARG  40 -16.488  10.803   4.904
  312    HD3  ARG  40           HD1      ARG  40 -18.136  10.570   4.322
  313    HE   ARG  40           HE       ARG  40 -17.928  11.508   7.031
  314   HH11  ARG  40          HH11      ARG  40 -18.233  12.469   3.631
  315   HH12  ARG  40          HH12      ARG  40 -18.792  14.041   3.959
  316   HH21  ARG  40          HH21      ARG  40 -18.697  13.692   7.489
  317   HH22  ARG  40          HH22      ARG  40 -19.022  14.768   6.210
  318    H    ALA  41           HN       ALA  41 -13.982   9.498   6.170
  319    HA   ALA  41           HA       ALA  41 -14.056  11.356   4.047
  320    HB1  ALA  41           HB1      ALA  41 -12.436  11.720   6.578
  321    HB2  ALA  41           HB2      ALA  41 -14.139  12.080   6.416
  322    HB3  ALA  41           HB3      ALA  41 -12.967  12.953   5.432
  323    H    ALA  42           HN       ALA  42 -11.512   9.312   5.298
  324    HA   ALA  42           HA       ALA  42  -9.717  10.259   3.242
  325    HB1  ALA  42           HB1      ALA  42  -8.180   8.512   4.034
  326    HB2  ALA  42           HB2      ALA  42  -9.452   7.861   5.068
  327    HB3  ALA  42           HB3      ALA  42  -8.801   9.468   5.377
  328    H    ALA  43           HN       ALA  43 -12.121   7.855   3.586
  329    HA   ALA  43           HA       ALA  43 -11.325   6.033   1.587
  330    HB1  ALA  43           HB1      ALA  43 -13.608   5.220   1.676
  331    HB2  ALA  43           HB2      ALA  43 -14.119   6.708   2.478
  332    HB3  ALA  43           HB3      ALA  43 -13.043   5.592   3.313
  333    H    GLU  44           HN       GLU  44 -12.847   9.110   1.520
  334    HA   GLU  44           HA       GLU  44 -14.029   9.001  -1.013
  335    HB2  GLU  44           HB2      GLU  44 -14.330  10.730   0.887
  336    HB3  GLU  44           HB1      GLU  44 -12.912  11.515   0.210
  337    HG2  GLU  44           HG2      GLU  44 -14.950  12.535  -0.625
  338    HG3  GLU  44           HG1      GLU  44 -14.068  11.742  -1.936
  339    H    PHE  45           HN       PHE  45 -10.751   9.690   0.066
  340    HA   PHE  45           HA       PHE  45  -9.769  10.698  -2.398
  341    HB2  PHE  45           HB2      PHE  45  -8.520  11.139  -0.361
  342    HB3  PHE  45           HB1      PHE  45  -8.327   9.419  -0.055
  343    HD1  PHE  45           HD2      PHE  45  -7.584  11.864  -2.797
  344    HD2  PHE  45           HD1      PHE  45  -6.236   8.522  -0.521
  345    HE1  PHE  45           HE2      PHE  45  -5.442  11.895  -4.011
  346    HE2  PHE  45           HE1      PHE  45  -4.075   8.568  -1.747
  347    HZ   PHE  45           HZ       PHE  45  -3.701  10.246  -3.487
  348    H    VAL  46           HN       VAL  46 -10.101   7.537  -1.019
  349    HA   VAL  46           HA       VAL  46  -8.537   6.109  -2.886
  350    HB   VAL  46           HB       VAL  46 -10.891   5.124  -1.254
  351   HG11  VAL  46          HG11      VAL  46  -8.635   3.611  -2.563
  352   HG12  VAL  46          HG12      VAL  46 -10.331   3.563  -3.022
  353   HG13  VAL  46          HG13      VAL  46  -9.822   2.905  -1.466
  354   HG21  VAL  46          HG21      VAL  46  -9.183   4.394   0.356
  355   HG22  VAL  46          HG22      VAL  46  -9.224   6.142   0.156
  356   HG23  VAL  46          HG23      VAL  46  -7.949   5.197  -0.614
  357    H    GLY  47           HN       GLY  47 -12.008   6.801  -2.699
  358    HA2  GLY  47           HA2      GLY  47 -12.668   5.497  -5.137
  359    HA3  GLY  47           HA1      GLY  47 -13.667   6.674  -4.292
  360    H    SER  48           HN       SER  48 -11.277   8.521  -4.409
  361    HA   SER  48           HA       SER  48 -12.018   9.835  -6.852
  362    HB2  SER  48           HB2      SER  48 -11.708  11.100  -4.754
  363    HB3  SER  48           HB1      SER  48 -10.032  10.582  -4.688
  364    HG   SER  48           HG       SER  48 -11.156  12.099  -6.799
  365    H    VAL  49           HN       VAL  49  -9.121   8.247  -5.531
  366    HA   VAL  49           HA       VAL  49  -7.611   8.911  -7.879
  367    HB   VAL  49           HB       VAL  49  -6.543   8.896  -5.645
  368   HG11  VAL  49          HG11      VAL  49  -6.813   5.903  -5.717
  369   HG12  VAL  49          HG12      VAL  49  -7.612   7.019  -4.613
  370   HG13  VAL  49          HG13      VAL  49  -5.861   6.827  -4.554
  371   HG21  VAL  49          HG21      VAL  49  -5.286   6.997  -7.626
  372   HG22  VAL  49          HG22      VAL  49  -4.442   7.770  -6.285
  373   HG23  VAL  49          HG23      VAL  49  -5.117   8.753  -7.584
  374    H    ASN  50           HN       ASN  50  -9.351   6.120  -6.739
  375    HA   ASN  50           HA       ASN  50  -8.334   4.511  -8.970
  376    HB2  ASN  50           HB2      ASN  50 -10.012   3.784  -6.563
  377    HB3  ASN  50           HB1      ASN  50  -9.674   2.668  -7.883
  378   HD21  ASN  50          HD21      ASN  50  -8.940   2.594  -5.011
  379   HD22  ASN  50          HD22      ASN  50  -7.249   2.387  -4.978
  380    H    GLY  51           HN       GLY  51  -9.535   3.837 -10.612
  381    HA2  GLY  51           HA2      GLY  51 -11.894   5.475 -11.048
  382    HA3  GLY  51           HA1      GLY  51 -10.959   4.653 -12.282
  383    H    GLY  52           HN       GLY  52 -13.853   4.761 -11.320
  384    HA2  GLY  52           HA2      GLY  52 -15.562   3.326 -11.891
  385    HA3  GLY  52           HA1      GLY  52 -14.389   2.021 -12.031
  386    H    ASN  53           HN       ASN  53 -13.722   0.961 -10.163
  387    HA   ASN  53           HA       ASN  53 -15.801   0.860  -8.090
  388    HB2  ASN  53           HB2      ASN  53 -13.526  -1.031  -8.778
  389    HB3  ASN  53           HB1      ASN  53 -14.562  -1.242  -7.381
  390   HD21  ASN  53          HD21      ASN  53 -15.237  -3.262  -8.123
  391   HD22  ASN  53          HD22      ASN  53 -16.326  -3.439  -9.437
  392    H    ARG  54           HN       ARG  54 -15.058   0.717  -5.801
  393    HA   ARG  54           HA       ARG  54 -12.731   2.390  -5.440
  394    HB2  ARG  54           HB2      ARG  54 -14.755   2.636  -3.915
  395    HB3  ARG  54           HB1      ARG  54 -14.347   1.050  -3.257
  396    HG2  ARG  54           HG2      ARG  54 -12.091   1.964  -2.704
  397    HG3  ARG  54           HG1      ARG  54 -12.722   3.560  -3.120
  398    HD2  ARG  54           HD2      ARG  54 -12.890   3.261  -0.751
  399    HD3  ARG  54           HD1      ARG  54 -14.506   3.212  -1.459
  400    HE   ARG  54           HE       ARG  54 -13.496   0.601  -1.294
  401   HH11  ARG  54          HH11      ARG  54 -14.797   3.156   0.769
  402   HH12  ARG  54          HH12      ARG  54 -15.276   2.083   2.012
  403   HH21  ARG  54          HH21      ARG  54 -14.117  -0.844   0.379
  404   HH22  ARG  54          HH22      ARG  54 -14.884  -0.247   1.789
  405    H    THR  55           HN       THR  55 -11.269   0.992  -6.379
  406    HA   THR  55           HA       THR  55 -10.761  -1.613  -5.639
  407    HB   THR  55           HB       THR  55  -8.679   0.415  -6.462
  408    HG1  THR  55           HG1      THR  55  -9.477   0.232  -8.504
  409   HG21  THR  55          HG21      THR  55  -9.090  -2.528  -6.954
  410   HG22  THR  55          HG22      THR  55  -7.884  -1.793  -5.878
  411   HG23  THR  55          HG23      THR  55  -7.792  -1.536  -7.632
  412    H    VAL  56           HN       VAL  56  -9.920  -2.442  -3.819
  413    HA   VAL  56           HA       VAL  56  -8.849  -0.513  -2.451
  414    HB   VAL  56           HB       VAL  56  -8.855  -1.634  -0.153
  415   HG11  VAL  56          HG11      VAL  56 -10.910   0.044  -1.520
  416   HG12  VAL  56          HG12      VAL  56  -9.401   0.499  -0.701
  417   HG13  VAL  56          HG13      VAL  56 -10.741  -0.167   0.247
  418   HG21  VAL  56          HG21      VAL  56 -11.174  -2.487   0.095
  419   HG22  VAL  56          HG22      VAL  56  -9.954  -3.519  -0.609
  420   HG23  VAL  56          HG23      VAL  56 -11.168  -2.742  -1.672
  421    HA   PRO  57           HA       PRO  57  -5.453  -1.948  -0.906
  422    HB2  PRO  57           HB2      PRO  57  -3.604  -3.573  -2.184
  423    HB3  PRO  57           HB1      PRO  57  -4.833  -4.130  -1.038
  424    HG2  PRO  57           HG2      PRO  57  -4.888  -4.142  -4.018
  425    HG3  PRO  57           HG1      PRO  57  -5.530  -5.339  -2.880
  426    HD2  PRO  57           HD2      PRO  57  -7.013  -3.379  -4.166
  427    HD3  PRO  57           HD1      PRO  57  -7.472  -4.287  -2.689
  428    H    THR  58           HN       THR  58  -5.048   0.132  -1.533
  429    HA   THR  58           HA       THR  58  -3.545   0.771  -3.958
  430    HB   THR  58           HB       THR  58  -5.185   2.666  -2.276
  431    HG1  THR  58           HG1      THR  58  -6.550   0.915  -2.962
  432   HG21  THR  58          HG21      THR  58  -3.661   3.589  -4.038
  433   HG22  THR  58          HG22      THR  58  -5.378   3.890  -4.375
  434   HG23  THR  58          HG23      THR  58  -4.542   2.605  -5.222
  435    H    VAL  59           HN       VAL  59  -1.512   1.214  -3.438
  436    HA   VAL  59           HA       VAL  59  -0.940   1.933  -0.676
  437    HB   VAL  59           HB       VAL  59   0.127  -0.142  -1.430
  438   HG11  VAL  59          HG11      VAL  59   1.889  -0.039  -3.142
  439   HG12  VAL  59          HG12      VAL  59   1.220   1.565  -3.580
  440   HG13  VAL  59          HG13      VAL  59   0.227   0.128  -3.725
  441   HG21  VAL  59          HG21      VAL  59   1.377   1.171   0.196
  442   HG22  VAL  59          HG22      VAL  59   2.092   2.108  -1.102
  443   HG23  VAL  59          HG23      VAL  59   2.474   0.402  -0.943
  444    H    LYS  60           HN       LYS  60   0.222   3.688  -0.193
  445    HA   LYS  60           HA       LYS  60   0.688   5.623  -2.355
  446    HB2  LYS  60           HB2      LYS  60  -1.149   6.071  -0.656
  447    HB3  LYS  60           HB1      LYS  60   0.109   6.163   0.562
  448    HG2  LYS  60           HG2      LYS  60   1.088   8.051  -0.709
  449    HG3  LYS  60           HG1      LYS  60  -0.304   7.977  -1.794
  450    HD2  LYS  60           HD2      LYS  60  -1.751   8.181   0.286
  451    HD3  LYS  60           HD1      LYS  60  -0.271   8.595   1.147
  452    HE2  LYS  60           HE2      LYS  60   0.056  10.385  -0.617
  453    HE3  LYS  60           HE1      LYS  60  -1.583  10.041  -1.112
  454    HZ1  LYS  60           HZ1      LYS  60  -1.576  11.869   0.449
  455    HZ2  LYS  60           HZ2      LYS  60  -0.797  10.935   1.599
  456    HZ3  LYS  60           HZ3      LYS  60  -2.359  10.556   1.149
  457    H    PHE  61           HN       PHE  61   2.805   6.001  -2.628
  458    HA   PHE  61           HA       PHE  61   4.651   5.322  -0.450
  459    HB2  PHE  61           HB2      PHE  61   5.208   5.797  -3.397
  460    HB3  PHE  61           HB1      PHE  61   6.423   5.450  -2.185
  461    HD1  PHE  61           HD2      PHE  61   3.685   4.053  -4.174
  462    HD2  PHE  61           HD1      PHE  61   6.728   3.229  -1.315
  463    HE1  PHE  61           HE2      PHE  61   3.399   1.621  -4.539
  464    HE2  PHE  61           HE1      PHE  61   6.409   0.820  -1.697
  465    HZ   PHE  61           HZ       PHE  61   4.746   0.031  -3.297
  466    H    ALA  62           HN       ALA  62   6.330   6.784   0.095
  467    HA   ALA  62           HA       ALA  62   5.651   9.516   0.205
  468    HB1  ALA  62           HB1      ALA  62   7.864   9.856   1.172
  469    HB2  ALA  62           HB2      ALA  62   8.368   8.258   0.632
  470    HB3  ALA  62           HB3      ALA  62   7.113   8.417   1.861
  471    H    ASP  63           HN       ASP  63   6.873   7.710  -2.246
  472    HA   ASP  63           HA       ASP  63   8.534   9.433  -3.751
  473    HB2  ASP  63           HB2      ASP  63   8.289   6.998  -4.122
  474    HB3  ASP  63           HB1      ASP  63   6.630   7.251  -4.632
  475    H    GLY  64           HN       GLY  64   5.153   9.403  -3.096
  476    HA2  GLY  64           HA2      GLY  64   3.739  11.239  -3.472
  477    HA3  GLY  64           HA1      GLY  64   4.797  11.760  -4.775
  478    H    SER  65           HN       SER  65   3.930   8.451  -4.730
  479    HA   SER  65           HA       SER  65   1.853   8.941  -6.712
  480    HB2  SER  65           HB2      SER  65   4.037   8.536  -7.854
  481    HB3  SER  65           HB1      SER  65   4.163   6.995  -7.017
  482    HG   SER  65           HG       SER  65   1.930   7.613  -8.643
  483    H    THR  66           HN       THR  66   0.363   7.179  -6.914
  484    HA   THR  66           HA       THR  66   0.392   5.328  -4.664
  485    HB   THR  66           HB       THR  66  -2.141   5.274  -5.201
  486    HG1  THR  66           HG1      THR  66  -2.476   6.403  -6.954
  487   HG21  THR  66          HG21      THR  66  -1.263   6.283  -3.153
  488   HG22  THR  66          HG22      THR  66  -2.575   7.264  -3.804
  489   HG23  THR  66          HG23      THR  66  -0.902   7.768  -4.031
  490    H    LEU  67           HN       LEU  67   0.098   3.206  -5.127
  491    HA   LEU  67           HA       LEU  67  -0.214   2.488  -7.955
  492    HB2  LEU  67           HB2      LEU  67   1.650   1.305  -5.905
  493    HB3  LEU  67           HB1      LEU  67   1.066   0.320  -7.222
  494    HG   LEU  67           HG       LEU  67   2.111   1.902  -8.833
  495   HD11  LEU  67          HD11      LEU  67   3.788   3.499  -8.107
  496   HD12  LEU  67          HD12      LEU  67   3.328   3.253  -6.427
  497   HD13  LEU  67          HD13      LEU  67   2.174   3.938  -7.566
  498   HD21  LEU  67          HD21      LEU  67   3.990   0.667  -6.813
  499   HD22  LEU  67          HD22      LEU  67   4.431   1.200  -8.430
  500   HD23  LEU  67          HD23      LEU  67   3.280  -0.115  -8.226
  501    H    THR  68           HN       THR  68  -1.898   1.317  -8.412
  502    HA   THR  68           HA       THR  68  -3.464   0.231  -6.222
  503    HB   THR  68           HB       THR  68  -4.231   0.608  -9.129
  504    HG1  THR  68           HG1      THR  68  -5.370   2.461  -7.643
  505   HG21  THR  68          HG21      THR  68  -5.656  -0.891  -7.817
  506   HG22  THR  68          HG22      THR  68  -6.502   0.605  -8.223
  507   HG23  THR  68          HG23      THR  68  -5.856   0.367  -6.599
  508    H    ASN  69           HN       ASN  69  -3.208  -1.853  -5.801
  509    HA   ASN  69           HA       ASN  69  -2.417  -3.935  -5.826
  510    HB2  ASN  69           HB2      ASN  69  -3.749  -4.064  -8.537
  511    HB3  ASN  69           HB1      ASN  69  -2.981  -5.446  -7.793
  512   HD21  ASN  69          HD21      ASN  69  -5.753  -3.646  -8.077
  513   HD22  ASN  69          HD22      ASN  69  -6.694  -4.468  -6.866
  514    HA   PRO  70           HA       PRO  70   1.405  -3.469  -8.267
  515    HB2  PRO  70           HB2      PRO  70   3.096  -2.863  -6.329
  516    HB3  PRO  70           HB1      PRO  70   2.037  -1.597  -6.970
  517    HG2  PRO  70           HG2      PRO  70   1.660  -3.316  -4.552
  518    HG3  PRO  70           HG1      PRO  70   1.576  -1.532  -4.639
  519    HD2  PRO  70           HD2      PRO  70  -0.643  -3.098  -4.722
  520    HD3  PRO  70           HD1      PRO  70  -0.518  -1.593  -5.648
  521    H    SER  71           HN       SER  71   3.236  -4.981  -8.031
  522    HA   SER  71           HA       SER  71   2.483  -7.398  -6.684
  523    HB2  SER  71           HB2      SER  71   4.989  -6.751  -8.238
  524    HB3  SER  71           HB1      SER  71   4.286  -8.345  -7.931
  525    HG   SER  71           HG       SER  71   3.839  -7.506 -10.019
  526    H    ALA  72           HN       ALA  72   4.083  -8.474  -5.230
  527    HA   ALA  72           HA       ALA  72   4.744  -6.896  -3.040
  528    HB1  ALA  72           HB1      ALA  72   5.863  -8.860  -2.145
  529    HB2  ALA  72           HB2      ALA  72   5.891  -9.595  -3.749
  530    HB3  ALA  72           HB3      ALA  72   4.353  -9.318  -2.931
  531    H    ASP  73           HN       ASP  73   6.822  -8.103  -5.615
  532    HA   ASP  73           HA       ASP  73   9.285  -7.143  -4.679
  533    HB2  ASP  73           HB2      ASP  73   8.307  -7.646  -7.477
  534    HB3  ASP  73           HB1      ASP  73   9.914  -7.011  -7.172
  535    H    GLU  74           HN       GLU  74   6.847  -5.625  -6.627
  536    HA   GLU  74           HA       GLU  74   8.183  -3.234  -7.211
  537    HB2  GLU  74           HB2      GLU  74   5.245  -3.852  -6.964
  538    HB3  GLU  74           HB1      GLU  74   5.861  -2.293  -7.500
  539    HG2  GLU  74           HG2      GLU  74   6.362  -4.939  -8.835
  540    HG3  GLU  74           HG1      GLU  74   5.233  -3.693  -9.385
  541    H    VAL  75           HN       VAL  75   6.094  -4.132  -4.547
  542    HA   VAL  75           HA       VAL  75   5.999  -1.564  -3.388
  543    HB   VAL  75           HB       VAL  75   5.620  -4.238  -2.008
  544   HG11  VAL  75          HG11      VAL  75   4.698  -1.481  -1.219
  545   HG12  VAL  75          HG12      VAL  75   5.970  -2.413  -0.435
  546   HG13  VAL  75          HG13      VAL  75   4.299  -2.981  -0.382
  547   HG21  VAL  75          HG21      VAL  75   3.597  -2.418  -3.293
  548   HG22  VAL  75          HG22      VAL  75   3.234  -3.890  -2.392
  549   HG23  VAL  75          HG23      VAL  75   4.123  -3.982  -3.910
  550    H    LYS  76           HN       LYS  76   7.980  -4.412  -2.724
  551    HA   LYS  76           HA       LYS  76   9.399  -3.419  -0.519
  552    HB2  LYS  76           HB2      LYS  76   9.227  -5.818  -1.351
  553    HB3  LYS  76           HB1      LYS  76  10.411  -5.386  -2.556
  554    HG2  LYS  76           HG2      LYS  76  12.070  -4.946  -0.859
  555    HG3  LYS  76           HG1      LYS  76  10.884  -5.245   0.418
  556    HD2  LYS  76           HD2      LYS  76  10.594  -7.547  -0.427
  557    HD3  LYS  76           HD1      LYS  76  11.815  -7.232  -1.653
  558    HE2  LYS  76           HE2      LYS  76  12.761  -8.476   0.176
  559    HE3  LYS  76           HE1      LYS  76  13.481  -6.873   0.102
  560    HZ1  LYS  76           HZ1      LYS  76  12.904  -7.686   2.350
  561    HZ2  LYS  76           HZ2      LYS  76  11.276  -7.604   1.986
  562    HZ3  LYS  76           HZ3      LYS  76  12.227  -6.199   2.014
  563    H    ALA  77           HN       ALA  77  10.143  -3.338  -3.984
  564    HA   ALA  77           HA       ALA  77  12.704  -2.123  -3.647
  565    HB1  ALA  77           HB1      ALA  77  10.978  -2.257  -6.117
  566    HB2  ALA  77           HB2      ALA  77  12.156  -3.475  -5.623
  567    HB3  ALA  77           HB3      ALA  77  12.695  -1.855  -6.067
  568    H    LYS  78           HN       LYS  78   9.463  -0.868  -4.251
  569    HA   LYS  78           HA       LYS  78  10.426   1.805  -4.622
  570    HB2  LYS  78           HB2      LYS  78   7.875   0.483  -4.775
  571    HB3  LYS  78           HB1      LYS  78   7.737   1.909  -3.762
  572    HG2  LYS  78           HG2      LYS  78   7.181   2.512  -6.014
  573    HG3  LYS  78           HG1      LYS  78   8.711   3.265  -5.585
  574    HD2  LYS  78           HD2      LYS  78   8.885   2.433  -7.822
  575    HD3  LYS  78           HD1      LYS  78   9.881   1.406  -6.786
  576    HE2  LYS  78           HE2      LYS  78   8.126  -0.292  -6.763
  577    HE3  LYS  78           HE1      LYS  78   7.077   0.749  -7.720
  578    HZ1  LYS  78           HZ1      LYS  78   8.756   0.622  -9.510
  579    HZ2  LYS  78           HZ2      LYS  78   8.079  -0.860  -9.160
  580    HZ3  LYS  78           HZ3      LYS  78   9.628  -0.515  -8.626
  581    H    LEU  79           HN       LEU  79   9.422  -0.137  -1.912
  582    HA   LEU  79           HA       LEU  79   9.126   1.873  -0.003
  583    HB2  LEU  79           HB2      LEU  79   8.599  -0.676   0.271
  584    HB3  LEU  79           HB1      LEU  79  10.302  -0.840   0.526
  585    HG   LEU  79           HG       LEU  79  10.079   0.757   2.460
  586   HD11  LEU  79          HD11      LEU  79   7.163   0.189   2.015
  587   HD12  LEU  79          HD12      LEU  79   7.925   1.781   2.118
  588   HD13  LEU  79          HD13      LEU  79   7.825   0.745   3.532
  589   HD21  LEU  79          HD21      LEU  79   8.725  -1.930   2.571
  590   HD22  LEU  79          HD22      LEU  79   9.308  -1.024   3.966
  591   HD23  LEU  79          HD23      LEU  79  10.446  -1.602   2.748
  592    H    VAL  80           HN       VAL  80  11.924  -0.068  -0.939
  593    HA   VAL  80           HA       VAL  80  13.629   1.055   0.986
  594    HB   VAL  80           HB       VAL  80  15.502  -0.018  -0.176
  595   HG11  VAL  80          HG11      VAL  80  14.753  -2.310  -0.020
  596   HG12  VAL  80          HG12      VAL  80  13.074  -1.762  -0.008
  597   HG13  VAL  80          HG13      VAL  80  14.150  -1.340   1.322
  598   HG21  VAL  80          HG21      VAL  80  13.475  -0.559  -2.296
  599   HG22  VAL  80          HG22      VAL  80  15.036  -1.391  -2.198
  600   HG23  VAL  80          HG23      VAL  80  14.972   0.356  -2.468
  601    H    LYS  81           HN       LYS  81  12.822   2.113  -2.205
  602    HA   LYS  81           HA       LYS  81  15.024   3.955  -2.210
  603    HB2  LYS  81           HB2      LYS  81  14.287   4.715  -4.385
  604    HB3  LYS  81           HB1      LYS  81  14.235   2.974  -4.339
  605    HG2  LYS  81           HG2      LYS  81  12.240   3.442  -5.448
  606    HG3  LYS  81           HG1      LYS  81  11.738   3.322  -3.770
  607    HD2  LYS  81           HD2      LYS  81  10.692   5.241  -4.894
  608    HD3  LYS  81           HD1      LYS  81  11.725   5.737  -3.557
  609    HE2  LYS  81           HE2      LYS  81  11.969   7.199  -5.517
  610    HE3  LYS  81           HE1      LYS  81  13.481   6.404  -5.114
  611    HZ1  LYS  81           HZ1      LYS  81  13.022   4.800  -6.912
  612    HZ2  LYS  81           HZ2      LYS  81  13.111   6.376  -7.466
  613    HZ3  LYS  81           HZ3      LYS  81  11.610   5.648  -7.299
  614    H    ILE  82           HN       ILE  82  11.754   4.017  -1.146
  615    HA   ILE  82           HA       ILE  82  11.862   6.884  -1.021
  616    HB   ILE  82           HB       ILE  82   9.576   6.889  -0.137
  617   HG12  ILE  82          HG12      ILE  82   8.297   4.590  -0.343
  618   HG13  ILE  82          HG11      ILE  82   9.886   3.899  -0.055
  619   HG21  ILE  82          HG21      ILE  82   9.914   5.165  -2.568
  620   HG22  ILE  82          HG22      ILE  82   9.874   6.922  -2.499
  621   HG23  ILE  82          HG23      ILE  82   8.426   5.993  -2.105
  622   HD11  ILE  82          HD11      ILE  82   9.992   5.064   2.093
  623   HD12  ILE  82          HD12      ILE  82   8.574   4.017   1.982
  624   HD13  ILE  82          HD13      ILE  82   8.401   5.760   1.777
  625    H    ALA  83           HN       ALA  83  12.261   4.220   1.132
  626    HA   ALA  83           HA       ALA  83  12.437   5.872   3.472
  627    HB1  ALA  83           HB1      ALA  83  13.244   3.810   4.568
  628    HB2  ALA  83           HB2      ALA  83  13.334   3.022   2.993
  629    HB3  ALA  83           HB3      ALA  83  11.772   3.518   3.641
  630    H    GLY  84           HN       GLY  84  14.877   3.882   1.747
  631    HA2  GLY  84           HA2      GLY  84  16.801   5.118   0.882
  632    HA3  GLY  84           HA1      GLY  84  16.801   5.983   2.412
  633    H    LEU  85           HN       LEU  85  18.011   5.258   3.974
  634    HA   LEU  85           HA       LEU  85  19.870   3.184   3.474
  635    HB2  LEU  85           HB2      LEU  85  20.335   5.268   4.770
  636    HB3  LEU  85           HB1      LEU  85  19.303   4.686   6.047
  637    HG   LEU  85           HG       LEU  85  21.777   4.551   6.487
  638   HD11  LEU  85          HD11      LEU  85  21.769   2.334   7.497
  639   HD12  LEU  85          HD12      LEU  85  20.292   1.948   6.609
  640   HD13  LEU  85          HD13      LEU  85  20.283   3.227   7.819
  641   HD21  LEU  85          HD21      LEU  85  21.685   2.350   4.429
  642   HD22  LEU  85          HD22      LEU  85  23.052   2.725   5.478
  643   HD23  LEU  85          HD23      LEU  85  22.521   3.896   4.268
  644    H    GLU  86           HN       GLU  86  17.081   3.449   5.625
  645    HA   GLU  86           HA       GLU  86  17.420   0.786   6.593
  646    HB2  GLU  86           HB2      GLU  86  15.236   2.808   6.957
  647    HB3  GLU  86           HB1      GLU  86  15.123   1.174   7.601
  648    HG2  GLU  86           HG2      GLU  86  17.335   3.104   8.226
  649    HG3  GLU  86           HG1      GLU  86  15.913   2.841   9.237
  650    H    HIS  87           HN       HIS  87  17.337  -0.668   5.134
  651    HA   HIS  87           HA       HIS  87  15.092  -0.746   3.315
  652    HB2  HIS  87           HB2      HIS  87  16.402  -2.594   2.183
  653    HB3  HIS  87           HB1      HIS  87  17.169  -1.017   2.145
  654    HD1  HIS  87           HD1      HIS  87  19.430  -0.791   3.354
  655    HD2  HIS  87           HD2      HIS  87  17.712  -4.553   3.727
  656    HE1  HIS  87           HE1      HIS  87  21.216  -2.278   4.351
  657    H    HIS  88           HN       HIS  88  13.515  -2.096   3.553
  658    HA   HIS  88           HA       HIS  88  13.647  -3.956   5.759
  659    HB2  HIS  88           HB2      HIS  88  11.297  -2.929   4.146
  660    HB3  HIS  88           HB1      HIS  88  11.158  -4.138   5.409
  661    HD1  HIS  88           HD1      HIS  88  11.160  -3.274   7.878
  662    HD2  HIS  88           HD2      HIS  88  11.807  -0.302   5.031
  663    HE1  HIS  88           HE1      HIS  88  10.961  -1.085   9.087
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1   8.878   3.934  15.224
    2    H2   MET   1           HT2      MET   1   7.767   2.693  14.907
    3    H3   MET   1           HT3      MET   1   7.322   3.991  15.877
    4    HA   MET   1           HA       MET   1   7.500   5.487  14.008
    5    HB2  MET   1           HB2      MET   1   7.991   2.931  12.467
    6    HB3  MET   1           HB1      MET   1   7.698   4.500  11.749
    7    HG2  MET   1           HG2      MET   1   9.787   5.333  12.681
    8    HG3  MET   1           HG1      MET   1  10.068   3.777  13.459
    9    HE1  MET   1           HE1      MET   1   9.058   1.728  11.194
   10    HE2  MET   1           HE2      MET   1  10.534   1.524  12.138
   11    HE3  MET   1           HE3      MET   1  10.589   1.405  10.381
   12    H    VAL   2           HN       VAL   2   5.381   5.965  14.156
   13    HA   VAL   2           HA       VAL   2   3.450   3.859  13.536
   14    HB   VAL   2           HB       VAL   2   3.157   5.353  15.586
   15   HG11  VAL   2          HG11      VAL   2   3.839   7.462  14.743
   16   HG12  VAL   2          HG12      VAL   2   2.150   7.579  15.245
   17   HG13  VAL   2          HG13      VAL   2   2.558   7.450  13.534
   18   HG21  VAL   2          HG21      VAL   2   0.732   5.641  15.328
   19   HG22  VAL   2          HG22      VAL   2   1.275   4.076  14.719
   20   HG23  VAL   2          HG23      VAL   2   0.900   5.381  13.593
   21    H    THR   3           HN       THR   3   5.200   6.340  12.159
   22    HA   THR   3           HA       THR   3   3.416   7.317  10.242
   23    HB   THR   3           HB       THR   3   5.689   7.928   9.152
   24    HG1  THR   3           HG1      THR   3   7.258   7.911  11.123
   25   HG21  THR   3          HG21      THR   3   5.993   9.770  10.770
   26   HG22  THR   3          HG22      THR   3   4.951   8.924  11.917
   27   HG23  THR   3          HG23      THR   3   4.289   9.518  10.396
   28    H    ALA   4           HN       ALA   4   2.763   6.381   8.489
   29    HA   ALA   4           HA       ALA   4   3.654   3.752   7.807
   30    HB1  ALA   4           HB1      ALA   4   1.294   4.368   7.833
   31    HB2  ALA   4           HB2      ALA   4   1.814   3.767   6.254
   32    HB3  ALA   4           HB3      ALA   4   1.582   5.497   6.509
   33    H    ALA   5           HN       ALA   5   5.358   3.480   6.577
   34    HA   ALA   5           HA       ALA   5   6.235   5.354   4.598
   35    HB1  ALA   5           HB1      ALA   5   7.809   3.555   3.940
   36    HB2  ALA   5           HB2      ALA   5   6.960   2.431   4.990
   37    HB3  ALA   5           HB3      ALA   5   7.827   3.801   5.686
   38    H    LEU   6           HN       LEU   6   4.284   2.504   4.786
   39    HA   LEU   6           HA       LEU   6   3.401   2.895   2.004
   40    HB2  LEU   6           HB2      LEU   6   3.164   0.362   3.627
   41    HB3  LEU   6           HB1      LEU   6   2.745   0.611   1.946
   42    HG   LEU   6           HG       LEU   6   5.521   0.556   3.079
   43   HD11  LEU   6          HD11      LEU   6   3.990  -1.326   1.302
   44   HD12  LEU   6          HD12      LEU   6   4.463  -1.616   2.979
   45   HD13  LEU   6          HD13      LEU   6   5.695  -1.467   1.725
   46   HD21  LEU   6          HD21      LEU   6   6.195   0.660   0.759
   47   HD22  LEU   6          HD22      LEU   6   5.333   2.117   1.290
   48   HD23  LEU   6          HD23      LEU   6   4.505   0.911   0.290
   49    H    THR   7           HN       THR   7   1.459   3.803   2.023
   50    HA   THR   7           HA       THR   7  -0.260   3.327   4.344
   51    HB   THR   7           HB       THR   7  -0.679   5.296   2.082
   52    HG1  THR   7           HG1      THR   7   1.364   5.583   3.314
   53   HG21  THR   7          HG21      THR   7  -1.690   5.213   4.928
   54   HG22  THR   7          HG22      THR   7  -2.628   4.826   3.486
   55   HG23  THR   7          HG23      THR   7  -2.052   6.472   3.747
   56    H    ILE   8           HN       ILE   8  -1.518   1.544   3.972
   57    HA   ILE   8           HA       ILE   8  -2.375   1.059   1.224
   58    HB   ILE   8           HB       ILE   8  -2.019  -0.931   3.494
   59   HG12  ILE   8          HG12      ILE   8  -0.524  -0.564   0.886
   60   HG13  ILE   8          HG11      ILE   8   0.089  -0.200   2.492
   61   HG21  ILE   8          HG21      ILE   8  -2.621  -2.687   1.872
   62   HG22  ILE   8          HG22      ILE   8  -2.958  -1.465   0.653
   63   HG23  ILE   8          HG23      ILE   8  -3.936  -1.541   2.119
   64   HD11  ILE   8          HD11      ILE   8  -0.625  -2.924   1.431
   65   HD12  ILE   8          HD12      ILE   8  -0.025  -2.582   3.055
   66   HD13  ILE   8          HD13      ILE   8   1.000  -2.277   1.653
   67    H    TYR   9           HN       TYR   9  -4.398   0.919   0.782
   68    HA   TYR   9           HA       TYR   9  -6.333   1.685   2.798
   69    HB2  TYR   9           HB2      TYR   9  -6.495   1.409  -0.207
   70    HB3  TYR   9           HB1      TYR   9  -7.789   2.057   0.778
   71    HD1  TYR   9           HD2      TYR   9  -7.430   4.254   1.971
   72    HD2  TYR   9           HD1      TYR   9  -4.623   2.733  -0.839
   73    HE1  TYR   9           HE2      TYR   9  -6.387   6.477   1.801
   74    HE2  TYR   9           HE1      TYR   9  -3.577   4.937  -1.008
   75    HH   TYR   9           HH       TYR   9  -4.273   7.441   1.185
   76    H    THR  10           HN       THR  10  -7.510   0.087   3.848
   77    HA   THR  10           HA       THR  10  -8.279  -2.267   2.329
   78    HB   THR  10           HB       THR  10  -7.858  -3.645   4.407
   79    HG1  THR  10           HG1      THR  10  -7.438  -2.268   5.996
   80   HG21  THR  10          HG21      THR  10  -6.404  -3.864   2.452
   81   HG22  THR  10          HG22      THR  10  -5.465  -4.013   3.940
   82   HG23  THR  10          HG23      THR  10  -5.432  -2.507   3.020
   83    H    THR  11           HN       THR  11 -10.023  -3.502   3.429
   84    HA   THR  11           HA       THR  11 -11.644  -2.229   5.452
   85    HB   THR  11           HB       THR  11 -13.656  -2.494   3.889
   86    HG1  THR  11           HG1      THR  11 -12.017  -2.007   1.725
   87   HG21  THR  11          HG21      THR  11 -11.682  -0.310   3.204
   88   HG22  THR  11          HG22      THR  11 -12.902  -0.238   4.477
   89   HG23  THR  11          HG23      THR  11 -13.390  -0.307   2.788
   90    H    SER  12           HN       SER  12 -13.773  -3.784   5.511
   91    HA   SER  12           HA       SER  12 -12.928  -6.507   5.578
   92    HB2  SER  12           HB2      SER  12 -14.698  -5.550   7.093
   93    HB3  SER  12           HB1      SER  12 -15.748  -5.403   5.691
   94    HG   SER  12           HG       SER  12 -15.669  -7.640   5.444
   95    H    TRP  13           HN       TRP  13 -13.904  -4.494   3.062
   96    HA   TRP  13           HA       TRP  13 -15.282  -6.459   1.424
   97    HB2  TRP  13           HB2      TRP  13 -14.121  -3.804   0.498
   98    HB3  TRP  13           HB1      TRP  13 -15.490  -4.674  -0.180
   99    HD1  TRP  13           HD1      TRP  13 -17.190  -5.020   2.507
  100    HE1  TRP  13           HE1      TRP  13 -18.291  -2.967   3.592
  101    HE3  TRP  13           HE3      TRP  13 -14.369  -1.333   0.361
  102    HZ2  TRP  13           HZ2      TRP  13 -18.025  -0.166   3.547
  103    HZ3  TRP  13           HZ3      TRP  13 -14.867   1.008   0.931
  104    HH2  TRP  13           HH2      TRP  13 -16.656   1.578   2.488
  105    H    CYS  14           HN       CYS  14 -12.928  -7.521   2.194
  106    HA   CYS  14           HA       CYS  14 -10.959  -6.995   0.096
  107    HB2  CYS  14           HB2      CYS  14 -10.387  -5.666   1.988
  108    HB3  CYS  14           HB1      CYS  14 -10.538  -7.055   3.061
  109    H    GLY  15           HN       GLY  15 -10.413  -8.830  -0.836
  110    HA2  GLY  15           HA2      GLY  15  -9.944 -11.183   0.872
  111    HA3  GLY  15           HA1      GLY  15 -10.600 -11.331  -0.757
  112    H    TYR  16           HN       TYR  16  -9.276 -10.285  -2.465
  113    HA   TYR  16           HA       TYR  16  -6.733 -11.432  -2.573
  114    HB2  TYR  16           HB2      TYR  16  -6.457 -10.194  -4.742
  115    HB3  TYR  16           HB1      TYR  16  -7.938 -11.126  -4.623
  116    HD1  TYR  16           HD2      TYR  16 -10.086  -9.862  -4.074
  117    HD2  TYR  16           HD1      TYR  16  -6.520  -7.883  -5.260
  118    HE1  TYR  16           HE2      TYR  16 -11.394  -7.879  -4.648
  119    HE2  TYR  16           HE1      TYR  16  -7.834  -5.896  -5.863
  120    HH   TYR  16           HH       TYR  16 -11.076  -5.562  -4.853
  121    H    CYS  17           HN       CYS  17  -7.570  -8.408  -1.220
  122    HA   CYS  17           HA       CYS  17  -5.111  -7.076  -1.575
  123    HB2  CYS  17           HB2      CYS  17  -6.231  -6.219   0.831
  124    HB3  CYS  17           HB1      CYS  17  -6.426  -5.420  -0.707
  125    H    LEU  18           HN       LEU  18  -6.432  -9.369   0.774
  126    HA   LEU  18           HA       LEU  18  -4.570  -9.033   2.845
  127    HB2  LEU  18           HB2      LEU  18  -6.238 -11.409   2.109
  128    HB3  LEU  18           HB1      LEU  18  -5.358 -11.224   3.612
  129    HG   LEU  18           HG       LEU  18  -7.681  -9.536   2.690
  130   HD11  LEU  18          HD11      LEU  18  -8.798 -10.552   4.584
  131   HD12  LEU  18          HD12      LEU  18  -7.324 -11.491   4.892
  132   HD13  LEU  18          HD13      LEU  18  -8.249 -11.769   3.412
  133   HD21  LEU  18          HD21      LEU  18  -6.054  -9.403   5.225
  134   HD22  LEU  18          HD22      LEU  18  -7.545  -8.517   4.911
  135   HD23  LEU  18          HD23      LEU  18  -6.107  -8.175   3.958
  136    H    ARG  19           HN       ARG  19  -4.748 -11.051   0.034
  137    HA   ARG  19           HA       ARG  19  -2.682 -12.860   0.333
  138    HB2  ARG  19           HB2      ARG  19  -4.231 -12.828  -1.555
  139    HB3  ARG  19           HB1      ARG  19  -3.520 -11.331  -2.132
  140    HG2  ARG  19           HG2      ARG  19  -1.362 -12.584  -2.403
  141    HG3  ARG  19           HG1      ARG  19  -2.267 -14.064  -2.075
  142    HD2  ARG  19           HD2      ARG  19  -2.101 -13.730  -4.476
  143    HD3  ARG  19           HD1      ARG  19  -3.775 -13.523  -3.942
  144    HE   ARG  19           HE       ARG  19  -2.098 -11.157  -4.202
  145   HH11  ARG  19          HH11      ARG  19  -4.756 -13.096  -5.533
  146   HH12  ARG  19          HH12      ARG  19  -5.379 -11.873  -6.525
  147   HH21  ARG  19          HH21      ARG  19  -2.920  -9.433  -5.608
  148   HH22  ARG  19          HH22      ARG  19  -4.295  -9.700  -6.557
  149    H    LEU  20           HN       LEU  20  -2.569  -9.569  -0.953
  150    HA   LEU  20           HA       LEU  20   0.202  -9.635  -1.418
  151    HB2  LEU  20           HB2      LEU  20  -1.174  -8.226  -2.785
  152    HB3  LEU  20           HB1      LEU  20  -1.789  -7.381  -1.384
  153    HG   LEU  20           HG       LEU  20   0.650  -6.595  -1.054
  154   HD11  LEU  20          HD11      LEU  20   0.827  -7.478  -3.922
  155   HD12  LEU  20          HD12      LEU  20   1.958  -7.849  -2.594
  156   HD13  LEU  20          HD13      LEU  20   1.822  -6.233  -3.221
  157   HD21  LEU  20          HD21      LEU  20  -1.047  -5.582  -3.308
  158   HD22  LEU  20          HD22      LEU  20   0.275  -4.687  -2.544
  159   HD23  LEU  20          HD23      LEU  20  -1.162  -5.117  -1.610
  160    H    LYS  21           HN       LYS  21  -1.841  -8.169   1.109
  161    HA   LYS  21           HA       LYS  21   0.413  -6.841   2.186
  162    HB2  LYS  21           HB2      LYS  21  -0.984  -5.759   3.699
  163    HB3  LYS  21           HB1      LYS  21  -2.053  -6.121   2.364
  164    HG2  LYS  21           HG2      LYS  21  -2.929  -8.039   3.658
  165    HG3  LYS  21           HG1      LYS  21  -1.933  -7.513   5.022
  166    HD2  LYS  21           HD2      LYS  21  -3.040  -5.210   4.707
  167    HD3  LYS  21           HD1      LYS  21  -4.213  -6.050   3.704
  168    HE2  LYS  21           HE2      LYS  21  -5.190  -5.948   5.838
  169    HE3  LYS  21           HE1      LYS  21  -4.583  -7.594   5.673
  170    HZ1  LYS  21           HZ1      LYS  21  -3.981  -6.888   7.803
  171    HZ2  LYS  21           HZ2      LYS  21  -3.533  -5.385   7.325
  172    HZ3  LYS  21           HZ3      LYS  21  -2.519  -6.699   6.963
  173    H    THR  22           HN       THR  22  -0.924  -9.985   2.799
  174    HA   THR  22           HA       THR  22   0.615 -10.339   5.179
  175    HB   THR  22           HB       THR  22   0.160 -12.816   4.794
  176    HG1  THR  22           HG1      THR  22  -1.675 -11.941   2.842
  177   HG21  THR  22          HG21      THR  22  -2.216 -10.947   4.822
  178   HG22  THR  22          HG22      THR  22  -1.281 -11.455   6.231
  179   HG23  THR  22          HG23      THR  22  -2.234 -12.632   5.332
  180    H    ALA  23           HN       ALA  23   1.193 -10.712   1.770
  181    HA   ALA  23           HA       ALA  23   3.693 -12.120   1.907
  182    HB1  ALA  23           HB1      ALA  23   2.391 -11.864  -0.195
  183    HB2  ALA  23           HB2      ALA  23   4.043 -11.252  -0.351
  184    HB3  ALA  23           HB3      ALA  23   2.694 -10.128  -0.131
  185    H    LEU  24           HN       LEU  24   2.795  -8.756   1.911
  186    HA   LEU  24           HA       LEU  24   5.396  -7.724   2.093
  187    HB2  LEU  24           HB2      LEU  24   2.823  -6.590   3.170
  188    HB3  LEU  24           HB1      LEU  24   4.301  -5.669   2.956
  189    HG   LEU  24           HG       LEU  24   2.545  -6.853   0.802
  190   HD11  LEU  24          HD11      LEU  24   1.661  -4.831   1.777
  191   HD12  LEU  24          HD12      LEU  24   2.227  -4.532   0.133
  192   HD13  LEU  24          HD13      LEU  24   3.196  -4.007   1.508
  193   HD21  LEU  24          HD21      LEU  24   4.069  -5.796  -0.806
  194   HD22  LEU  24          HD22      LEU  24   4.867  -7.065   0.121
  195   HD23  LEU  24          HD23      LEU  24   5.154  -5.369   0.516
  196    H    THR  25           HN       THR  25   3.036  -8.525   4.605
  197    HA   THR  25           HA       THR  25   4.517  -7.828   6.857
  198    HB   THR  25           HB       THR  25   2.570 -10.157   6.653
  199    HG1  THR  25           HG1      THR  25   1.564  -8.237   5.908
  200   HG21  THR  25          HG21      THR  25   3.333  -8.397   8.989
  201   HG22  THR  25          HG22      THR  25   3.860 -10.060   8.738
  202   HG23  THR  25          HG23      THR  25   2.154  -9.713   9.022
  203    H    ALA  26           HN       ALA  26   4.365 -10.964   5.153
  204    HA   ALA  26           HA       ALA  26   6.104 -12.409   6.825
  205    HB1  ALA  26           HB1      ALA  26   6.206 -14.029   5.020
  206    HB2  ALA  26           HB2      ALA  26   5.551 -12.839   3.895
  207    HB3  ALA  26           HB3      ALA  26   4.553 -13.440   5.216
  208    H    ASN  27           HN       ASN  27   6.722 -10.149   4.334
  209    HA   ASN  27           HA       ASN  27   9.510 -10.949   4.131
  210    HB2  ASN  27           HB2      ASN  27   7.663  -9.344   2.504
  211    HB3  ASN  27           HB1      ASN  27   9.397  -8.941   2.364
  212   HD21  ASN  27          HD21      ASN  27   6.838 -11.057   1.621
  213   HD22  ASN  27          HD22      ASN  27   7.718 -12.175   0.644
  214    H    ARG  28           HN       ARG  28   7.902  -9.257   6.272
  215    HA   ARG  28           HA       ARG  28   8.380  -7.728   7.814
  216    HB2  ARG  28           HB2      ARG  28  11.166  -8.107   6.754
  217    HB3  ARG  28           HB1      ARG  28  10.828  -6.922   8.005
  218    HG2  ARG  28           HG2      ARG  28  10.277  -9.881   8.197
  219    HG3  ARG  28           HG1      ARG  28  11.629  -9.024   8.949
  220    HD2  ARG  28           HD2      ARG  28   8.684  -8.637   9.538
  221    HD3  ARG  28           HD1      ARG  28   9.898  -9.354  10.582
  222    HE   ARG  28           HE       ARG  28  11.016  -7.127  10.532
  223   HH11  ARG  28          HH11      ARG  28   7.480  -7.327  10.091
  224   HH12  ARG  28          HH12      ARG  28   7.223  -5.744  10.671
  225   HH21  ARG  28          HH21      ARG  28  10.585  -5.010  11.331
  226   HH22  ARG  28          HH22      ARG  28   8.987  -4.426  11.425
  227    H    ILE  29           HN       ILE  29   7.557  -6.974   5.147
  228    HA   ILE  29           HA       ILE  29   8.599  -4.304   4.888
  229    HB   ILE  29           HB       ILE  29   6.398  -5.782   3.408
  230   HG12  ILE  29          HG12      ILE  29   9.191  -4.983   2.550
  231   HG13  ILE  29          HG11      ILE  29   8.679  -6.610   2.974
  232   HG21  ILE  29          HG21      ILE  29   6.456  -3.880   1.816
  233   HG22  ILE  29          HG22      ILE  29   7.519  -3.025   2.950
  234   HG23  ILE  29          HG23      ILE  29   5.883  -3.436   3.423
  235   HD11  ILE  29          HD11      ILE  29   8.843  -6.332   0.576
  236   HD12  ILE  29          HD12      ILE  29   7.704  -4.988   0.631
  237   HD13  ILE  29          HD13      ILE  29   7.167  -6.618   1.043
  238    H    ALA  30           HN       ALA  30   7.824  -2.667   5.993
  239    HA   ALA  30           HA       ALA  30   5.580  -3.126   7.731
  240    HB1  ALA  30           HB1      ALA  30   6.263  -1.049   8.806
  241    HB2  ALA  30           HB2      ALA  30   7.443  -0.778   7.521
  242    HB3  ALA  30           HB3      ALA  30   7.633  -2.148   8.614
  243    H    TYR  31           HN       TYR  31   3.603  -2.357   7.418
  244    HA   TYR  31           HA       TYR  31   3.207  -0.061   5.667
  245    HB2  TYR  31           HB2      TYR  31   1.375  -1.152   4.466
  246    HB3  TYR  31           HB1      TYR  31   2.859  -2.061   4.234
  247    HD1  TYR  31           HD2      TYR  31  -0.469  -2.064   5.788
  248    HD2  TYR  31           HD1      TYR  31   3.098  -4.293   5.155
  249    HE1  TYR  31           HE2      TYR  31  -1.618  -4.091   6.544
  250    HE2  TYR  31           HE1      TYR  31   1.962  -6.320   5.896
  251    HH   TYR  31           HH       TYR  31   0.086  -6.992   7.210
  252    H    ASP  32           HN       ASP  32   0.884   0.705   5.883
  253    HA   ASP  32           HA       ASP  32  -0.316  -0.147   8.392
  254    HB2  ASP  32           HB2      ASP  32   0.937   1.902   8.905
  255    HB3  ASP  32           HB1      ASP  32   0.130   2.721   7.568
  256    H    GLU  33           HN       GLU  33  -2.516  -0.003   8.418
  257    HA   GLU  33           HA       GLU  33  -3.688   0.296   5.764
  258    HB2  GLU  33           HB2      GLU  33  -5.422  -1.314   6.579
  259    HB3  GLU  33           HB1      GLU  33  -3.805  -1.958   6.479
  260    HG2  GLU  33           HG2      GLU  33  -3.547  -1.597   8.925
  261    HG3  GLU  33           HG1      GLU  33  -5.246  -1.138   8.985
  262    H    VAL  34           HN       VAL  34  -5.326   1.595   5.425
  263    HA   VAL  34           HA       VAL  34  -5.705   3.710   7.346
  264    HB   VAL  34           HB       VAL  34  -7.018   3.524   4.628
  265   HG11  VAL  34          HG11      VAL  34  -6.377   5.921   6.334
  266   HG12  VAL  34          HG12      VAL  34  -7.968   5.209   6.070
  267   HG13  VAL  34          HG13      VAL  34  -7.106   5.952   4.723
  268   HG21  VAL  34          HG21      VAL  34  -4.619   3.252   4.377
  269   HG22  VAL  34          HG22      VAL  34  -4.340   4.698   5.351
  270   HG23  VAL  34          HG23      VAL  34  -5.132   4.830   3.782
  271    H    ASP  35           HN       ASP  35  -7.443   4.448   8.293
  272    HA   ASP  35           HA       ASP  35  -9.428   2.876   9.452
  273    HB2  ASP  35           HB2      ASP  35  -9.464   5.875   9.164
  274    HB3  ASP  35           HB1      ASP  35 -10.353   4.926  10.335
  275    H    ILE  36           HN       ILE  36  -9.584   3.668   6.293
  276    HA   ILE  36           HA       ILE  36 -11.729   5.297   5.733
  277    HB   ILE  36           HB       ILE  36 -11.995   4.194   3.564
  278   HG12  ILE  36          HG12      ILE  36  -9.826   2.316   4.481
  279   HG13  ILE  36          HG11      ILE  36 -11.532   1.876   4.438
  280   HG21  ILE  36          HG21      ILE  36  -9.733   4.674   2.774
  281   HG22  ILE  36          HG22      ILE  36  -9.172   4.691   4.452
  282   HG23  ILE  36          HG23      ILE  36 -10.338   5.894   3.894
  283   HD11  ILE  36          HD11      ILE  36 -10.248   1.119   2.472
  284   HD12  ILE  36          HD12      ILE  36 -10.003   2.846   2.064
  285   HD13  ILE  36          HD13      ILE  36 -11.621   2.161   2.105
  286    H    GLU  37           HN       GLU  37 -12.149   1.979   6.845
  287    HA   GLU  37           HA       GLU  37 -14.760   1.726   5.771
  288    HB2  GLU  37           HB2      GLU  37 -13.175  -0.149   6.737
  289    HB3  GLU  37           HB1      GLU  37 -13.855   0.337   8.265
  290    HG2  GLU  37           HG2      GLU  37 -16.088  -0.148   7.508
  291    HG3  GLU  37           HG1      GLU  37 -15.471  -0.615   5.926
  292    H    HIS  38           HN       HIS  38 -13.379   3.237   8.505
  293    HA   HIS  38           HA       HIS  38 -15.965   3.675   9.790
  294    HB2  HIS  38           HB2      HIS  38 -13.156   4.266  10.753
  295    HB3  HIS  38           HB1      HIS  38 -14.618   4.639  11.656
  296    HD1  HIS  38           HD1      HIS  38 -15.535   2.778  13.128
  297    HD2  HIS  38           HD2      HIS  38 -12.714   1.438  10.385
  298    HE1  HIS  38           HE1      HIS  38 -15.090   0.378  13.695
  299    H    ASN  39           HN       ASN  39 -13.342   5.366   8.186
  300    HA   ASN  39           HA       ASN  39 -15.059   7.709   8.317
  301    HB2  ASN  39           HB2      ASN  39 -13.117   9.222   8.056
  302    HB3  ASN  39           HB1      ASN  39 -13.071   8.316   9.558
  303   HD21  ASN  39          HD21      ASN  39 -11.925   7.404   6.250
  304   HD22  ASN  39          HD22      ASN  39 -10.277   7.353   6.773
  305    H    ARG  40           HN       ARG  40 -15.908   8.474   6.688
  306    HA   ARG  40           HA       ARG  40 -15.494   7.127   4.193
  307    HB2  ARG  40           HB2      ARG  40 -17.413   8.424   3.276
  308    HB3  ARG  40           HB1      ARG  40 -17.798   7.487   4.701
  309    HG2  ARG  40           HG2      ARG  40 -17.142  10.400   4.934
  310    HG3  ARG  40           HG1      ARG  40 -18.756   9.881   4.439
  311    HD2  ARG  40           HD2      ARG  40 -18.949   8.564   6.495
  312    HD3  ARG  40           HD1      ARG  40 -17.352   9.088   7.008
  313    HE   ARG  40           HE       ARG  40 -18.920  11.319   6.490
  314   HH11  ARG  40          HH11      ARG  40 -18.683   8.660   8.858
  315   HH12  ARG  40          HH12      ARG  40 -19.370   9.557  10.113
  316   HH21  ARG  40          HH21      ARG  40 -19.892  12.525   8.241
  317   HH22  ARG  40          HH22      ARG  40 -20.087  11.797   9.763
  318    H    ALA  41           HN       ALA  41 -14.374  10.029   5.497
  319    HA   ALA  41           HA       ALA  41 -14.114  11.514   3.159
  320    HB1  ALA  41           HB1      ALA  41 -12.453  12.857   4.321
  321    HB2  ALA  41           HB2      ALA  41 -12.285  11.579   5.529
  322    HB3  ALA  41           HB3      ALA  41 -13.804  12.464   5.393
  323    H    ALA  42           HN       ALA  42 -11.673   9.474   4.696
  324    HA   ALA  42           HA       ALA  42  -9.951   9.630   2.444
  325    HB1  ALA  42           HB1      ALA  42  -9.976   7.650   4.717
  326    HB2  ALA  42           HB2      ALA  42  -9.046   9.145   4.652
  327    HB3  ALA  42           HB3      ALA  42  -8.676   7.826   3.543
  328    H    ALA  43           HN       ALA  43 -12.718   7.728   3.148
  329    HA   ALA  43           HA       ALA  43 -12.119   5.486   1.505
  330    HB1  ALA  43           HB1      ALA  43 -13.860   5.418   3.273
  331    HB2  ALA  43           HB2      ALA  43 -14.472   4.906   1.701
  332    HB3  ALA  43           HB3      ALA  43 -14.837   6.520   2.302
  333    H    GLU  44           HN       GLU  44 -13.666   8.580   0.936
  334    HA   GLU  44           HA       GLU  44 -14.427   7.974  -1.742
  335    HB2  GLU  44           HB2      GLU  44 -14.083  10.642  -0.362
  336    HB3  GLU  44           HB1      GLU  44 -14.811  10.419  -1.945
  337    HG2  GLU  44           HG2      GLU  44 -15.859   9.344   0.667
  338    HG3  GLU  44           HG1      GLU  44 -16.523  10.684  -0.264
  339    H    PHE  45           HN       PHE  45 -11.597   9.194  -0.201
  340    HA   PHE  45           HA       PHE  45 -10.255  10.257  -2.451
  341    HB2  PHE  45           HB2      PHE  45  -9.602  10.732  -0.107
  342    HB3  PHE  45           HB1      PHE  45  -9.101   9.061   0.089
  343    HD1  PHE  45           HD1      PHE  45  -8.401  12.140  -1.860
  344    HD2  PHE  45           HD2      PHE  45  -6.899   8.442  -0.388
  345    HE1  PHE  45           HE1      PHE  45  -6.139  12.778  -2.582
  346    HE2  PHE  45           HE2      PHE  45  -4.634   9.072  -1.109
  347    HZ   PHE  45           HZ       PHE  45  -4.251  11.241  -2.206
  348    H    VAL  46           HN       VAL  46 -10.638   7.054  -1.191
  349    HA   VAL  46           HA       VAL  46  -8.680   5.707  -2.691
  350    HB   VAL  46           HB       VAL  46 -11.373   4.612  -1.799
  351   HG11  VAL  46          HG11      VAL  46 -10.273   3.176  -3.435
  352   HG12  VAL  46          HG12      VAL  46 -10.270   2.420  -1.835
  353   HG13  VAL  46          HG13      VAL  46  -8.806   3.182  -2.457
  354   HG21  VAL  46          HG21      VAL  46  -8.724   4.589  -0.360
  355   HG22  VAL  46          HG22      VAL  46 -10.204   3.798   0.182
  356   HG23  VAL  46          HG23      VAL  46 -10.133   5.559   0.075
  357    H    GLY  47           HN       GLY  47 -11.860   6.897  -3.514
  358    HA2  GLY  47           HA2      GLY  47 -12.165   5.428  -5.946
  359    HA3  GLY  47           HA1      GLY  47 -13.067   6.866  -5.475
  360    H    SER  48           HN       SER  48 -11.021   8.645  -5.101
  361    HA   SER  48           HA       SER  48 -10.563   9.566  -7.689
  362    HB2  SER  48           HB2      SER  48  -9.235  10.411  -5.110
  363    HB3  SER  48           HB1      SER  48  -9.360  11.367  -6.590
  364    HG   SER  48           HG       SER  48 -11.005  11.603  -4.747
  365    H    VAL  49           HN       VAL  49  -8.554   7.561  -5.582
  366    HA   VAL  49           HA       VAL  49  -6.247   7.968  -7.283
  367    HB   VAL  49           HB       VAL  49  -5.017   6.398  -5.868
  368   HG11  VAL  49          HG11      VAL  49  -5.099   8.698  -5.177
  369   HG12  VAL  49          HG12      VAL  49  -5.100   7.649  -3.757
  370   HG13  VAL  49          HG13      VAL  49  -6.597   8.412  -4.291
  371   HG21  VAL  49          HG21      VAL  49  -6.058   5.427  -3.848
  372   HG22  VAL  49          HG22      VAL  49  -6.767   4.807  -5.340
  373   HG23  VAL  49          HG23      VAL  49  -7.623   6.027  -4.403
  374    H    ASN  50           HN       ASN  50  -8.924   6.177  -7.560
  375    HA   ASN  50           HA       ASN  50  -7.577   4.120  -9.168
  376    HB2  ASN  50           HB2      ASN  50 -10.295   4.170  -7.878
  377    HB3  ASN  50           HB1      ASN  50 -10.000   3.130  -9.259
  378   HD21  ASN  50          HD21      ASN  50  -9.311   3.699  -5.900
  379   HD22  ASN  50          HD22      ASN  50  -8.546   2.183  -5.588
  380    H    GLY  51           HN       GLY  51 -10.362   6.312  -9.241
  381    HA2  GLY  51           HA2      GLY  51 -10.089   7.736 -11.385
  382    HA3  GLY  51           HA1      GLY  51 -10.344   6.172 -12.156
  383    H    GLY  52           HN       GLY  52 -12.162   5.144 -10.286
  384    HA2  GLY  52           HA2      GLY  52 -14.372   6.928  -9.977
  385    HA3  GLY  52           HA1      GLY  52 -14.576   5.837 -11.346
  386    H    ASN  53           HN       ASN  53 -13.461   3.534 -10.453
  387    HA   ASN  53           HA       ASN  53 -15.411   2.739  -8.446
  388    HB2  ASN  53           HB2      ASN  53 -14.865   0.442  -9.020
  389    HB3  ASN  53           HB1      ASN  53 -15.080   1.337 -10.516
  390   HD21  ASN  53          HD21      ASN  53 -13.675  -1.150  -9.980
  391   HD22  ASN  53          HD22      ASN  53 -12.045  -0.919 -10.487
  392    H    ARG  54           HN       ARG  54 -14.390   0.936  -6.877
  393    HA   ARG  54           HA       ARG  54 -11.858   2.039  -5.960
  394    HB2  ARG  54           HB2      ARG  54 -14.276   1.473  -4.296
  395    HB3  ARG  54           HB1      ARG  54 -12.673   1.521  -3.583
  396    HG2  ARG  54           HG2      ARG  54 -12.399   3.807  -4.445
  397    HG3  ARG  54           HG1      ARG  54 -14.038   3.739  -5.087
  398    HD2  ARG  54           HD2      ARG  54 -13.324   3.384  -2.189
  399    HD3  ARG  54           HD1      ARG  54 -13.811   4.915  -2.911
  400    HE   ARG  54           HE       ARG  54 -15.622   2.663  -3.212
  401   HH11  ARG  54          HH11      ARG  54 -14.800   5.629  -1.515
  402   HH12  ARG  54          HH12      ARG  54 -16.354   5.977  -0.960
  403   HH21  ARG  54          HH21      ARG  54 -17.776   2.989  -2.349
  404   HH22  ARG  54          HH22      ARG  54 -18.104   4.356  -1.386
  405    H    THR  55           HN       THR  55 -10.361   0.700  -6.042
  406    HA   THR  55           HA       THR  55 -10.797  -2.163  -5.694
  407    HB   THR  55           HB       THR  55  -8.242  -0.667  -6.325
  408    HG1  THR  55           HG1      THR  55  -9.245  -0.172  -8.118
  409   HG21  THR  55          HG21      THR  55  -7.565  -2.781  -7.309
  410   HG22  THR  55          HG22      THR  55  -9.159  -3.474  -6.985
  411   HG23  THR  55          HG23      THR  55  -8.099  -3.043  -5.644
  412    H    VAL  56           HN       VAL  56  -9.549  -3.239  -3.964
  413    HA   VAL  56           HA       VAL  56  -9.227  -1.451  -1.767
  414    HB   VAL  56           HB       VAL  56  -8.615  -4.394  -1.670
  415   HG11  VAL  56          HG11      VAL  56  -8.664  -4.049   0.752
  416   HG12  VAL  56          HG12      VAL  56  -9.141  -2.373   0.483
  417   HG13  VAL  56          HG13      VAL  56  -7.530  -2.873   0.037
  418   HG21  VAL  56          HG21      VAL  56 -10.691  -4.569  -0.598
  419   HG22  VAL  56          HG22      VAL  56 -10.917  -3.771  -2.208
  420   HG23  VAL  56          HG23      VAL  56 -10.875  -2.812  -0.702
  421    HA   PRO  57           HA       PRO  57  -5.330  -2.839  -1.182
  422    HB2  PRO  57           HB2      PRO  57  -3.476  -4.293  -2.623
  423    HB3  PRO  57           HB1      PRO  57  -4.625  -4.949  -1.468
  424    HG2  PRO  57           HG2      PRO  57  -4.788  -4.912  -4.424
  425    HG3  PRO  57           HG1      PRO  57  -5.528  -6.044  -3.285
  426    HD2  PRO  57           HD2      PRO  57  -6.712  -3.841  -4.579
  427    HD3  PRO  57           HD1      PRO  57  -7.437  -4.899  -3.326
  428    H    THR  58           HN       THR  58  -4.938  -0.703  -1.712
  429    HA   THR  58           HA       THR  58  -3.426   0.071  -4.055
  430    HB   THR  58           HB       THR  58  -5.608   1.463  -2.487
  431    HG1  THR  58           HG1      THR  58  -6.626   0.034  -3.651
  432   HG21  THR  58          HG21      THR  58  -4.017   3.077  -3.536
  433   HG22  THR  58          HG22      THR  58  -5.611   3.078  -4.333
  434   HG23  THR  58          HG23      THR  58  -4.269   2.235  -5.079
  435    H    VAL  59           HN       VAL  59  -1.558   0.949  -3.488
  436    HA   VAL  59           HA       VAL  59  -1.131   1.624  -0.663
  437    HB   VAL  59           HB       VAL  59   0.103  -0.408  -1.256
  438   HG11  VAL  59          HG11      VAL  59   0.166  -0.272  -3.565
  439   HG12  VAL  59          HG12      VAL  59   1.843  -0.371  -2.996
  440   HG13  VAL  59          HG13      VAL  59   1.138   1.183  -3.509
  441   HG21  VAL  59          HG21      VAL  59   2.399   0.268  -0.743
  442   HG22  VAL  59          HG22      VAL  59   1.245   1.129   0.273
  443   HG23  VAL  59          HG23      VAL  59   1.989   1.947  -1.103
  444    H    LYS  60           HN       LYS  60  -0.326   3.526  -0.191
  445    HA   LYS  60           HA       LYS  60   0.644   5.228  -2.367
  446    HB2  LYS  60           HB2      LYS  60  -1.394   6.074  -1.172
  447    HB3  LYS  60           HB1      LYS  60  -0.484   6.056   0.324
  448    HG2  LYS  60           HG2      LYS  60   0.957   7.809  -0.428
  449    HG3  LYS  60           HG1      LYS  60   0.292   7.725  -2.059
  450    HD2  LYS  60           HD2      LYS  60  -0.675   9.633  -0.953
  451    HD3  LYS  60           HD1      LYS  60  -1.919   8.402  -1.121
  452    HE2  LYS  60           HE2      LYS  60  -2.089   9.383   1.066
  453    HE3  LYS  60           HE1      LYS  60  -1.501   7.733   1.247
  454    HZ1  LYS  60           HZ1      LYS  60   0.741   8.604   1.568
  455    HZ2  LYS  60           HZ2      LYS  60  -0.309   9.350   2.644
  456    HZ3  LYS  60           HZ3      LYS  60   0.199  10.163   1.280
  457    H    PHE  61           HN       PHE  61   2.686   5.650  -2.354
  458    HA   PHE  61           HA       PHE  61   4.375   4.800  -0.126
  459    HB2  PHE  61           HB2      PHE  61   5.052   5.662  -2.940
  460    HB3  PHE  61           HB1      PHE  61   6.235   5.209  -1.719
  461    HD1  PHE  61           HD2      PHE  61   3.460   3.943  -3.795
  462    HD2  PHE  61           HD1      PHE  61   6.688   2.973  -1.216
  463    HE1  PHE  61           HE2      PHE  61   3.245   1.582  -4.414
  464    HE2  PHE  61           HE1      PHE  61   6.481   0.627  -1.818
  465    HZ   PHE  61           HZ       PHE  61   4.752  -0.095  -3.427
  466    H    ALA  62           HN       ALA  62   6.443   6.239   0.099
  467    HA   ALA  62           HA       ALA  62   5.591   8.664   1.255
  468    HB1  ALA  62           HB1      ALA  62   7.859   9.015   1.903
  469    HB2  ALA  62           HB2      ALA  62   8.439   7.915   0.671
  470    HB3  ALA  62           HB3      ALA  62   7.528   7.286   2.050
  471    H    ASP  63           HN       ASP  63   6.743   7.946  -1.903
  472    HA   ASP  63           HA       ASP  63   7.337  10.704  -2.526
  473    HB2  ASP  63           HB2      ASP  63   7.219   8.237  -4.269
  474    HB3  ASP  63           HB1      ASP  63   7.412   9.842  -4.953
  475    H    GLY  64           HN       GLY  64   4.555   9.216  -1.937
  476    HA2  GLY  64           HA2      GLY  64   2.430  10.089  -2.170
  477    HA3  GLY  64           HA1      GLY  64   3.035  11.205  -3.389
  478    H    SER  65           HN       SER  65   4.210   8.301  -4.231
  479    HA   SER  65           HA       SER  65   2.551   7.982  -6.476
  480    HB2  SER  65           HB2      SER  65   4.404   5.945  -5.242
  481    HB3  SER  65           HB1      SER  65   3.942   6.096  -6.939
  482    HG   SER  65           HG       SER  65   4.934   8.278  -6.740
  483    H    THR  66           HN       THR  66   0.658   6.840  -6.645
  484    HA   THR  66           HA       THR  66  -0.020   4.990  -4.481
  485    HB   THR  66           HB       THR  66  -2.390   5.379  -5.456
  486    HG1  THR  66           HG1      THR  66  -2.609   6.937  -6.918
  487   HG21  THR  66          HG21      THR  66  -2.728   7.403  -4.097
  488   HG22  THR  66          HG22      THR  66  -0.981   7.648  -4.042
  489   HG23  THR  66          HG23      THR  66  -1.698   6.236  -3.267
  490    H    LEU  67           HN       LEU  67  -0.459   2.930  -5.074
  491    HA   LEU  67           HA       LEU  67  -0.761   2.331  -7.933
  492    HB2  LEU  67           HB2      LEU  67   1.022   0.833  -6.021
  493    HB3  LEU  67           HB1      LEU  67   0.585   0.251  -7.610
  494    HG   LEU  67           HG       LEU  67   2.332   2.622  -6.936
  495   HD11  LEU  67          HD11      LEU  67   3.394   0.424  -6.666
  496   HD12  LEU  67          HD12      LEU  67   4.076   1.324  -8.028
  497   HD13  LEU  67          HD13      LEU  67   2.936   0.018  -8.320
  498   HD21  LEU  67          HD21      LEU  67   1.089   3.193  -8.957
  499   HD22  LEU  67          HD22      LEU  67   1.452   1.614  -9.654
  500   HD23  LEU  67          HD23      LEU  67   2.746   2.774  -9.383
  501    H    THR  68           HN       THR  68  -2.504   1.355  -8.268
  502    HA   THR  68           HA       THR  68  -3.845  -0.162  -6.217
  503    HB   THR  68           HB       THR  68  -4.573   0.596  -9.049
  504    HG1  THR  68           HG1      THR  68  -5.641   1.515  -6.584
  505   HG21  THR  68          HG21      THR  68  -5.678  -1.474  -8.408
  506   HG22  THR  68          HG22      THR  68  -6.848  -0.150  -8.449
  507   HG23  THR  68          HG23      THR  68  -6.219  -0.736  -6.905
  508    H    ASN  69           HN       ASN  69  -3.513  -2.263  -6.056
  509    HA   ASN  69           HA       ASN  69  -2.822  -4.337  -6.367
  510    HB2  ASN  69           HB2      ASN  69  -3.738  -3.921  -9.223
  511    HB3  ASN  69           HB1      ASN  69  -3.230  -5.469  -8.577
  512   HD21  ASN  69          HD21      ASN  69  -5.725  -4.826  -9.724
  513   HD22  ASN  69          HD22      ASN  69  -6.934  -5.089  -8.531
  514    HA   PRO  70           HA       PRO  70   1.305  -3.526  -8.201
  515    HB2  PRO  70           HB2      PRO  70   2.746  -3.194  -5.988
  516    HB3  PRO  70           HB1      PRO  70   1.808  -1.839  -6.631
  517    HG2  PRO  70           HG2      PRO  70   1.079  -3.752  -4.443
  518    HG3  PRO  70           HG1      PRO  70   1.019  -1.976  -4.419
  519    HD2  PRO  70           HD2      PRO  70  -1.195  -3.463  -4.927
  520    HD3  PRO  70           HD1      PRO  70  -0.889  -1.898  -5.701
  521    H    SER  71           HN       SER  71   3.328  -4.887  -7.438
  522    HA   SER  71           HA       SER  71   2.358  -7.501  -6.524
  523    HB2  SER  71           HB2      SER  71   4.875  -6.995  -8.103
  524    HB3  SER  71           HB1      SER  71   3.973  -8.502  -7.919
  525    HG   SER  71           HG       SER  71   3.606  -6.366  -9.554
  526    H    ALA  72           HN       ALA  72   3.767  -8.654  -5.085
  527    HA   ALA  72           HA       ALA  72   4.576  -7.198  -2.887
  528    HB1  ALA  72           HB1      ALA  72   3.926  -9.555  -2.830
  529    HB2  ALA  72           HB2      ALA  72   5.441  -9.262  -1.979
  530    HB3  ALA  72           HB3      ALA  72   5.459  -9.986  -3.587
  531    H    ASP  73           HN       ASP  73   6.688  -8.445  -5.452
  532    HA   ASP  73           HA       ASP  73   9.061  -7.590  -4.038
  533    HB2  ASP  73           HB2      ASP  73   9.088  -9.539  -5.614
  534    HB3  ASP  73           HB1      ASP  73   8.850  -8.409  -6.946
  535    H    GLU  74           HN       GLU  74   7.027  -6.381  -6.571
  536    HA   GLU  74           HA       GLU  74   8.652  -4.205  -7.351
  537    HB2  GLU  74           HB2      GLU  74   5.645  -4.437  -7.475
  538    HB3  GLU  74           HB1      GLU  74   6.606  -3.214  -8.281
  539    HG2  GLU  74           HG2      GLU  74   7.745  -5.038  -9.554
  540    HG3  GLU  74           HG1      GLU  74   6.600  -6.179  -8.862
  541    H    VAL  75           HN       VAL  75   6.184  -4.580  -4.866
  542    HA   VAL  75           HA       VAL  75   6.097  -1.925  -3.981
  543    HB   VAL  75           HB       VAL  75   5.707  -4.470  -2.351
  544   HG11  VAL  75          HG11      VAL  75   4.522  -3.075  -0.713
  545   HG12  VAL  75          HG12      VAL  75   4.953  -1.631  -1.631
  546   HG13  VAL  75          HG13      VAL  75   6.213  -2.597  -0.864
  547   HG21  VAL  75          HG21      VAL  75   4.111  -4.225  -4.172
  548   HG22  VAL  75          HG22      VAL  75   3.702  -2.603  -3.610
  549   HG23  VAL  75          HG23      VAL  75   3.321  -4.008  -2.612
  550    H    LYS  76           HN       LYS  76   8.179  -4.603  -3.141
  551    HA   LYS  76           HA       LYS  76   9.660  -3.379  -1.094
  552    HB2  LYS  76           HB2      LYS  76   9.657  -5.785  -1.434
  553    HB3  LYS  76           HB1      LYS  76  10.391  -5.577  -3.017
  554    HG2  LYS  76           HG2      LYS  76  12.417  -4.776  -2.008
  555    HG3  LYS  76           HG1      LYS  76  11.721  -4.911  -0.383
  556    HD2  LYS  76           HD2      LYS  76  13.179  -6.797  -0.882
  557    HD3  LYS  76           HD1      LYS  76  11.507  -7.349  -0.764
  558    HE2  LYS  76           HE2      LYS  76  11.310  -7.371  -3.181
  559    HE3  LYS  76           HE1      LYS  76  12.941  -6.721  -3.346
  560    HZ1  LYS  76           HZ1      LYS  76  12.753  -9.119  -3.713
  561    HZ2  LYS  76           HZ2      LYS  76  12.306  -9.330  -2.090
  562    HZ3  LYS  76           HZ3      LYS  76  13.820  -8.730  -2.465
  563    H    ALA  77           HN       ALA  77  10.176  -3.491  -4.596
  564    HA   ALA  77           HA       ALA  77  12.677  -2.118  -4.559
  565    HB1  ALA  77           HB1      ALA  77  11.947  -3.526  -6.444
  566    HB2  ALA  77           HB2      ALA  77  12.394  -1.905  -6.967
  567    HB3  ALA  77           HB3      ALA  77  10.692  -2.350  -6.827
  568    H    LYS  78           HN       LYS  78   9.368  -1.037  -4.715
  569    HA   LYS  78           HA       LYS  78  10.083   1.732  -5.158
  570    HB2  LYS  78           HB2      LYS  78   7.520   0.418  -4.263
  571    HB3  LYS  78           HB1      LYS  78   7.688   2.142  -4.587
  572    HG2  LYS  78           HG2      LYS  78   8.170  -0.034  -6.608
  573    HG3  LYS  78           HG1      LYS  78   6.643   0.828  -6.413
  574    HD2  LYS  78           HD2      LYS  78   7.747   2.932  -6.926
  575    HD3  LYS  78           HD1      LYS  78   9.300   2.106  -7.065
  576    HE2  LYS  78           HE2      LYS  78   6.881   1.577  -8.780
  577    HE3  LYS  78           HE1      LYS  78   8.251   2.581  -9.248
  578    HZ1  LYS  78           HZ1      LYS  78   9.672   0.623  -9.013
  579    HZ2  LYS  78           HZ2      LYS  78   8.514   0.425 -10.182
  580    HZ3  LYS  78           HZ3      LYS  78   8.339  -0.359  -8.711
  581    H    LEU  79           HN       LEU  79   9.579  -0.364  -2.475
  582    HA   LEU  79           HA       LEU  79   9.351   1.565  -0.485
  583    HB2  LEU  79           HB2      LEU  79   8.882  -0.977  -0.251
  584    HB3  LEU  79           HB1      LEU  79  10.595  -1.159  -0.242
  585    HG   LEU  79           HG       LEU  79  10.738   0.107   1.839
  586   HD11  LEU  79          HD11      LEU  79   8.689   1.466   1.838
  587   HD12  LEU  79          HD12      LEU  79   8.712   0.379   3.210
  588   HD13  LEU  79          HD13      LEU  79   7.735  -0.020   1.814
  589   HD21  LEU  79          HD21      LEU  79   9.805  -1.699   3.236
  590   HD22  LEU  79          HD22      LEU  79  10.746  -2.274   1.855
  591   HD23  LEU  79          HD23      LEU  79   8.986  -2.319   1.799
  592    H    VAL  80           HN       VAL  80  12.128  -0.096  -1.918
  593    HA   VAL  80           HA       VAL  80  14.013   1.005  -0.146
  594    HB   VAL  80           HB       VAL  80  15.793   0.248  -1.617
  595   HG11  VAL  80          HG11      VAL  80  15.282  -2.125  -1.717
  596   HG12  VAL  80          HG12      VAL  80  13.585  -1.730  -1.371
  597   HG13  VAL  80          HG13      VAL  80  14.832  -1.370  -0.183
  598   HG21  VAL  80          HG21      VAL  80  15.303  -0.901  -3.755
  599   HG22  VAL  80          HG22      VAL  80  14.956   0.826  -3.780
  600   HG23  VAL  80          HG23      VAL  80  13.634  -0.324  -3.627
  601    H    LYS  81           HN       LYS  81  12.770   2.224  -3.201
  602    HA   LYS  81           HA       LYS  81  14.751   4.272  -3.311
  603    HB2  LYS  81           HB2      LYS  81  13.488   5.320  -5.111
  604    HB3  LYS  81           HB1      LYS  81  13.614   3.595  -5.395
  605    HG2  LYS  81           HG2      LYS  81  11.304   3.300  -4.627
  606    HG3  LYS  81           HG1      LYS  81  11.188   5.029  -4.321
  607    HD2  LYS  81           HD2      LYS  81  11.820   3.877  -7.038
  608    HD3  LYS  81           HD1      LYS  81  10.184   4.236  -6.506
  609    HE2  LYS  81           HE2      LYS  81  12.362   6.328  -6.526
  610    HE3  LYS  81           HE1      LYS  81  11.363   6.004  -7.933
  611    HZ1  LYS  81           HZ1      LYS  81   9.403   6.548  -6.593
  612    HZ2  LYS  81           HZ2      LYS  81  10.443   7.829  -6.712
  613    HZ3  LYS  81           HZ3      LYS  81  10.340   7.005  -5.273
  614    H    ILE  82           HN       ILE  82  11.593   4.034  -1.881
  615    HA   ILE  82           HA       ILE  82  11.533   6.843  -1.420
  616    HB   ILE  82           HB       ILE  82   9.424   6.549  -0.245
  617   HG12  ILE  82          HG12      ILE  82   8.381   4.137  -0.328
  618   HG13  ILE  82          HG11      ILE  82  10.055   3.605  -0.345
  619   HG21  ILE  82          HG21      ILE  82   8.090   5.645  -2.059
  620   HG22  ILE  82          HG22      ILE  82   9.516   4.863  -2.727
  621   HG23  ILE  82          HG23      ILE  82   9.426   6.621  -2.663
  622   HD11  ILE  82          HD11      ILE  82   9.116   3.524   1.895
  623   HD12  ILE  82          HD12      ILE  82   8.735   5.243   1.808
  624   HD13  ILE  82          HD13      ILE  82  10.419   4.712   1.803
  625    H    ALA  83           HN       ALA  83  12.552   4.083   0.376
  626    HA   ALA  83           HA       ALA  83  12.902   5.544   2.821
  627    HB1  ALA  83           HB1      ALA  83  14.060   3.537   3.617
  628    HB2  ALA  83           HB2      ALA  83  14.057   2.880   1.983
  629    HB3  ALA  83           HB3      ALA  83  12.534   3.115   2.840
  630    H    GLY  84           HN       GLY  84  15.069   4.356   0.241
  631    HA2  GLY  84           HA2      GLY  84  16.958   5.384  -0.579
  632    HA3  GLY  84           HA1      GLY  84  16.825   6.607   0.682
  633    H    LEU  85           HN       LEU  85  17.121   5.625   2.922
  634    HA   LEU  85           HA       LEU  85  19.647   4.134   2.882
  635    HB2  LEU  85           HB2      LEU  85  18.363   5.730   5.104
  636    HB3  LEU  85           HB1      LEU  85  19.927   4.953   5.185
  637    HG   LEU  85           HG       LEU  85  19.205   7.279   3.400
  638   HD11  LEU  85          HD11      LEU  85  20.926   7.128   5.864
  639   HD12  LEU  85          HD12      LEU  85  19.346   7.900   5.744
  640   HD13  LEU  85          HD13      LEU  85  20.715   8.546   4.838
  641   HD21  LEU  85          HD21      LEU  85  21.602   7.358   2.895
  642   HD22  LEU  85          HD22      LEU  85  20.886   5.841   2.356
  643   HD23  LEU  85          HD23      LEU  85  21.849   5.891   3.834
  644    H    GLU  86           HN       GLU  86  19.821   2.879   5.119
  645    HA   GLU  86           HA       GLU  86  19.227   1.255   6.518
  646    HB2  GLU  86           HB2      GLU  86  17.279   2.657   7.139
  647    HB3  GLU  86           HB1      GLU  86  16.349   1.895   5.862
  648    HG2  GLU  86           HG2      GLU  86  16.478  -0.234   6.975
  649    HG3  GLU  86           HG1      GLU  86  17.544   0.438   8.205
  650    H    HIS  87           HN       HIS  87  17.137   1.071   3.697
  651    HA   HIS  87           HA       HIS  87  17.310  -1.777   3.572
  652    HB2  HIS  87           HB2      HIS  87  16.356   0.267   1.574
  653    HB3  HIS  87           HB1      HIS  87  16.443  -1.447   1.185
  654    HD1  HIS  87           HD1      HIS  87  14.473  -2.858   1.876
  655    HD2  HIS  87           HD2      HIS  87  14.537   0.856   3.743
  656    HE1  HIS  87           HE1      HIS  87  12.341  -2.700   3.165
  657    H    HIS  88           HN       HIS  88  19.202   0.806   2.533
  658    HA   HIS  88           HA       HIS  88  21.045  -0.995   1.185
  659    HB2  HIS  88           HB2      HIS  88  20.571   1.960   0.630
  660    HB3  HIS  88           HB1      HIS  88  21.790   0.961  -0.142
  661    HD1  HIS  88           HD1      HIS  88  20.888  -0.799  -1.963
  662    HD2  HIS  88           HD2      HIS  88  18.042   1.814  -0.417
  663    HE1  HIS  88           HE1      HIS  88  18.888  -0.981  -3.451
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1   6.927   6.978  16.723
    2    H2   MET   1           HT2      MET   1   5.469   6.945  17.528
    3    H3   MET   1           HT3      MET   1   5.939   8.345  16.665
    4    HA   MET   1           HA       MET   1   5.375   5.691  15.521
    5    HB2  MET   1           HB2      MET   1   3.818   8.275  15.239
    6    HB3  MET   1           HB1      MET   1   3.408   6.733  14.510
    7    HG2  MET   1           HG2      MET   1   3.362   7.443  17.428
    8    HG3  MET   1           HG1      MET   1   1.987   7.070  16.391
    9    HE1  MET   1           HE1      MET   1   2.090   4.034  18.871
   10    HE2  MET   1           HE2      MET   1   1.112   5.348  18.218
   11    HE3  MET   1           HE3      MET   1   2.500   5.708  19.242
   12    H    VAL   2           HN       VAL   2   6.801   5.408  13.980
   13    HA   VAL   2           HA       VAL   2   8.068   7.638  12.649
   14    HB   VAL   2           HB       VAL   2   8.327   4.654  12.158
   15   HG11  VAL   2          HG11      VAL   2   8.959   5.935  10.190
   16   HG12  VAL   2          HG12      VAL   2  10.382   5.200  10.931
   17   HG13  VAL   2          HG13      VAL   2  10.055   6.920  11.157
   18   HG21  VAL   2          HG21      VAL   2  10.100   6.545  13.693
   19   HG22  VAL   2          HG22      VAL   2  10.449   4.845  13.373
   20   HG23  VAL   2          HG23      VAL   2   9.074   5.291  14.386
   21    H    THR   3           HN       THR   3   5.594   5.328  12.083
   22    HA   THR   3           HA       THR   3   4.185   4.782  10.533
   23    HB   THR   3           HB       THR   3   3.270   6.471   8.944
   24    HG1  THR   3           HG1      THR   3   5.577   7.729   9.548
   25   HG21  THR   3          HG21      THR   3   2.373   8.015  10.632
   26   HG22  THR   3          HG22      THR   3   3.617   7.486  11.762
   27   HG23  THR   3          HG23      THR   3   2.387   6.351  11.213
   28    H    ALA   4           HN       ALA   4   3.951   3.810   8.570
   29    HA   ALA   4           HA       ALA   4   6.474   3.242   7.353
   30    HB1  ALA   4           HB1      ALA   4   5.212   1.668   6.027
   31    HB2  ALA   4           HB2      ALA   4   3.702   2.327   6.687
   32    HB3  ALA   4           HB3      ALA   4   4.844   1.490   7.746
   33    H    ALA   5           HN       ALA   5   6.957   3.532   5.189
   34    HA   ALA   5           HA       ALA   5   6.079   6.039   4.145
   35    HB1  ALA   5           HB1      ALA   5   7.935   3.993   2.976
   36    HB2  ALA   5           HB2      ALA   5   8.406   5.334   4.023
   37    HB3  ALA   5           HB3      ALA   5   7.748   5.656   2.415
   38    H    LEU   6           HN       LEU   6   4.820   3.002   3.947
   39    HA   LEU   6           HA       LEU   6   3.369   3.723   1.537
   40    HB2  LEU   6           HB2      LEU   6   2.899   1.315   1.159
   41    HB3  LEU   6           HB1      LEU   6   4.555   1.742   0.861
   42    HG   LEU   6           HG       LEU   6   3.744   0.533   3.464
   43   HD11  LEU   6          HD11      LEU   6   4.421  -0.877   0.875
   44   HD12  LEU   6          HD12      LEU   6   2.850  -0.909   1.675
   45   HD13  LEU   6          HD13      LEU   6   4.245  -1.674   2.436
   46   HD21  LEU   6          HD21      LEU   6   6.051  -0.302   3.396
   47   HD22  LEU   6          HD22      LEU   6   6.004   1.456   3.235
   48   HD23  LEU   6          HD23      LEU   6   6.260   0.444   1.815
   49    H    THR   7           HN       THR   7   1.401   4.077   1.843
   50    HA   THR   7           HA       THR   7   0.099   3.033   4.239
   51    HB   THR   7           HB       THR   7  -0.659   5.433   2.548
   52    HG1  THR   7           HG1      THR   7   1.319   5.054   4.281
   53   HG21  THR   7          HG21      THR   7  -1.478   4.568   5.331
   54   HG22  THR   7          HG22      THR   7  -2.481   4.453   3.878
   55   HG23  THR   7          HG23      THR   7  -2.009   6.035   4.502
   56    H    ILE   8           HN       ILE   8  -1.169   1.387   3.781
   57    HA   ILE   8           HA       ILE   8  -2.059   0.941   1.024
   58    HB   ILE   8           HB       ILE   8  -1.910  -0.975   3.366
   59   HG12  ILE   8          HG12      ILE   8  -0.201  -0.735   0.886
   60   HG13  ILE   8          HG11      ILE   8   0.293  -0.361   2.533
   61   HG21  ILE   8          HG21      ILE   8  -3.726  -1.533   1.851
   62   HG22  ILE   8          HG22      ILE   8  -2.449  -2.745   1.794
   63   HG23  ILE   8          HG23      ILE   8  -2.616  -1.579   0.476
   64   HD11  ILE   8          HD11      ILE   8   0.005  -2.705   3.140
   65   HD12  ILE   8          HD12      ILE   8   1.155  -2.498   1.814
   66   HD13  ILE   8          HD13      ILE   8  -0.483  -3.059   1.483
   67    H    TYR   9           HN       TYR   9  -4.121   0.823   0.536
   68    HA   TYR   9           HA       TYR   9  -6.034   1.544   2.573
   69    HB2  TYR   9           HB2      TYR   9  -6.170   1.426  -0.454
   70    HB3  TYR   9           HB1      TYR   9  -7.510   1.961   0.547
   71    HD1  TYR   9           HD1      TYR   9  -4.144   2.810  -0.694
   72    HD2  TYR   9           HD2      TYR   9  -7.440   4.166   1.632
   73    HE1  TYR   9           HE1      TYR   9  -3.187   5.052  -0.676
   74    HE2  TYR   9           HE2      TYR   9  -6.482   6.437   1.654
   75    HH   TYR   9           HH       TYR   9  -4.283   7.499   1.401
   76    H    THR  10           HN       THR  10  -7.141  -0.072   3.585
   77    HA   THR  10           HA       THR  10  -7.642  -2.541   2.111
   78    HB   THR  10           HB       THR  10  -7.456  -3.622   4.428
   79    HG1  THR  10           HG1      THR  10  -6.290  -2.494   5.963
   80   HG21  THR  10          HG21      THR  10  -4.953  -2.512   3.146
   81   HG22  THR  10          HG22      THR  10  -5.785  -3.995   2.665
   82   HG23  THR  10          HG23      THR  10  -5.012  -3.883   4.250
   83    H    THR  11           HN       THR  11  -9.558  -3.701   2.845
   84    HA   THR  11           HA       THR  11 -11.296  -2.213   4.580
   85    HB   THR  11           HB       THR  11 -13.257  -2.713   3.088
   86    HG1  THR  11           HG1      THR  11 -11.276  -3.172   1.132
   87   HG21  THR  11          HG21      THR  11 -12.895  -0.872   1.502
   88   HG22  THR  11          HG22      THR  11 -11.170  -0.909   1.869
   89   HG23  THR  11          HG23      THR  11 -12.326  -0.451   3.119
   90    H    SER  12           HN       SER  12 -13.325  -3.698   4.995
   91    HA   SER  12           HA       SER  12 -12.417  -6.353   5.660
   92    HB2  SER  12           HB2      SER  12 -15.215  -5.236   5.869
   93    HB3  SER  12           HB1      SER  12 -14.454  -6.473   6.869
   94    HG   SER  12           HG       SER  12 -12.955  -4.293   7.148
   95    H    TRP  13           HN       TRP  13 -13.673  -4.803   2.971
   96    HA   TRP  13           HA       TRP  13 -15.770  -6.628   2.208
   97    HB2  TRP  13           HB2      TRP  13 -14.563  -4.428   0.553
   98    HB3  TRP  13           HB1      TRP  13 -16.146  -5.164   0.382
   99    HD1  TRP  13           HD1      TRP  13 -16.921  -4.844   3.563
  100    HE1  TRP  13           HE1      TRP  13 -17.544  -2.498   4.410
  101    HE3  TRP  13           HE3      TRP  13 -14.826  -2.054  -0.170
  102    HZ2  TRP  13           HZ2      TRP  13 -17.217   0.185   3.588
  103    HZ3  TRP  13           HZ3      TRP  13 -15.035   0.398  -0.067
  104    HH2  TRP  13           HH2      TRP  13 -16.210   1.490   1.769
  105    H    CYS  14           HN       CYS  14 -12.401  -6.396   1.665
  106    HA   CYS  14           HA       CYS  14 -12.643  -7.840  -0.864
  107    HB2  CYS  14           HB2      CYS  14 -10.308  -7.029  -1.235
  108    HB3  CYS  14           HB1      CYS  14 -11.561  -5.793  -1.209
  109    H    GLY  15           HN       GLY  15 -11.508  -9.664  -1.226
  110    HA2  GLY  15           HA2      GLY  15 -10.099 -10.846   1.045
  111    HA3  GLY  15           HA1      GLY  15 -10.651 -11.709  -0.392
  112    H    TYR  16           HN       TYR  16  -9.718 -10.013  -2.362
  113    HA   TYR  16           HA       TYR  16  -7.123 -10.959  -2.721
  114    HB2  TYR  16           HB2      TYR  16  -7.005  -9.694  -4.788
  115    HB3  TYR  16           HB1      TYR  16  -8.608 -10.370  -4.614
  116    HD1  TYR  16           HD1      TYR  16 -10.128  -8.423  -3.123
  117    HD2  TYR  16           HD2      TYR  16  -7.048  -7.705  -5.974
  118    HE1  TYR  16           HE1      TYR  16 -11.108  -6.227  -3.643
  119    HE2  TYR  16           HE2      TYR  16  -8.013  -5.532  -6.482
  120    HH   TYR  16           HH       TYR  16 -10.235  -4.456  -6.344
  121    H    CYS  17           HN       CYS  17  -8.094  -8.083  -1.124
  122    HA   CYS  17           HA       CYS  17  -5.672  -6.640  -1.364
  123    HB2  CYS  17           HB2      CYS  17  -6.503  -5.507   0.773
  124    HB3  CYS  17           HB1      CYS  17  -7.578  -5.377  -0.628
  125    H    LEU  18           HN       LEU  18  -6.938  -9.047   0.844
  126    HA   LEU  18           HA       LEU  18  -5.038  -8.784   2.895
  127    HB2  LEU  18           HB2      LEU  18  -7.291  -9.630   3.163
  128    HB3  LEU  18           HB1      LEU  18  -6.881 -11.033   2.206
  129    HG   LEU  18           HG       LEU  18  -5.336 -11.795   3.913
  130   HD11  LEU  18          HD11      LEU  18  -6.179  -9.316   5.427
  131   HD12  LEU  18          HD12      LEU  18  -4.562  -9.649   4.786
  132   HD13  LEU  18          HD13      LEU  18  -5.218 -10.640   6.078
  133   HD21  LEU  18          HD21      LEU  18  -7.992 -10.955   4.938
  134   HD22  LEU  18          HD22      LEU  18  -6.973 -12.211   5.655
  135   HD23  LEU  18          HD23      LEU  18  -7.646 -12.426   4.026
  136    H    ARG  19           HN       ARG  19  -5.171 -10.598  -0.052
  137    HA   ARG  19           HA       ARG  19  -3.219 -12.551   0.577
  138    HB2  ARG  19           HB2      ARG  19  -4.317 -11.538  -2.033
  139    HB3  ARG  19           HB1      ARG  19  -2.923 -12.601  -2.038
  140    HG2  ARG  19           HG2      ARG  19  -5.055 -13.803  -2.410
  141    HG3  ARG  19           HG1      ARG  19  -4.197 -14.360  -0.978
  142    HD2  ARG  19           HD2      ARG  19  -5.669 -13.028   0.432
  143    HD3  ARG  19           HD1      ARG  19  -6.503 -12.417  -0.991
  144    HE   ARG  19           HE       ARG  19  -6.969 -14.928  -1.347
  145   HH11  ARG  19          HH11      ARG  19  -6.825 -13.392   1.848
  146   HH12  ARG  19          HH12      ARG  19  -8.113 -14.315   2.476
  147   HH21  ARG  19          HH21      ARG  19  -8.712 -16.173  -0.447
  148   HH22  ARG  19          HH22      ARG  19  -9.188 -15.944   1.170
  149    H    LEU  20           HN       LEU  20  -2.896  -9.467  -1.170
  150    HA   LEU  20           HA       LEU  20  -0.113  -9.696  -1.357
  151    HB2  LEU  20           HB2      LEU  20  -1.199  -8.206  -2.885
  152    HB3  LEU  20           HB1      LEU  20  -1.951  -7.315  -1.584
  153    HG   LEU  20           HG       LEU  20   0.332  -6.459  -0.960
  154   HD11  LEU  20          HD11      LEU  20   1.177  -7.749  -3.552
  155   HD12  LEU  20          HD12      LEU  20   1.947  -7.908  -1.949
  156   HD13  LEU  20          HD13      LEU  20   1.999  -6.405  -2.814
  157   HD21  LEU  20          HD21      LEU  20  -0.707  -5.777  -3.693
  158   HD22  LEU  20          HD22      LEU  20   0.393  -4.785  -2.728
  159   HD23  LEU  20          HD23      LEU  20  -1.250  -5.093  -2.157
  160    H    LYS  21           HN       LYS  21  -2.277  -8.265   0.945
  161    HA   LYS  21           HA       LYS  21  -0.567  -6.857   2.619
  162    HB2  LYS  21           HB2      LYS  21  -3.013  -6.745   2.716
  163    HB3  LYS  21           HB1      LYS  21  -3.074  -8.422   3.212
  164    HG2  LYS  21           HG2      LYS  21  -2.133  -7.883   5.347
  165    HG3  LYS  21           HG1      LYS  21  -1.870  -6.210   4.848
  166    HD2  LYS  21           HD2      LYS  21  -4.249  -5.822   4.678
  167    HD3  LYS  21           HD1      LYS  21  -4.595  -7.517   4.955
  168    HE2  LYS  21           HE2      LYS  21  -3.658  -7.375   7.208
  169    HE3  LYS  21           HE1      LYS  21  -3.256  -5.683   6.947
  170    HZ1  LYS  21           HZ1      LYS  21  -6.075  -6.637   6.785
  171    HZ2  LYS  21           HZ2      LYS  21  -5.495  -5.052   7.093
  172    HZ3  LYS  21           HZ3      LYS  21  -5.324  -6.253   8.227
  173    H    THR  22           HN       THR  22  -1.287 -10.310   2.500
  174    HA   THR  22           HA       THR  22   0.226 -10.947   4.836
  175    HB   THR  22           HB       THR  22  -0.634 -12.822   2.604
  176    HG1  THR  22           HG1      THR  22  -2.409 -11.596   3.529
  177   HG21  THR  22          HG21      THR  22   0.987 -13.745   4.209
  178   HG22  THR  22          HG22      THR  22  -0.597 -14.504   4.378
  179   HG23  THR  22          HG23      THR  22  -0.075 -13.282   5.537
  180    H    ALA  23           HN       ALA  23   0.833 -10.996   1.334
  181    HA   ALA  23           HA       ALA  23   3.419 -12.167   1.316
  182    HB1  ALA  23           HB1      ALA  23   2.006 -11.835  -0.702
  183    HB2  ALA  23           HB2      ALA  23   3.642 -11.189  -0.889
  184    HB3  ALA  23           HB3      ALA  23   2.293 -10.100  -0.560
  185    H    LEU  24           HN       LEU  24   2.424  -8.835   1.645
  186    HA   LEU  24           HA       LEU  24   5.044  -7.780   1.715
  187    HB2  LEU  24           HB2      LEU  24   2.504  -6.719   2.909
  188    HB3  LEU  24           HB1      LEU  24   3.974  -5.772   2.705
  189    HG   LEU  24           HG       LEU  24   2.219  -6.921   0.553
  190   HD11  LEU  24          HD11      LEU  24   1.819  -4.598  -0.033
  191   HD12  LEU  24          HD12      LEU  24   2.810  -4.090   1.332
  192   HD13  LEU  24          HD13      LEU  24   1.303  -4.961   1.613
  193   HD21  LEU  24          HD21      LEU  24   4.534  -7.032  -0.162
  194   HD22  LEU  24          HD22      LEU  24   4.752  -5.332   0.271
  195   HD23  LEU  24          HD23      LEU  24   3.665  -5.773  -1.042
  196    H    THR  25           HN       THR  25   2.976  -9.123   4.175
  197    HA   THR  25           HA       THR  25   4.519  -8.362   6.405
  198    HB   THR  25           HB       THR  25   2.671 -10.747   6.043
  199    HG1  THR  25           HG1      THR  25   1.463  -8.893   5.766
  200   HG21  THR  25          HG21      THR  25   4.148 -11.003   8.005
  201   HG22  THR  25          HG22      THR  25   2.478 -10.726   8.500
  202   HG23  THR  25          HG23      THR  25   3.652  -9.411   8.584
  203    H    ALA  26           HN       ALA  26   4.529 -11.276   4.360
  204    HA   ALA  26           HA       ALA  26   6.620 -12.617   5.733
  205    HB1  ALA  26           HB1      ALA  26   5.712 -12.928   2.868
  206    HB2  ALA  26           HB2      ALA  26   5.035 -13.779   4.256
  207    HB3  ALA  26           HB3      ALA  26   6.705 -14.075   3.765
  208    H    ASN  27           HN       ASN  27   6.549 -10.182   3.328
  209    HA   ASN  27           HA       ASN  27   9.332 -10.385   2.562
  210    HB2  ASN  27           HB2      ASN  27   6.976  -8.865   1.720
  211    HB3  ASN  27           HB1      ASN  27   8.523  -8.017   1.488
  212   HD21  ASN  27          HD21      ASN  27   6.467 -10.633   0.593
  213   HD22  ASN  27          HD22      ASN  27   7.335 -11.122  -0.807
  214    H    ARG  28           HN       ARG  28   7.965  -9.388   5.270
  215    HA   ARG  28           HA       ARG  28   8.480  -8.117   7.035
  216    HB2  ARG  28           HB2      ARG  28  10.753  -9.181   6.636
  217    HB3  ARG  28           HB1      ARG  28  11.212  -7.722   5.765
  218    HG2  ARG  28           HG2      ARG  28  10.719  -6.412   7.825
  219    HG3  ARG  28           HG1      ARG  28  10.446  -7.927   8.670
  220    HD2  ARG  28           HD2      ARG  28  12.743  -8.585   8.291
  221    HD3  ARG  28           HD1      ARG  28  13.025  -7.131   7.327
  222    HE   ARG  28           HE       ARG  28  12.069  -6.781  10.034
  223   HH11  ARG  28          HH11      ARG  28  14.875  -6.696   7.864
  224   HH12  ARG  28          HH12      ARG  28  15.795  -5.668   8.879
  225   HH21  ARG  28          HH21      ARG  28  13.380  -5.382  11.430
  226   HH22  ARG  28          HH22      ARG  28  14.934  -4.937  10.903
  227    H    ILE  29           HN       ILE  29   7.153  -6.881   4.944
  228    HA   ILE  29           HA       ILE  29   8.309  -4.229   4.822
  229    HB   ILE  29           HB       ILE  29   5.948  -5.453   3.337
  230   HG12  ILE  29          HG12      ILE  29   8.671  -4.557   2.393
  231   HG13  ILE  29          HG11      ILE  29   8.218  -6.227   2.696
  232   HG21  ILE  29          HG21      ILE  29   7.149  -2.691   3.071
  233   HG22  ILE  29          HG22      ILE  29   5.562  -3.068   3.743
  234   HG23  ILE  29          HG23      ILE  29   5.895  -3.376   2.036
  235   HD11  ILE  29          HD11      ILE  29   8.189  -5.696   0.330
  236   HD12  ILE  29          HD12      ILE  29   7.007  -4.415   0.619
  237   HD13  ILE  29          HD13      ILE  29   6.578  -6.103   0.910
  238    H    ALA  30           HN       ALA  30   7.713  -2.757   6.180
  239    HA   ALA  30           HA       ALA  30   5.474  -3.147   7.945
  240    HB1  ALA  30           HB1      ALA  30   6.245  -1.024   8.955
  241    HB2  ALA  30           HB2      ALA  30   7.439  -0.858   7.667
  242    HB3  ALA  30           HB3      ALA  30   7.562  -2.190   8.815
  243    H    TYR  31           HN       TYR  31   3.515  -2.363   7.541
  244    HA   TYR  31           HA       TYR  31   3.238  -0.155   5.667
  245    HB2  TYR  31           HB2      TYR  31   1.342  -1.286   4.555
  246    HB3  TYR  31           HB1      TYR  31   2.870  -2.112   4.298
  247    HD1  TYR  31           HD2      TYR  31  -0.396  -2.270   5.997
  248    HD2  TYR  31           HD1      TYR  31   3.220  -4.341   5.134
  249    HE1  TYR  31           HE2      TYR  31  -1.408  -4.359   6.790
  250    HE2  TYR  31           HE1      TYR  31   2.212  -6.436   5.911
  251    HH   TYR  31           HH       TYR  31   0.482  -7.195   7.273
  252    H    ASP  32           HN       ASP  32   1.484   1.121   5.971
  253    HA   ASP  32           HA       ASP  32  -0.061   0.585   8.402
  254    HB2  ASP  32           HB2      ASP  32   0.759   3.184   7.103
  255    HB3  ASP  32           HB1      ASP  32  -0.620   3.107   8.185
  256    H    GLU  33           HN       GLU  33  -2.117   0.115   8.093
  257    HA   GLU  33           HA       GLU  33  -3.146   0.544   5.419
  258    HB2  GLU  33           HB2      GLU  33  -4.853  -1.121   5.989
  259    HB3  GLU  33           HB1      GLU  33  -3.230  -1.750   6.172
  260    HG2  GLU  33           HG2      GLU  33  -3.445  -1.354   8.624
  261    HG3  GLU  33           HG1      GLU  33  -5.139  -0.940   8.342
  262    H    VAL  34           HN       VAL  34  -5.290   1.365   5.158
  263    HA   VAL  34           HA       VAL  34  -5.584   3.615   6.983
  264    HB   VAL  34           HB       VAL  34  -7.004   3.327   4.332
  265   HG11  VAL  34          HG11      VAL  34  -7.137   5.760   4.405
  266   HG12  VAL  34          HG12      VAL  34  -6.311   5.765   5.959
  267   HG13  VAL  34          HG13      VAL  34  -7.913   5.045   5.822
  268   HG21  VAL  34          HG21      VAL  34  -4.342   4.593   4.909
  269   HG22  VAL  34          HG22      VAL  34  -5.204   4.668   3.371
  270   HG23  VAL  34          HG23      VAL  34  -4.605   3.122   3.975
  271    H    ASP  35           HN       ASP  35  -7.270   4.291   7.927
  272    HA   ASP  35           HA       ASP  35  -9.088   2.563   9.138
  273    HB2  ASP  35           HB2      ASP  35 -10.002   4.656  10.120
  274    HB3  ASP  35           HB1      ASP  35  -8.265   4.449  10.311
  275    H    ILE  36           HN       ILE  36  -9.374   3.595   6.057
  276    HA   ILE  36           HA       ILE  36 -11.782   4.864   5.614
  277    HB   ILE  36           HB       ILE  36 -11.959   3.788   3.412
  278   HG12  ILE  36          HG12      ILE  36  -9.561   2.142   4.208
  279   HG13  ILE  36          HG11      ILE  36 -11.211   1.526   4.168
  280   HG21  ILE  36          HG21      ILE  36  -9.154   4.613   4.122
  281   HG22  ILE  36          HG22      ILE  36 -10.476   5.680   3.640
  282   HG23  ILE  36          HG23      ILE  36  -9.818   4.521   2.495
  283   HD11  ILE  36          HD11      ILE  36  -9.905   0.962   2.178
  284   HD12  ILE  36          HD12      ILE  36  -9.797   2.710   1.813
  285   HD13  ILE  36          HD13      ILE  36 -11.359   1.897   1.843
  286    H    GLU  37           HN       GLU  37 -11.444   1.570   6.626
  287    HA   GLU  37           HA       GLU  37 -13.836   0.418   5.866
  288    HB2  GLU  37           HB2      GLU  37 -12.248   0.039   8.406
  289    HB3  GLU  37           HB1      GLU  37 -13.550  -1.027   7.888
  290    HG2  GLU  37           HG2      GLU  37 -12.373  -1.628   5.958
  291    HG3  GLU  37           HG1      GLU  37 -11.054  -0.492   6.287
  292    H    HIS  38           HN       HIS  38 -13.159   2.715   8.407
  293    HA   HIS  38           HA       HIS  38 -16.007   2.813   9.080
  294    HB2  HIS  38           HB2      HIS  38 -15.343   3.330  11.448
  295    HB3  HIS  38           HB1      HIS  38 -14.978   1.691  10.940
  296    HD1  HIS  38           HD1      HIS  38 -12.514   0.964  11.099
  297    HD2  HIS  38           HD2      HIS  38 -13.071   5.024  11.801
  298    HE1  HIS  38           HE1      HIS  38 -10.323   1.822  11.981
  299    H    ASN  39           HN       ASN  39 -14.176   4.411   7.309
  300    HA   ASN  39           HA       ASN  39 -14.962   7.039   8.343
  301    HB2  ASN  39           HB2      ASN  39 -12.690   6.840   9.088
  302    HB3  ASN  39           HB1      ASN  39 -12.167   6.333   7.485
  303   HD21  ASN  39          HD21      ASN  39 -10.864   7.887   7.017
  304   HD22  ASN  39          HD22      ASN  39 -11.141   9.570   6.971
  305    H    ARG  40           HN       ARG  40 -15.985   8.058   6.815
  306    HA   ARG  40           HA       ARG  40 -15.836   7.178   4.097
  307    HB2  ARG  40           HB2      ARG  40 -17.615   8.692   3.636
  308    HB3  ARG  40           HB1      ARG  40 -17.944   7.963   5.195
  309    HG2  ARG  40           HG2      ARG  40 -16.985  10.057   6.247
  310    HG3  ARG  40           HG1      ARG  40 -16.980  10.754   4.633
  311    HD2  ARG  40           HD2      ARG  40 -19.005  11.421   5.722
  312    HD3  ARG  40           HD1      ARG  40 -19.410  10.247   4.467
  313    HE   ARG  40           HE       ARG  40 -19.036   9.363   7.225
  314   HH11  ARG  40          HH11      ARG  40 -21.217   9.712   4.427
  315   HH12  ARG  40          HH12      ARG  40 -22.496   8.886   5.146
  316   HH21  ARG  40          HH21      ARG  40 -20.795   8.213   8.197
  317   HH22  ARG  40          HH22      ARG  40 -22.253   7.964   7.378
  318    H    ALA  41           HN       ALA  41 -14.285   9.686   5.966
  319    HA   ALA  41           HA       ALA  41 -13.912  11.399   3.768
  320    HB1  ALA  41           HB1      ALA  41 -12.393  11.623   6.381
  321    HB2  ALA  41           HB2      ALA  41 -13.997  12.251   6.080
  322    HB3  ALA  41           HB3      ALA  41 -12.636  12.857   5.151
  323    H    ALA  42           HN       ALA  42 -11.826   8.972   5.090
  324    HA   ALA  42           HA       ALA  42  -9.766   9.688   3.183
  325    HB1  ALA  42           HB1      ALA  42  -8.576   7.696   4.024
  326    HB2  ALA  42           HB2      ALA  42  -9.985   7.286   5.009
  327    HB3  ALA  42           HB3      ALA  42  -9.082   8.768   5.326
  328    H    ALA  43           HN       ALA  43 -12.509   7.648   3.364
  329    HA   ALA  43           HA       ALA  43 -11.832   5.792   1.329
  330    HB1  ALA  43           HB1      ALA  43 -14.560   6.650   2.281
  331    HB2  ALA  43           HB2      ALA  43 -13.565   5.422   3.040
  332    HB3  ALA  43           HB3      ALA  43 -14.183   5.160   1.397
  333    H    GLU  44           HN       GLU  44 -13.244   8.941   1.402
  334    HA   GLU  44           HA       GLU  44 -14.240   9.124  -1.204
  335    HB2  GLU  44           HB2      GLU  44 -14.606  10.626   0.857
  336    HB3  GLU  44           HB1      GLU  44 -13.078  11.372   0.453
  337    HG2  GLU  44           HG2      GLU  44 -15.407  11.298  -1.444
  338    HG3  GLU  44           HG1      GLU  44 -15.188  12.575  -0.263
  339    H    PHE  45           HN       PHE  45 -11.016   9.634   0.181
  340    HA   PHE  45           HA       PHE  45  -9.841  10.656  -2.187
  341    HB2  PHE  45           HB2      PHE  45  -8.704  11.034  -0.065
  342    HB3  PHE  45           HB1      PHE  45  -8.533   9.300   0.193
  343    HD1  PHE  45           HD1      PHE  45  -7.540  12.047  -2.096
  344    HD2  PHE  45           HD2      PHE  45  -6.658   8.174  -0.584
  345    HE1  PHE  45           HE1      PHE  45  -5.397  12.070  -3.306
  346    HE2  PHE  45           HE2      PHE  45  -4.509   8.193  -1.791
  347    HZ   PHE  45           HZ       PHE  45  -3.884  10.148  -3.156
  348    H    VAL  46           HN       VAL  46 -10.431   7.451  -0.995
  349    HA   VAL  46           HA       VAL  46  -8.816   6.072  -2.870
  350    HB   VAL  46           HB       VAL  46 -11.361   5.055  -1.549
  351   HG11  VAL  46          HG11      VAL  46  -9.015   3.552  -2.703
  352   HG12  VAL  46          HG12      VAL  46 -10.612   3.677  -3.428
  353   HG13  VAL  46          HG13      VAL  46 -10.400   2.828  -1.886
  354   HG21  VAL  46          HG21      VAL  46  -9.923   4.111   0.172
  355   HG22  VAL  46          HG22      VAL  46  -9.727   5.870   0.100
  356   HG23  VAL  46          HG23      VAL  46  -8.512   4.817  -0.611
  357    H    GLY  47           HN       GLY  47 -12.010   7.437  -2.942
  358    HA2  GLY  47           HA2      GLY  47 -12.757   6.318  -5.480
  359    HA3  GLY  47           HA1      GLY  47 -13.582   7.616  -4.619
  360    H    SER  48           HN       SER  48 -11.029   9.088  -4.373
  361    HA   SER  48           HA       SER  48 -11.141  10.618  -6.739
  362    HB2  SER  48           HB2      SER  48 -10.434  11.573  -4.561
  363    HB3  SER  48           HB1      SER  48  -9.008  10.546  -4.573
  364    HG   SER  48           HG       SER  48  -9.554  12.360  -6.658
  365    H    VAL  49           HN       VAL  49  -8.865   8.160  -5.546
  366    HA   VAL  49           HA       VAL  49  -7.377   8.327  -7.994
  367    HB   VAL  49           HB       VAL  49  -5.984   6.432  -7.122
  368   HG11  VAL  49          HG11      VAL  49  -6.346   8.769  -5.259
  369   HG12  VAL  49          HG12      VAL  49  -5.337   8.720  -6.704
  370   HG13  VAL  49          HG13      VAL  49  -4.933   7.711  -5.313
  371   HG21  VAL  49          HG21      VAL  49  -6.242   5.744  -4.775
  372   HG22  VAL  49          HG22      VAL  49  -7.655   5.302  -5.734
  373   HG23  VAL  49          HG23      VAL  49  -7.719   6.703  -4.664
  374    H    ASN  50           HN       ASN  50  -9.743   6.081  -6.654
  375    HA   ASN  50           HA       ASN  50  -9.627   4.630  -9.189
  376    HB2  ASN  50           HB2      ASN  50 -10.677   3.780  -6.493
  377    HB3  ASN  50           HB1      ASN  50 -11.004   2.883  -7.967
  378   HD21  ASN  50          HD21      ASN  50  -8.720   3.598  -5.517
  379   HD22  ASN  50          HD22      ASN  50  -7.492   2.505  -6.063
  380    H    GLY  51           HN       GLY  51 -11.018   5.370 -10.584
  381    HA2  GLY  51           HA2      GLY  51 -13.418   6.735  -9.760
  382    HA3  GLY  51           HA1      GLY  51 -12.854   6.488 -11.408
  383    H    GLY  52           HN       GLY  52 -15.369   5.867  -9.570
  384    HA2  GLY  52           HA2      GLY  52 -17.164   4.501  -9.982
  385    HA3  GLY  52           HA1      GLY  52 -16.191   3.630 -11.163
  386    H    ASN  53           HN       ASN  53 -14.720   2.073 -10.406
  387    HA   ASN  53           HA       ASN  53 -15.753   0.661  -8.084
  388    HB2  ASN  53           HB2      ASN  53 -13.821  -0.194 -10.251
  389    HB3  ASN  53           HB1      ASN  53 -14.148  -1.165  -8.827
  390   HD21  ASN  53          HD21      ASN  53 -14.574  -1.746 -11.623
  391   HD22  ASN  53          HD22      ASN  53 -16.262  -2.081 -11.799
  392    H    ARG  54           HN       ARG  54 -14.831   0.783  -6.207
  393    HA   ARG  54           HA       ARG  54 -12.291   2.104  -5.903
  394    HB2  ARG  54           HB2      ARG  54 -14.216   0.926  -3.906
  395    HB3  ARG  54           HB1      ARG  54 -12.677   1.592  -3.430
  396    HG2  ARG  54           HG2      ARG  54 -13.375   3.791  -4.308
  397    HG3  ARG  54           HG1      ARG  54 -14.935   3.098  -4.760
  398    HD2  ARG  54           HD2      ARG  54 -15.378   2.549  -2.415
  399    HD3  ARG  54           HD1      ARG  54 -13.806   3.183  -1.955
  400    HE   ARG  54           HE       ARG  54 -14.944   5.286  -3.159
  401   HH11  ARG  54          HH11      ARG  54 -16.350   3.097  -0.766
  402   HH12  ARG  54          HH12      ARG  54 -17.130   4.302   0.131
  403   HH21  ARG  54          HH21      ARG  54 -16.005   6.999  -1.916
  404   HH22  ARG  54          HH22      ARG  54 -16.898   6.622  -0.534
  405    H    THR  55           HN       THR  55 -10.798   0.734  -6.825
  406    HA   THR  55           HA       THR  55 -10.478  -1.988  -6.184
  407    HB   THR  55           HB       THR  55  -8.273  -0.040  -6.887
  408    HG1  THR  55           HG1      THR  55  -9.174   0.213  -8.748
  409   HG21  THR  55          HG21      THR  55  -8.766  -2.953  -7.560
  410   HG22  THR  55          HG22      THR  55  -7.611  -2.343  -6.373
  411   HG23  THR  55          HG23      THR  55  -7.379  -2.000  -8.086
  412    H    VAL  56           HN       VAL  56  -9.750  -2.822  -4.301
  413    HA   VAL  56           HA       VAL  56  -9.328  -0.915  -2.254
  414    HB   VAL  56           HB       VAL  56  -8.937  -3.850  -1.845
  415   HG11  VAL  56          HG11      VAL  56  -9.300  -3.250   0.510
  416   HG12  VAL  56          HG12      VAL  56  -9.547  -1.569   0.030
  417   HG13  VAL  56          HG13      VAL  56  -7.966  -2.288  -0.158
  418   HG21  VAL  56          HG21      VAL  56 -11.095  -3.352  -2.717
  419   HG22  VAL  56          HG22      VAL  56 -11.215  -2.048  -1.497
  420   HG23  VAL  56          HG23      VAL  56 -11.137  -3.761  -0.972
  421    HA   PRO  57           HA       PRO  57  -5.554  -2.548  -1.469
  422    HB2  PRO  57           HB2      PRO  57  -3.746  -4.163  -2.782
  423    HB3  PRO  57           HB1      PRO  57  -5.040  -4.708  -1.716
  424    HG2  PRO  57           HG2      PRO  57  -5.042  -4.545  -4.697
  425    HG3  PRO  57           HG1      PRO  57  -5.787  -5.760  -3.645
  426    HD2  PRO  57           HD2      PRO  57  -7.112  -3.652  -4.830
  427    HD3  PRO  57           HD1      PRO  57  -7.662  -4.598  -3.437
  428    H    THR  58           HN       THR  58  -5.420  -0.409  -2.315
  429    HA   THR  58           HA       THR  58  -3.570   0.356  -4.401
  430    HB   THR  58           HB       THR  58  -5.811   1.804  -2.927
  431    HG1  THR  58           HG1      THR  58  -6.948   0.619  -4.301
  432   HG21  THR  58          HG21      THR  58  -5.601   3.505  -4.680
  433   HG22  THR  58          HG22      THR  58  -4.252   2.626  -5.383
  434   HG23  THR  58          HG23      THR  58  -4.078   3.376  -3.782
  435    H    VAL  59           HN       VAL  59  -1.863   1.700  -3.703
  436    HA   VAL  59           HA       VAL  59  -1.631   2.107  -0.825
  437    HB   VAL  59           HB       VAL  59  -0.511  -0.013  -1.227
  438   HG11  VAL  59          HG11      VAL  59   0.997   1.407  -3.359
  439   HG12  VAL  59          HG12      VAL  59  -0.165   0.092  -3.558
  440   HG13  VAL  59          HG13      VAL  59   1.381  -0.206  -2.743
  441   HG21  VAL  59          HG21      VAL  59   0.594   1.464   0.374
  442   HG22  VAL  59          HG22      VAL  59   1.538   2.180  -0.933
  443   HG23  VAL  59          HG23      VAL  59   1.771   0.485  -0.506
  444    H    LYS  60           HN       LYS  60  -0.597   3.891  -0.254
  445    HA   LYS  60           HA       LYS  60   0.346   5.669  -2.385
  446    HB2  LYS  60           HB2      LYS  60  -1.447   6.599  -1.006
  447    HB3  LYS  60           HB1      LYS  60  -0.538   6.247   0.455
  448    HG2  LYS  60           HG2      LYS  60   1.234   7.801  -0.318
  449    HG3  LYS  60           HG1      LYS  60   0.217   8.204  -1.698
  450    HD2  LYS  60           HD2      LYS  60  -0.598   8.579   1.178
  451    HD3  LYS  60           HD1      LYS  60   0.123   9.845   0.187
  452    HE2  LYS  60           HE2      LYS  60  -1.769   9.591  -1.397
  453    HE3  LYS  60           HE1      LYS  60  -2.499   8.430  -0.287
  454    HZ1  LYS  60           HZ1      LYS  60  -1.912  11.275   0.289
  455    HZ2  LYS  60           HZ2      LYS  60  -2.531  10.188   1.408
  456    HZ3  LYS  60           HZ3      LYS  60  -3.439  10.624   0.077
  457    H    PHE  61           HN       PHE  61   2.449   6.071  -2.493
  458    HA   PHE  61           HA       PHE  61   4.141   5.317  -0.202
  459    HB2  PHE  61           HB2      PHE  61   4.728   5.431  -3.147
  460    HB3  PHE  61           HB1      PHE  61   5.995   5.396  -1.939
  461    HD1  PHE  61           HD1      PHE  61   6.452   3.380  -0.685
  462    HD2  PHE  61           HD2      PHE  61   3.417   3.536  -3.659
  463    HE1  PHE  61           HE1      PHE  61   6.425   0.958  -0.760
  464    HE2  PHE  61           HE2      PHE  61   3.383   1.084  -3.762
  465    HZ   PHE  61           HZ       PHE  61   4.866  -0.221  -2.335
  466    H    ALA  62           HN       ALA  62   6.019   6.606   0.086
  467    HA   ALA  62           HA       ALA  62   5.714   9.419  -0.087
  468    HB1  ALA  62           HB1      ALA  62   7.070   8.332   1.660
  469    HB2  ALA  62           HB2      ALA  62   8.020   9.508   0.751
  470    HB3  ALA  62           HB3      ALA  62   8.212   7.787   0.429
  471    H    ASP  63           HN       ASP  63   6.479   7.137  -2.261
  472    HA   ASP  63           HA       ASP  63   8.392   8.209  -4.039
  473    HB2  ASP  63           HB2      ASP  63   7.697   5.848  -4.029
  474    HB3  ASP  63           HB1      ASP  63   6.080   6.311  -4.507
  475    H    GLY  64           HN       GLY  64   5.111   9.096  -3.434
  476    HA2  GLY  64           HA2      GLY  64   4.325  11.221  -4.082
  477    HA3  GLY  64           HA1      GLY  64   5.398  11.171  -5.466
  478    H    SER  65           HN       SER  65   3.732   8.266  -5.116
  479    HA   SER  65           HA       SER  65   1.415   9.139  -6.549
  480    HB2  SER  65           HB2      SER  65   3.228   8.834  -8.293
  481    HB3  SER  65           HB1      SER  65   3.294   7.134  -7.833
  482    HG   SER  65           HG       SER  65   1.194   8.587  -9.013
  483    H    THR  66           HN       THR  66   0.144   7.004  -7.121
  484    HA   THR  66           HA       THR  66   0.278   5.296  -4.748
  485    HB   THR  66           HB       THR  66  -2.193   4.950  -5.187
  486    HG1  THR  66           HG1      THR  66  -2.132   7.366  -6.637
  487   HG21  THR  66          HG21      THR  66  -2.893   7.081  -4.156
  488   HG22  THR  66          HG22      THR  66  -1.314   7.771  -4.529
  489   HG23  THR  66          HG23      THR  66  -1.444   6.436  -3.384
  490    H    LEU  67           HN       LEU  67   0.209   3.150  -5.086
  491    HA   LEU  67           HA       LEU  67   0.159   2.268  -7.874
  492    HB2  LEU  67           HB2      LEU  67   1.537   1.085  -5.461
  493    HB3  LEU  67           HB1      LEU  67   1.202   0.113  -6.873
  494    HG   LEU  67           HG       LEU  67   2.549   1.737  -8.208
  495   HD11  LEU  67          HD11      LEU  67   3.417   2.849  -5.565
  496   HD12  LEU  67          HD12      LEU  67   2.487   3.671  -6.810
  497   HD13  LEU  67          HD13      LEU  67   4.148   3.183  -7.134
  498   HD21  LEU  67          HD21      LEU  67   4.735   0.888  -7.402
  499   HD22  LEU  67          HD22      LEU  67   3.511  -0.330  -7.684
  500   HD23  LEU  67          HD23      LEU  67   3.896   0.149  -6.035
  501    H    THR  68           HN       THR  68  -0.987   0.324  -8.355
  502    HA   THR  68           HA       THR  68  -3.104  -0.263  -6.429
  503    HB   THR  68           HB       THR  68  -3.520   0.146  -9.410
  504    HG1  THR  68           HG1      THR  68  -3.408   1.870  -7.266
  505   HG21  THR  68          HG21      THR  68  -5.884   0.209  -8.788
  506   HG22  THR  68          HG22      THR  68  -5.461   0.019  -7.089
  507   HG23  THR  68          HG23      THR  68  -5.161  -1.297  -8.220
  508    H    ASN  69           HN       ASN  69  -2.927  -2.359  -6.000
  509    HA   ASN  69           HA       ASN  69  -2.459  -4.571  -6.112
  510    HB2  ASN  69           HB2      ASN  69  -3.144  -4.150  -9.026
  511    HB3  ASN  69           HB1      ASN  69  -2.765  -5.731  -8.362
  512   HD21  ASN  69          HD21      ASN  69  -4.246  -6.729  -7.026
  513   HD22  ASN  69          HD22      ASN  69  -5.881  -6.191  -6.924
  514    HA   PRO  70           HA       PRO  70   1.824  -3.885  -8.138
  515    HB2  PRO  70           HB2      PRO  70   3.341  -3.032  -6.130
  516    HB3  PRO  70           HB1      PRO  70   2.320  -1.890  -7.018
  517    HG2  PRO  70           HG2      PRO  70   1.758  -3.290  -4.432
  518    HG3  PRO  70           HG1      PRO  70   1.644  -1.544  -4.775
  519    HD2  PRO  70           HD2      PRO  70  -0.534  -3.138  -4.830
  520    HD3  PRO  70           HD1      PRO  70  -0.331  -1.799  -5.970
  521    H    SER  71           HN       SER  71   3.661  -5.293  -7.767
  522    HA   SER  71           HA       SER  71   2.942  -7.588  -6.182
  523    HB2  SER  71           HB2      SER  71   5.399  -7.078  -7.873
  524    HB3  SER  71           HB1      SER  71   4.845  -8.639  -7.258
  525    HG   SER  71           HG       SER  71   2.910  -7.317  -8.605
  526    H    ALA  72           HN       ALA  72   4.415  -8.493  -4.617
  527    HA   ALA  72           HA       ALA  72   5.100  -6.767  -2.567
  528    HB1  ALA  72           HB1      ALA  72   4.647  -9.152  -2.266
  529    HB2  ALA  72           HB2      ALA  72   6.171  -8.682  -1.510
  530    HB3  ALA  72           HB3      ALA  72   6.177  -9.537  -3.052
  531    H    ASP  73           HN       ASP  73   7.193  -8.203  -5.007
  532    HA   ASP  73           HA       ASP  73   9.645  -7.256  -4.034
  533    HB2  ASP  73           HB2      ASP  73   9.596  -8.974  -5.739
  534    HB3  ASP  73           HB1      ASP  73   8.832  -7.870  -6.879
  535    H    GLU  74           HN       GLU  74   7.298  -5.761  -6.169
  536    HA   GLU  74           HA       GLU  74   8.878  -3.528  -6.936
  537    HB2  GLU  74           HB2      GLU  74   5.885  -3.779  -6.778
  538    HB3  GLU  74           HB1      GLU  74   6.770  -2.535  -7.646
  539    HG2  GLU  74           HG2      GLU  74   7.708  -4.231  -9.110
  540    HG3  GLU  74           HG1      GLU  74   6.811  -5.476  -8.239
  541    H    VAL  75           HN       VAL  75   6.525  -4.125  -4.431
  542    HA   VAL  75           HA       VAL  75   6.419  -1.562  -3.306
  543    HB   VAL  75           HB       VAL  75   6.047  -4.271  -1.984
  544   HG11  VAL  75          HG11      VAL  75   4.819  -3.088  -0.227
  545   HG12  VAL  75          HG12      VAL  75   5.226  -1.546  -0.975
  546   HG13  VAL  75          HG13      VAL  75   6.498  -2.558  -0.301
  547   HG21  VAL  75          HG21      VAL  75   4.487  -3.871  -3.805
  548   HG22  VAL  75          HG22      VAL  75   4.041  -2.316  -3.102
  549   HG23  VAL  75          HG23      VAL  75   3.648  -3.812  -2.254
  550    H    LYS  76           HN       LYS  76   8.485  -4.327  -2.670
  551    HA   LYS  76           HA       LYS  76   9.916  -3.142  -0.541
  552    HB2  LYS  76           HB2      LYS  76   9.721  -5.624  -1.105
  553    HB3  LYS  76           HB1      LYS  76  10.912  -5.337  -2.353
  554    HG2  LYS  76           HG2      LYS  76  11.936  -6.271  -0.362
  555    HG3  LYS  76           HG1      LYS  76  12.534  -4.636  -0.653
  556    HD2  LYS  76           HD2      LYS  76  11.103  -3.748   1.064
  557    HD3  LYS  76           HD1      LYS  76  10.285  -5.303   1.243
  558    HE2  LYS  76           HE2      LYS  76  13.207  -4.834   1.819
  559    HE3  LYS  76           HE1      LYS  76  11.935  -4.775   3.034
  560    HZ1  LYS  76           HZ1      LYS  76  13.072  -6.912   2.968
  561    HZ2  LYS  76           HZ2      LYS  76  12.601  -7.162   1.381
  562    HZ3  LYS  76           HZ3      LYS  76  11.440  -7.107   2.610
  563    H    ALA  77           HN       ALA  77  10.509  -3.376  -4.027
  564    HA   ALA  77           HA       ALA  77  13.079  -2.199  -4.027
  565    HB1  ALA  77           HB1      ALA  77  11.031  -2.266  -6.245
  566    HB2  ALA  77           HB2      ALA  77  12.208  -3.533  -5.901
  567    HB3  ALA  77           HB3      ALA  77  12.754  -1.941  -6.433
  568    H    LYS  78           HN       LYS  78   9.834  -0.819  -4.397
  569    HA   LYS  78           HA       LYS  78  10.812   1.852  -4.696
  570    HB2  LYS  78           HB2      LYS  78   8.107   0.733  -4.014
  571    HB3  LYS  78           HB1      LYS  78   8.425   2.450  -3.859
  572    HG2  LYS  78           HG2      LYS  78   8.689   0.843  -6.401
  573    HG3  LYS  78           HG1      LYS  78   7.345   1.913  -5.979
  574    HD2  LYS  78           HD2      LYS  78   8.973   3.805  -5.829
  575    HD3  LYS  78           HD1      LYS  78  10.224   2.699  -6.391
  576    HE2  LYS  78           HE2      LYS  78   9.457   4.022  -8.241
  577    HE3  LYS  78           HE1      LYS  78   8.950   2.351  -8.465
  578    HZ1  LYS  78           HZ1      LYS  78   7.186   4.558  -7.471
  579    HZ2  LYS  78           HZ2      LYS  78   6.723   2.943  -7.809
  580    HZ3  LYS  78           HZ3      LYS  78   7.228   3.940  -9.028
  581    H    LEU  79           HN       LEU  79   9.896  -0.091  -1.936
  582    HA   LEU  79           HA       LEU  79   9.924   1.953  -0.101
  583    HB2  LEU  79           HB2      LEU  79   9.132  -0.482   0.337
  584    HB3  LEU  79           HB1      LEU  79  10.807  -0.860   0.432
  585    HG   LEU  79           HG       LEU  79  11.119   0.503   2.367
  586   HD11  LEU  79          HD11      LEU  79   8.226   1.223   2.079
  587   HD12  LEU  79          HD12      LEU  79   9.640   2.293   2.334
  588   HD13  LEU  79          HD13      LEU  79   9.068   1.254   3.610
  589   HD21  LEU  79          HD21      LEU  79  10.545  -1.825   2.693
  590   HD22  LEU  79          HD22      LEU  79   8.827  -1.410   2.629
  591   HD23  LEU  79          HD23      LEU  79   9.823  -0.827   3.960
  592    H    VAL  80           HN       VAL  80  12.521  -0.269  -1.047
  593    HA   VAL  80           HA       VAL  80  14.427   0.751   0.729
  594    HB   VAL  80           HB       VAL  80  16.138  -0.421  -0.585
  595   HG11  VAL  80          HG11      VAL  80  15.241  -2.677  -0.435
  596   HG12  VAL  80          HG12      VAL  80  13.622  -2.010  -0.224
  597   HG13  VAL  80          HG13      VAL  80  14.865  -1.708   0.990
  598   HG21  VAL  80          HG21      VAL  80  15.465   0.026  -2.822
  599   HG22  VAL  80          HG22      VAL  80  13.926  -0.767  -2.550
  600   HG23  VAL  80          HG23      VAL  80  15.418  -1.734  -2.592
  601    H    LYS  81           HN       LYS  81  13.503   1.890  -2.431
  602    HA   LYS  81           HA       LYS  81  15.825   3.577  -2.539
  603    HB2  LYS  81           HB2      LYS  81  15.011   4.444  -4.671
  604    HB3  LYS  81           HB1      LYS  81  14.900   2.692  -4.636
  605    HG2  LYS  81           HG2      LYS  81  12.544   2.805  -4.264
  606    HG3  LYS  81           HG1      LYS  81  12.616   4.559  -4.169
  607    HD2  LYS  81           HD2      LYS  81  11.810   4.079  -6.355
  608    HD3  LYS  81           HD1      LYS  81  13.486   4.539  -6.541
  609    HE2  LYS  81           HE2      LYS  81  12.629   1.650  -6.387
  610    HE3  LYS  81           HE1      LYS  81  12.663   2.536  -7.902
  611    HZ1  LYS  81           HZ1      LYS  81  15.054   2.904  -7.536
  612    HZ2  LYS  81           HZ2      LYS  81  14.645   1.301  -7.677
  613    HZ3  LYS  81           HZ3      LYS  81  15.024   1.906  -6.167
  614    H    ILE  82           HN       ILE  82  12.373   4.079  -1.829
  615    HA   ILE  82           HA       ILE  82  12.930   6.877  -1.562
  616    HB   ILE  82           HB       ILE  82  10.517   7.222  -1.012
  617   HG12  ILE  82          HG12      ILE  82   8.918   5.321  -1.577
  618   HG13  ILE  82          HG11      ILE  82  10.287   4.232  -1.491
  619   HG21  ILE  82          HG21      ILE  82  11.037   5.673  -3.529
  620   HG22  ILE  82          HG22      ILE  82  11.326   7.399  -3.281
  621   HG23  ILE  82          HG23      ILE  82   9.683   6.758  -3.243
  622   HD11  ILE  82          HD11      ILE  82  10.555   4.776   0.865
  623   HD12  ILE  82          HD12      ILE  82   8.937   4.157   0.517
  624   HD13  ILE  82          HD13      ILE  82   9.189   5.884   0.766
  625    H    ALA  83           HN       ALA  83  12.946   4.245   0.572
  626    HA   ALA  83           HA       ALA  83  12.702   6.048   2.843
  627    HB1  ALA  83           HB1      ALA  83  12.530   4.036   4.221
  628    HB2  ALA  83           HB2      ALA  83  12.803   3.036   2.795
  629    HB3  ALA  83           HB3      ALA  83  11.348   4.023   2.915
  630    H    GLY  84           HN       GLY  84  15.052   5.130   0.882
  631    HA2  GLY  84           HA2      GLY  84  17.275   5.789   1.101
  632    HA3  GLY  84           HA1      GLY  84  17.024   5.963   2.822
  633    H    LEU  85           HN       LEU  85  19.264   5.037   2.372
  634    HA   LEU  85           HA       LEU  85  19.728   2.339   1.704
  635    HB2  LEU  85           HB2      LEU  85  21.437   4.106   1.700
  636    HB3  LEU  85           HB1      LEU  85  21.301   4.241   3.437
  637    HG   LEU  85           HG       LEU  85  22.152   1.896   3.620
  638   HD11  LEU  85          HD11      LEU  85  21.576   1.090   1.426
  639   HD12  LEU  85          HD12      LEU  85  23.314   0.938   1.699
  640   HD13  LEU  85          HD13      LEU  85  22.692   2.236   0.683
  641   HD21  LEU  85          HD21      LEU  85  24.480   2.492   3.167
  642   HD22  LEU  85          HD22      LEU  85  23.615   3.800   3.971
  643   HD23  LEU  85          HD23      LEU  85  23.940   3.890   2.239
  644    H    GLU  86           HN       GLU  86  18.693   3.907   4.546
  645    HA   GLU  86           HA       GLU  86  19.539   2.112   6.545
  646    HB2  GLU  86           HB2      GLU  86  17.206   4.009   6.616
  647    HB3  GLU  86           HB1      GLU  86  18.057   3.333   7.996
  648    HG2  GLU  86           HG2      GLU  86  20.100   4.518   7.252
  649    HG3  GLU  86           HG1      GLU  86  19.155   5.253   5.964
  650    H    HIS  87           HN       HIS  87  16.817   2.077   4.377
  651    HA   HIS  87           HA       HIS  87  15.590   0.034   6.035
  652    HB2  HIS  87           HB2      HIS  87  14.407   1.771   3.879
  653    HB3  HIS  87           HB1      HIS  87  13.554   0.391   4.563
  654    HD1  HIS  87           HD1      HIS  87  14.466   3.957   5.342
  655    HD2  HIS  87           HD2      HIS  87  12.797   0.668   7.285
  656    HE1  HIS  87           HE1      HIS  87  13.451   4.833   7.463
  657    H    HIS  88           HN       HIS  88  15.982  -1.931   5.614
  658    HA   HIS  88           HA       HIS  88  15.968  -3.021   3.014
  659    HB2  HIS  88           HB2      HIS  88  18.267  -3.995   3.181
  660    HB3  HIS  88           HB1      HIS  88  18.301  -2.253   3.020
  661    HD1  HIS  88           HD1      HIS  88  19.790  -4.906   4.926
  662    HD2  HIS  88           HD2      HIS  88  18.719  -0.968   5.679
  663    HE1  HIS  88           HE1      HIS  88  21.148  -4.178   6.938
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1   8.904   5.170  14.929
    2    H2   MET   1           HT2      MET   1   9.839   6.378  14.283
    3    H3   MET   1           HT3      MET   1  10.501   5.387  15.454
    4    HA   MET   1           HA       MET   1  11.296   4.800  13.232
    5    HB2  MET   1           HB2      MET   1   9.189   2.789  14.124
    6    HB3  MET   1           HB1      MET   1  10.551   2.467  13.074
    7    HG2  MET   1           HG2      MET   1  12.090   2.870  14.906
    8    HG3  MET   1           HG1      MET   1  10.734   3.268  15.958
    9    HE1  MET   1           HE1      MET   1  12.548   0.432  13.936
   10    HE2  MET   1           HE2      MET   1  10.926   0.362  13.247
   11    HE3  MET   1           HE3      MET   1  11.518  -0.962  14.251
   12    H    VAL   2           HN       VAL   2  10.732   4.361  11.020
   13    HA   VAL   2           HA       VAL   2   8.359   5.763  10.243
   14    HB   VAL   2           HB       VAL   2  10.289   4.210   8.486
   15   HG11  VAL   2          HG11      VAL   2   9.437   5.616   6.664
   16   HG12  VAL   2          HG12      VAL   2   8.295   6.362   7.779
   17   HG13  VAL   2          HG13      VAL   2   8.159   4.647   7.395
   18   HG21  VAL   2          HG21      VAL   2  11.356   6.371   8.006
   19   HG22  VAL   2          HG22      VAL   2  11.483   5.945   9.714
   20   HG23  VAL   2          HG23      VAL   2  10.304   7.148   9.190
   21    H    THR   3           HN       THR   3   6.604   4.660  10.842
   22    HA   THR   3           HA       THR   3   6.321   1.840  10.353
   23    HB   THR   3           HB       THR   3   4.241   3.853  11.273
   24    HG1  THR   3           HG1      THR   3   4.832   3.386  13.313
   25   HG21  THR   3          HG21      THR   3   3.301   1.714  10.488
   26   HG22  THR   3          HG22      THR   3   3.116   1.883  12.235
   27   HG23  THR   3          HG23      THR   3   4.375   0.838  11.578
   28    H    ALA   4           HN       ALA   4   4.933   4.881   9.133
   29    HA   ALA   4           HA       ALA   4   3.636   3.331   7.053
   30    HB1  ALA   4           HB1      ALA   4   2.252   5.265   6.604
   31    HB2  ALA   4           HB2      ALA   4   3.173   6.222   7.761
   32    HB3  ALA   4           HB3      ALA   4   2.189   4.867   8.322
   33    H    ALA   5           HN       ALA   5   5.700   2.957   6.143
   34    HA   ALA   5           HA       ALA   5   6.873   5.121   4.624
   35    HB1  ALA   5           HB1      ALA   5   8.286   3.280   5.374
   36    HB2  ALA   5           HB2      ALA   5   8.236   3.293   3.608
   37    HB3  ALA   5           HB3      ALA   5   7.270   2.121   4.521
   38    H    LEU   6           HN       LEU   6   4.487   2.723   4.387
   39    HA   LEU   6           HA       LEU   6   3.480   3.895   1.986
   40    HB2  LEU   6           HB2      LEU   6   2.786   1.597   1.169
   41    HB3  LEU   6           HB1      LEU   6   4.452   2.025   0.921
   42    HG   LEU   6           HG       LEU   6   3.665   0.369   3.284
   43   HD11  LEU   6          HD11      LEU   6   4.047  -1.634   1.907
   44   HD12  LEU   6          HD12      LEU   6   4.250  -0.613   0.481
   45   HD13  LEU   6          HD13      LEU   6   2.683  -0.706   1.284
   46   HD21  LEU   6          HD21      LEU   6   5.918  -0.518   2.997
   47   HD22  LEU   6          HD22      LEU   6   5.934   1.240   3.155
   48   HD23  LEU   6          HD23      LEU   6   6.132   0.494   1.566
   49    H    THR   7           HN       THR   7   1.454   4.221   2.103
   50    HA   THR   7           HA       THR   7  -0.023   3.243   4.412
   51    HB   THR   7           HB       THR   7  -0.603   5.527   2.490
   52    HG1  THR   7           HG1      THR   7   0.509   5.635   5.108
   53   HG21  THR   7          HG21      THR   7  -1.681   4.887   5.244
   54   HG22  THR   7          HG22      THR   7  -2.556   4.711   3.718
   55   HG23  THR   7          HG23      THR   7  -2.085   6.312   4.285
   56    H    ILE   8           HN       ILE   8  -1.411   1.629   3.969
   57    HA   ILE   8           HA       ILE   8  -2.157   1.149   1.173
   58    HB   ILE   8           HB       ILE   8  -1.825  -0.797   3.461
   59   HG12  ILE   8          HG12      ILE   8  -0.344  -0.493   0.846
   60   HG13  ILE   8          HG11      ILE   8   0.264  -0.055   2.438
   61   HG21  ILE   8          HG21      ILE   8  -2.391  -2.585   1.863
   62   HG22  ILE   8          HG22      ILE   8  -2.791  -1.367   0.645
   63   HG23  ILE   8          HG23      ILE   8  -3.729  -1.467   2.141
   64   HD11  ILE   8          HD11      ILE   8   0.182  -2.384   3.113
   65   HD12  ILE   8          HD12      ILE   8   1.172  -2.171   1.668
   66   HD13  ILE   8          HD13      ILE   8  -0.464  -2.821   1.530
   67    H    TYR   9           HN       TYR   9  -4.187   1.076   0.657
   68    HA   TYR   9           HA       TYR   9  -6.141   1.620   2.687
   69    HB2  TYR   9           HB2      TYR   9  -6.346   1.447  -0.324
   70    HB3  TYR   9           HB1      TYR   9  -7.690   1.885   0.721
   71    HD1  TYR   9           HD1      TYR   9  -4.435   2.984  -0.620
   72    HD2  TYR   9           HD2      TYR   9  -7.783   4.085   1.755
   73    HE1  TYR   9           HE1      TYR   9  -3.683   5.312  -0.657
   74    HE2  TYR   9           HE2      TYR   9  -7.035   6.429   1.722
   75    HH   TYR   9           HH       TYR   9  -4.935   7.667   1.417
   76    H    THR  10           HN       THR  10  -7.494   0.145   3.604
   77    HA   THR  10           HA       THR  10  -7.723  -2.469   2.335
   78    HB   THR  10           HB       THR  10  -7.629  -3.463   4.638
   79    HG1  THR  10           HG1      THR  10  -6.635  -2.218   6.259
   80   HG21  THR  10          HG21      THR  10  -5.171  -3.458   4.796
   81   HG22  THR  10          HG22      THR  10  -5.112  -2.063   3.717
   82   HG23  THR  10          HG23      THR  10  -5.699  -3.614   3.116
   83    H    THR  11           HN       THR  11  -9.567  -3.712   3.180
   84    HA   THR  11           HA       THR  11 -11.563  -2.321   4.717
   85    HB   THR  11           HB       THR  11 -12.213  -3.561   1.952
   86    HG1  THR  11           HG1      THR  11 -11.259  -1.137   2.648
   87   HG21  THR  11          HG21      THR  11 -13.856  -1.876   3.853
   88   HG22  THR  11          HG22      THR  11 -14.029  -3.620   3.627
   89   HG23  THR  11          HG23      THR  11 -14.363  -2.510   2.285
   90    H    SER  12           HN       SER  12 -12.925  -3.961   5.799
   91    HA   SER  12           HA       SER  12 -11.785  -6.460   6.252
   92    HB2  SER  12           HB2      SER  12 -14.252  -6.993   7.054
   93    HB3  SER  12           HB1      SER  12 -13.275  -5.812   7.929
   94    HG   SER  12           HG       SER  12 -14.308  -4.197   6.999
   95    H    TRP  13           HN       TRP  13 -14.404  -5.561   4.076
   96    HA   TRP  13           HA       TRP  13 -14.270  -8.057   2.587
   97    HB2  TRP  13           HB2      TRP  13 -16.334  -7.222   1.946
   98    HB3  TRP  13           HB1      TRP  13 -15.997  -5.664   2.663
   99    HD1  TRP  13           HD1      TRP  13 -14.730  -7.485  -0.456
  100    HE1  TRP  13           HE1      TRP  13 -14.632  -5.918  -2.294
  101    HE3  TRP  13           HE3      TRP  13 -16.775  -3.476   1.926
  102    HZ2  TRP  13           HZ2      TRP  13 -15.466  -3.179  -2.869
  103    HZ3  TRP  13           HZ3      TRP  13 -17.124  -1.406   0.638
  104    HH2  TRP  13           HH2      TRP  13 -16.489  -1.265  -1.714
  105    H    CYS  14           HN       CYS  14 -12.377  -8.567   2.262
  106    HA   CYS  14           HA       CYS  14 -11.142  -7.485  -0.048
  107    HB2  CYS  14           HB2      CYS  14 -10.033  -6.807   2.598
  108    HB3  CYS  14           HB1      CYS  14  -8.883  -7.425   1.417
  109    H    GLY  15           HN       GLY  15 -10.728  -9.231  -1.088
  110    HA2  GLY  15           HA2      GLY  15  -9.539 -11.508   0.317
  111    HA3  GLY  15           HA1      GLY  15 -10.313 -11.579  -1.269
  112    H    TYR  16           HN       TYR  16  -9.296  -9.724  -2.747
  113    HA   TYR  16           HA       TYR  16  -6.670 -10.650  -3.161
  114    HB2  TYR  16           HB2      TYR  16  -6.619  -8.921  -5.069
  115    HB3  TYR  16           HB1      TYR  16  -7.735 -10.263  -5.187
  116    HD1  TYR  16           HD1      TYR  16  -7.697  -6.698  -3.979
  117    HD2  TYR  16           HD2      TYR  16  -9.869  -9.800  -5.910
  118    HE1  TYR  16           HE1      TYR  16  -9.561  -5.111  -4.499
  119    HE2  TYR  16           HE2      TYR  16 -11.693  -8.219  -6.406
  120    HH   TYR  16           HH       TYR  16 -12.560  -6.045  -5.411
  121    H    CYS  17           HN       CYS  17  -7.830  -7.995  -1.386
  122    HA   CYS  17           HA       CYS  17  -5.439  -6.425  -1.450
  123    HB2  CYS  17           HB2      CYS  17  -7.168  -6.555   0.990
  124    HB3  CYS  17           HB1      CYS  17  -6.339  -5.189   0.306
  125    H    LEU  18           HN       LEU  18  -6.628  -9.170   0.366
  126    HA   LEU  18           HA       LEU  18  -4.793  -8.969   2.517
  127    HB2  LEU  18           HB2      LEU  18  -7.087 -10.005   2.526
  128    HB3  LEU  18           HB1      LEU  18  -6.374 -11.368   1.685
  129    HG   LEU  18           HG       LEU  18  -4.899 -11.797   3.593
  130   HD11  LEU  18          HD11      LEU  18  -6.331  -9.442   4.832
  131   HD12  LEU  18          HD12      LEU  18  -4.608  -9.536   4.438
  132   HD13  LEU  18          HD13      LEU  18  -5.283 -10.561   5.693
  133   HD21  LEU  18          HD21      LEU  18  -6.618 -12.494   5.156
  134   HD22  LEU  18          HD22      LEU  18  -7.095 -12.817   3.476
  135   HD23  LEU  18          HD23      LEU  18  -7.760 -11.419   4.337
  136    H    ARG  19           HN       ARG  19  -4.911 -10.521  -0.551
  137    HA   ARG  19           HA       ARG  19  -2.856 -12.410  -0.376
  138    HB2  ARG  19           HB2      ARG  19  -3.722 -10.713  -2.720
  139    HB3  ARG  19           HB1      ARG  19  -2.683 -12.121  -2.838
  140    HG2  ARG  19           HG2      ARG  19  -5.471 -12.260  -1.713
  141    HG3  ARG  19           HG1      ARG  19  -5.133 -12.433  -3.432
  142    HD2  ARG  19           HD2      ARG  19  -5.335 -14.608  -2.384
  143    HD3  ARG  19           HD1      ARG  19  -3.692 -14.351  -2.948
  144    HE   ARG  19           HE       ARG  19  -4.403 -13.919  -0.131
  145   HH11  ARG  19          HH11      ARG  19  -2.485 -15.635  -2.553
  146   HH12  ARG  19          HH12      ARG  19  -1.502 -16.437  -1.429
  147   HH21  ARG  19          HH21      ARG  19  -3.074 -15.030   1.427
  148   HH22  ARG  19          HH22      ARG  19  -1.842 -16.099   0.918
  149    H    LEU  20           HN       LEU  20  -2.761  -8.974  -1.036
  150    HA   LEU  20           HA       LEU  20   0.064  -8.955  -1.454
  151    HB2  LEU  20           HB2      LEU  20  -1.289  -7.335  -2.628
  152    HB3  LEU  20           HB1      LEU  20  -1.972  -6.754  -1.129
  153    HG   LEU  20           HG       LEU  20   0.425  -5.995  -0.574
  154   HD11  LEU  20          HD11      LEU  20   0.745  -6.400  -3.538
  155   HD12  LEU  20          HD12      LEU  20   1.826  -6.968  -2.237
  156   HD13  LEU  20          HD13      LEU  20   1.687  -5.275  -2.597
  157   HD21  LEU  20          HD21      LEU  20  -1.375  -4.465  -0.942
  158   HD22  LEU  20          HD22      LEU  20  -1.257  -4.674  -2.680
  159   HD23  LEU  20          HD23      LEU  20   0.052  -3.867  -1.800
  160    H    LYS  21           HN       LYS  21  -2.209  -8.083   1.043
  161    HA   LYS  21           HA       LYS  21  -0.546  -6.752   2.822
  162    HB2  LYS  21           HB2      LYS  21  -3.046  -6.797   2.847
  163    HB3  LYS  21           HB1      LYS  21  -2.962  -8.424   3.507
  164    HG2  LYS  21           HG2      LYS  21  -1.868  -7.603   5.489
  165    HG3  LYS  21           HG1      LYS  21  -1.824  -5.974   4.822
  166    HD2  LYS  21           HD2      LYS  21  -4.291  -5.961   4.774
  167    HD3  LYS  21           HD1      LYS  21  -4.299  -7.555   5.527
  168    HE2  LYS  21           HE2      LYS  21  -3.040  -6.622   7.451
  169    HE3  LYS  21           HE1      LYS  21  -3.128  -5.030   6.707
  170    HZ1  LYS  21           HZ1      LYS  21  -5.588  -5.237   6.832
  171    HZ2  LYS  21           HZ2      LYS  21  -4.829  -5.148   8.296
  172    HZ3  LYS  21           HZ3      LYS  21  -5.388  -6.660   7.720
  173    H    THR  22           HN       THR  22  -1.374 -10.227   2.718
  174    HA   THR  22           HA       THR  22   0.211 -10.914   4.944
  175    HB   THR  22           HB       THR  22  -1.576 -12.425   4.142
  176    HG1  THR  22           HG1      THR  22  -0.081 -14.380   3.842
  177   HG21  THR  22          HG21      THR  22  -1.332 -12.078   1.727
  178   HG22  THR  22          HG22      THR  22  -1.300 -13.793   2.122
  179   HG23  THR  22          HG23      THR  22   0.203 -12.943   1.752
  180    H    ALA  23           HN       ALA  23   0.915 -10.593   1.529
  181    HA   ALA  23           HA       ALA  23   3.446 -11.864   1.485
  182    HB1  ALA  23           HB1      ALA  23   2.115 -11.409  -0.541
  183    HB2  ALA  23           HB2      ALA  23   3.747 -10.750  -0.657
  184    HB3  ALA  23           HB3      ALA  23   2.385  -9.682  -0.307
  185    H    LEU  24           HN       LEU  24   2.500  -8.506   1.899
  186    HA   LEU  24           HA       LEU  24   5.157  -7.537   2.036
  187    HB2  LEU  24           HB2      LEU  24   2.644  -6.328   3.143
  188    HB3  LEU  24           HB1      LEU  24   4.161  -5.482   2.929
  189    HG   LEU  24           HG       LEU  24   2.374  -6.574   0.762
  190   HD11  LEU  24          HD11      LEU  24   3.115  -3.765   1.515
  191   HD12  LEU  24          HD12      LEU  24   1.579  -4.563   1.836
  192   HD13  LEU  24          HD13      LEU  24   2.069  -4.246   0.175
  193   HD21  LEU  24          HD21      LEU  24   4.714  -6.810   0.099
  194   HD22  LEU  24          HD22      LEU  24   5.007  -5.119   0.512
  195   HD23  LEU  24          HD23      LEU  24   3.928  -5.529  -0.820
  196    H    THR  25           HN       THR  25   2.901  -8.637   4.487
  197    HA   THR  25           HA       THR  25   4.462  -7.832   6.692
  198    HB   THR  25           HB       THR  25   2.422 -10.074   6.562
  199    HG1  THR  25           HG1      THR  25   1.294  -8.341   5.927
  200   HG21  THR  25          HG21      THR  25   3.331  -8.311   8.861
  201   HG22  THR  25          HG22      THR  25   3.769 -10.002   8.649
  202   HG23  THR  25          HG23      THR  25   2.086  -9.557   8.946
  203    H    ALA  26           HN       ALA  26   4.233 -10.902   4.900
  204    HA   ALA  26           HA       ALA  26   6.142 -12.282   6.447
  205    HB1  ALA  26           HB1      ALA  26   5.360 -12.737   3.564
  206    HB2  ALA  26           HB2      ALA  26   4.529 -13.410   4.966
  207    HB3  ALA  26           HB3      ALA  26   6.191 -13.890   4.611
  208    H    ASN  27           HN       ASN  27   6.424  -9.941   3.990
  209    HA   ASN  27           HA       ASN  27   9.243 -10.512   3.530
  210    HB2  ASN  27           HB2      ASN  27   7.192  -8.893   2.193
  211    HB3  ASN  27           HB1      ASN  27   8.875  -8.356   1.981
  212   HD21  ASN  27          HD21      ASN  27   6.476 -10.714   1.289
  213   HD22  ASN  27          HD22      ASN  27   7.355 -11.618   0.113
  214    H    ARG  28           HN       ARG  28   7.697  -9.063   5.902
  215    HA   ARG  28           HA       ARG  28   8.284  -7.678   7.582
  216    HB2  ARG  28           HB2      ARG  28  10.991  -7.830   6.260
  217    HB3  ARG  28           HB1      ARG  28  10.711  -7.040   7.805
  218    HG2  ARG  28           HG2      ARG  28   9.994  -9.144   8.769
  219    HG3  ARG  28           HG1      ARG  28  10.195  -9.948   7.208
  220    HD2  ARG  28           HD2      ARG  28  12.362  -8.563   8.747
  221    HD3  ARG  28           HD1      ARG  28  12.103 -10.312   8.737
  222    HE   ARG  28           HE       ARG  28  12.333  -9.837   6.166
  223   HH11  ARG  28          HH11      ARG  28  14.324  -8.589   8.811
  224   HH12  ARG  28          HH12      ARG  28  15.738  -8.516   7.879
  225   HH21  ARG  28          HH21      ARG  28  14.288  -9.751   4.902
  226   HH22  ARG  28          HH22      ARG  28  15.719  -9.152   5.620
  227    H    ILE  29           HN       ILE  29   7.327  -6.600   5.006
  228    HA   ILE  29           HA       ILE  29   8.550  -4.002   4.903
  229    HB   ILE  29           HB       ILE  29   6.243  -5.190   3.320
  230   HG12  ILE  29          HG12      ILE  29   9.102  -4.568   2.488
  231   HG13  ILE  29          HG11      ILE  29   8.481  -6.173   2.839
  232   HG21  ILE  29          HG21      ILE  29   6.427  -3.202   1.867
  233   HG22  ILE  29          HG22      ILE  29   7.633  -2.527   2.965
  234   HG23  ILE  29          HG23      ILE  29   5.978  -2.770   3.519
  235   HD11  ILE  29          HD11      ILE  29   6.976  -5.995   0.930
  236   HD12  ILE  29          HD12      ILE  29   8.657  -5.763   0.457
  237   HD13  ILE  29          HD13      ILE  29   7.582  -4.372   0.605
  238    H    ALA  30           HN       ALA  30   7.879  -2.403   6.131
  239    HA   ALA  30           HA       ALA  30   5.548  -2.738   7.803
  240    HB1  ALA  30           HB1      ALA  30   7.636  -1.904   8.774
  241    HB2  ALA  30           HB2      ALA  30   6.332  -0.721   8.940
  242    HB3  ALA  30           HB3      ALA  30   7.569  -0.507   7.701
  243    H    TYR  31           HN       TYR  31   3.669  -1.835   7.488
  244    HA   TYR  31           HA       TYR  31   3.384   0.465   5.740
  245    HB2  TYR  31           HB2      TYR  31   1.527  -0.629   4.505
  246    HB3  TYR  31           HB1      TYR  31   3.054  -1.460   4.242
  247    HD1  TYR  31           HD1      TYR  31  -0.228  -1.669   5.919
  248    HD2  TYR  31           HD2      TYR  31   3.376  -3.720   4.979
  249    HE1  TYR  31           HE1      TYR  31  -1.239  -3.779   6.658
  250    HE2  TYR  31           HE2      TYR  31   2.370  -5.831   5.724
  251    HH   TYR  31           HH       TYR  31   0.640  -6.686   7.007
  252    H    ASP  32           HN       ASP  32   1.110   1.272   5.920
  253    HA   ASP  32           HA       ASP  32  -0.116   0.551   8.493
  254    HB2  ASP  32           HB2      ASP  32   1.185   2.705   8.611
  255    HB3  ASP  32           HB1      ASP  32   0.115   3.353   7.375
  256    H    GLU  33           HN       GLU  33  -2.357   0.367   8.372
  257    HA   GLU  33           HA       GLU  33  -3.383   0.663   5.656
  258    HB2  GLU  33           HB2      GLU  33  -5.109  -0.971   6.222
  259    HB3  GLU  33           HB1      GLU  33  -3.499  -1.607   6.485
  260    HG2  GLU  33           HG2      GLU  33  -3.780  -1.205   8.902
  261    HG3  GLU  33           HG1      GLU  33  -5.428  -0.657   8.583
  262    H    VAL  34           HN       VAL  34  -5.293   1.639   5.216
  263    HA   VAL  34           HA       VAL  34  -5.722   3.924   6.935
  264    HB   VAL  34           HB       VAL  34  -7.060   3.512   4.264
  265   HG11  VAL  34          HG11      VAL  34  -6.420   6.014   5.778
  266   HG12  VAL  34          HG12      VAL  34  -8.011   5.284   5.522
  267   HG13  VAL  34          HG13      VAL  34  -7.107   5.922   4.152
  268   HG21  VAL  34          HG21      VAL  34  -4.660   3.211   3.983
  269   HG22  VAL  34          HG22      VAL  34  -4.376   4.731   4.835
  270   HG23  VAL  34          HG23      VAL  34  -5.196   4.735   3.274
  271    H    ASP  35           HN       ASP  35  -7.458   4.710   7.677
  272    HA   ASP  35           HA       ASP  35  -9.406   3.225   8.985
  273    HB2  ASP  35           HB2      ASP  35 -10.322   5.527   9.494
  274    HB3  ASP  35           HB1      ASP  35  -8.668   5.179   9.992
  275    H    ILE  36           HN       ILE  36  -9.563   3.901   5.743
  276    HA   ILE  36           HA       ILE  36 -11.884   5.254   5.168
  277    HB   ILE  36           HB       ILE  36 -12.089   4.115   3.033
  278   HG12  ILE  36          HG12      ILE  36  -9.825   2.330   3.853
  279   HG13  ILE  36          HG11      ILE  36 -11.509   1.815   4.010
  280   HG21  ILE  36          HG21      ILE  36 -10.417   5.843   3.347
  281   HG22  ILE  36          HG22      ILE  36  -9.909   4.650   2.157
  282   HG23  ILE  36          HG23      ILE  36  -9.223   4.622   3.794
  283   HD11  ILE  36          HD11      ILE  36 -11.825   2.082   1.621
  284   HD12  ILE  36          HD12      ILE  36 -10.472   0.994   1.926
  285   HD13  ILE  36          HD13      ILE  36 -10.187   2.680   1.446
  286    H    GLU  37           HN       GLU  37 -11.859   2.058   6.467
  287    HA   GLU  37           HA       GLU  37 -14.463   1.284   5.645
  288    HB2  GLU  37           HB2      GLU  37 -12.733  -0.304   6.374
  289    HB3  GLU  37           HB1      GLU  37 -12.787   0.370   7.990
  290    HG2  GLU  37           HG2      GLU  37 -15.050  -0.433   8.281
  291    HG3  GLU  37           HG1      GLU  37 -15.071  -1.025   6.619
  292    H    HIS  38           HN       HIS  38 -13.242   3.334   8.098
  293    HA   HIS  38           HA       HIS  38 -15.869   3.514   9.434
  294    HB2  HIS  38           HB2      HIS  38 -13.130   4.319  10.462
  295    HB3  HIS  38           HB1      HIS  38 -14.638   4.539  11.332
  296    HD1  HIS  38           HD1      HIS  38 -15.087   2.707  13.026
  297    HD2  HIS  38           HD2      HIS  38 -12.628   1.430   9.923
  298    HE1  HIS  38           HE1      HIS  38 -14.379   0.385  13.607
  299    H    ASN  39           HN       ASN  39 -13.258   5.230   7.939
  300    HA   ASN  39           HA       ASN  39 -14.510   7.843   8.305
  301    HB2  ASN  39           HB2      ASN  39 -12.204   7.640   8.942
  302    HB3  ASN  39           HB1      ASN  39 -11.809   6.952   7.384
  303   HD21  ASN  39          HD21      ASN  39 -10.500   8.324   6.683
  304   HD22  ASN  39          HD22      ASN  39 -10.657  10.013   6.440
  305    H    ARG  40           HN       ARG  40 -15.677   8.629   6.690
  306    HA   ARG  40           HA       ARG  40 -15.614   7.534   4.058
  307    HB2  ARG  40           HB2      ARG  40 -17.248   9.275   3.477
  308    HB3  ARG  40           HB1      ARG  40 -17.706   8.442   4.955
  309    HG2  ARG  40           HG2      ARG  40 -16.999  10.278   6.299
  310    HG3  ARG  40           HG1      ARG  40 -16.283  11.094   4.909
  311    HD2  ARG  40           HD2      ARG  40 -18.419  12.097   5.533
  312    HD3  ARG  40           HD1      ARG  40 -18.499  11.365   3.935
  313    HE   ARG  40           HE       ARG  40 -19.798   9.610   4.833
  314   HH11  ARG  40          HH11      ARG  40 -19.177  12.145   7.241
  315   HH12  ARG  40          HH12      ARG  40 -20.628  11.860   8.086
  316   HH21  ARG  40          HH21      ARG  40 -21.787   9.254   6.028
  317   HH22  ARG  40          HH22      ARG  40 -22.131  10.182   7.406
  318    H    ALA  41           HN       ALA  41 -13.883  10.111   5.640
  319    HA   ALA  41           HA       ALA  41 -13.612  11.660   3.309
  320    HB1  ALA  41           HB1      ALA  41 -11.968  12.015   5.835
  321    HB2  ALA  41           HB2      ALA  41 -13.532  12.726   5.503
  322    HB3  ALA  41           HB3      ALA  41 -12.154  13.143   4.501
  323    H    ALA  42           HN       ALA  42 -11.538   9.235   4.656
  324    HA   ALA  42           HA       ALA  42  -9.640   9.748   2.531
  325    HB1  ALA  42           HB1      ALA  42  -9.723   7.530   4.581
  326    HB2  ALA  42           HB2      ALA  42  -8.778   9.018   4.680
  327    HB3  ALA  42           HB3      ALA  42  -8.412   7.820   3.440
  328    H    ALA  43           HN       ALA  43 -12.430   7.891   3.104
  329    HA   ALA  43           HA       ALA  43 -11.945   5.758   1.311
  330    HB1  ALA  43           HB1      ALA  43 -14.292   5.244   1.561
  331    HB2  ALA  43           HB2      ALA  43 -14.588   6.854   2.224
  332    HB3  ALA  43           HB3      ALA  43 -13.611   5.707   3.134
  333    H    GLU  44           HN       GLU  44 -13.574   8.870   1.014
  334    HA   GLU  44           HA       GLU  44 -14.321   8.442  -1.671
  335    HB2  GLU  44           HB2      GLU  44 -13.994  11.078  -0.227
  336    HB3  GLU  44           HB1      GLU  44 -14.842  10.835  -1.749
  337    HG2  GLU  44           HG2      GLU  44 -15.625   9.863   0.983
  338    HG3  GLU  44           HG1      GLU  44 -16.506  10.953  -0.083
  339    H    PHE  45           HN       PHE  45 -11.416   9.450  -0.179
  340    HA   PHE  45           HA       PHE  45 -10.219  10.654  -2.442
  341    HB2  PHE  45           HB2      PHE  45  -9.327  11.016  -0.179
  342    HB3  PHE  45           HB1      PHE  45  -8.916   9.313  -0.056
  343    HD1  PHE  45           HD2      PHE  45  -8.241  12.310  -2.161
  344    HD2  PHE  45           HD1      PHE  45  -6.776   8.637  -0.601
  345    HE1  PHE  45           HE2      PHE  45  -6.029  12.798  -3.115
  346    HE2  PHE  45           HE1      PHE  45  -4.557   9.111  -1.556
  347    HZ   PHE  45           HZ       PHE  45  -4.181  11.199  -2.812
  348    H    VAL  46           HN       VAL  46 -10.538   7.354  -1.337
  349    HA   VAL  46           HA       VAL  46  -8.763   6.136  -3.186
  350    HB   VAL  46           HB       VAL  46 -11.317   4.916  -2.082
  351   HG11  VAL  46          HG11      VAL  46 -10.143   2.774  -2.362
  352   HG12  VAL  46          HG12      VAL  46  -8.774   3.637  -3.065
  353   HG13  VAL  46          HG13      VAL  46 -10.325   3.635  -3.897
  354   HG21  VAL  46          HG21      VAL  46  -8.561   4.924  -0.859
  355   HG22  VAL  46          HG22      VAL  46  -9.944   4.004  -0.270
  356   HG23  VAL  46          HG23      VAL  46  -9.981   5.767  -0.238
  357    H    GLY  47           HN       GLY  47 -12.147   7.026  -3.279
  358    HA2  GLY  47           HA2      GLY  47 -12.682   5.990  -5.884
  359    HA3  GLY  47           HA1      GLY  47 -13.688   7.114  -4.975
  360    H    SER  48           HN       SER  48 -11.191   8.807  -4.712
  361    HA   SER  48           HA       SER  48 -11.632  10.399  -7.034
  362    HB2  SER  48           HB2      SER  48 -11.315  11.404  -4.785
  363    HB3  SER  48           HB1      SER  48  -9.677  10.760  -4.738
  364    HG   SER  48           HG       SER  48 -10.616  12.512  -6.742
  365    H    VAL  49           HN       VAL  49  -8.965   8.423  -5.727
  366    HA   VAL  49           HA       VAL  49  -7.324   9.034  -8.017
  367    HB   VAL  49           HB       VAL  49  -5.604   7.551  -7.019
  368   HG11  VAL  49          HG11      VAL  49  -5.134   8.909  -5.038
  369   HG12  VAL  49          HG12      VAL  49  -6.771   9.557  -5.106
  370   HG13  VAL  49          HG13      VAL  49  -5.635   9.892  -6.415
  371   HG21  VAL  49          HG21      VAL  49  -7.052   5.909  -5.919
  372   HG22  VAL  49          HG22      VAL  49  -7.613   7.146  -4.794
  373   HG23  VAL  49          HG23      VAL  49  -5.931   6.627  -4.759
  374    H    ASN  50           HN       ASN  50  -9.359   6.371  -7.039
  375    HA   ASN  50           HA       ASN  50  -8.423   4.846  -9.360
  376    HB2  ASN  50           HB2      ASN  50  -9.969   3.961  -6.908
  377    HB3  ASN  50           HB1      ASN  50  -9.698   2.929  -8.307
  378   HD21  ASN  50          HD21      ASN  50  -8.802   2.657  -5.498
  379   HD22  ASN  50          HD22      ASN  50  -7.102   2.485  -5.581
  380    H    GLY  51           HN       GLY  51 -10.106   3.706 -10.625
  381    HA2  GLY  51           HA2      GLY  51 -12.562   5.293 -10.696
  382    HA3  GLY  51           HA1      GLY  51 -11.636   4.958 -12.160
  383    H    GLY  52           HN       GLY  52 -14.369   4.279 -11.555
  384    HA2  GLY  52           HA2      GLY  52 -15.656   2.477 -12.252
  385    HA3  GLY  52           HA1      GLY  52 -14.225   1.453 -12.183
  386    H    ASN  53           HN       ASN  53 -14.129   0.069 -10.596
  387    HA   ASN  53           HA       ASN  53 -15.864   0.377  -8.270
  388    HB2  ASN  53           HB2      ASN  53 -15.620  -1.849  -9.449
  389    HB3  ASN  53           HB1      ASN  53 -13.927  -1.856  -8.971
  390   HD21  ASN  53          HD21      ASN  53 -14.038  -3.642  -7.685
  391   HD22  ASN  53          HD22      ASN  53 -14.926  -3.714  -6.209
  392    H    ARG  54           HN       ARG  54 -14.933   0.552  -6.165
  393    HA   ARG  54           HA       ARG  54 -12.432   1.891  -6.165
  394    HB2  ARG  54           HB2      ARG  54 -14.245   1.068  -3.915
  395    HB3  ARG  54           HB1      ARG  54 -12.697   1.846  -3.622
  396    HG2  ARG  54           HG2      ARG  54 -13.420   3.733  -5.014
  397    HG3  ARG  54           HG1      ARG  54 -14.988   2.964  -5.212
  398    HD2  ARG  54           HD2      ARG  54 -15.331   3.096  -2.770
  399    HD3  ARG  54           HD1      ARG  54 -13.775   3.907  -2.595
  400    HE   ARG  54           HE       ARG  54 -15.278   5.188  -4.553
  401   HH11  ARG  54          HH11      ARG  54 -15.366   4.839  -1.015
  402   HH12  ARG  54          HH12      ARG  54 -16.025   6.409  -0.797
  403   HH21  ARG  54          HH21      ARG  54 -16.182   7.296  -4.171
  404   HH22  ARG  54          HH22      ARG  54 -16.515   7.794  -2.577
  405    H    THR  55           HN       THR  55 -10.862   0.684  -6.854
  406    HA   THR  55           HA       THR  55 -10.150  -1.877  -6.049
  407    HB   THR  55           HB       THR  55  -8.176   0.331  -6.646
  408    HG1  THR  55           HG1      THR  55 -10.155  -0.856  -8.288
  409   HG21  THR  55          HG21      THR  55  -7.368  -1.929  -6.185
  410   HG22  THR  55          HG22      THR  55  -7.072  -1.477  -7.873
  411   HG23  THR  55          HG23      THR  55  -8.398  -2.569  -7.469
  412    H    VAL  56           HN       VAL  56  -9.757  -2.419  -3.940
  413    HA   VAL  56           HA       VAL  56  -9.297  -0.320  -2.099
  414    HB   VAL  56           HB       VAL  56  -8.963  -3.183  -1.335
  415   HG11  VAL  56          HG11      VAL  56  -8.192  -1.433   0.185
  416   HG12  VAL  56          HG12      VAL  56  -9.566  -2.315   0.867
  417   HG13  VAL  56          HG13      VAL  56  -9.789  -0.710   0.161
  418   HG21  VAL  56          HG21      VAL  56 -11.111  -2.902  -2.446
  419   HG22  VAL  56          HG22      VAL  56 -11.432  -1.525  -1.364
  420   HG23  VAL  56          HG23      VAL  56 -11.256  -3.170  -0.694
  421    HA   PRO  57           HA       PRO  57  -5.438  -2.194  -1.200
  422    HB2  PRO  57           HB2      PRO  57  -3.836  -3.880  -2.661
  423    HB3  PRO  57           HB1      PRO  57  -5.076  -4.391  -1.512
  424    HG2  PRO  57           HG2      PRO  57  -5.278  -4.109  -4.478
  425    HG3  PRO  57           HG1      PRO  57  -5.928  -5.388  -3.436
  426    HD2  PRO  57           HD2      PRO  57  -7.411  -3.282  -4.387
  427    HD3  PRO  57           HD1      PRO  57  -7.724  -4.215  -2.875
  428    H    THR  58           HN       THR  58  -5.233  -0.052  -1.996
  429    HA   THR  58           HA       THR  58  -3.534   0.562  -4.256
  430    HB   THR  58           HB       THR  58  -5.449   2.222  -2.577
  431    HG1  THR  58           HG1      THR  58  -6.714   0.897  -3.746
  432   HG21  THR  58          HG21      THR  58  -5.294   3.856  -4.408
  433   HG22  THR  58          HG22      THR  58  -4.154   2.828  -5.249
  434   HG23  THR  58          HG23      THR  58  -3.685   3.598  -3.727
  435    H    VAL  59           HN       VAL  59  -1.528   1.226  -3.738
  436    HA   VAL  59           HA       VAL  59  -0.964   1.626  -0.903
  437    HB   VAL  59           HB       VAL  59   0.171  -0.365  -1.776
  438   HG11  VAL  59          HG11      VAL  59   0.290   0.124  -4.096
  439   HG12  VAL  59          HG12      VAL  59   1.932  -0.163  -3.485
  440   HG13  VAL  59          HG13      VAL  59   1.357   1.483  -3.777
  441   HG21  VAL  59          HG21      VAL  59   2.482   0.199  -1.194
  442   HG22  VAL  59          HG22      VAL  59   1.312   0.894  -0.071
  443   HG23  VAL  59          HG23      VAL  59   2.072   1.913  -1.291
  444    H    LYS  60           HN       LYS  60  -0.464   3.528  -0.303
  445    HA   LYS  60           HA       LYS  60   0.492   5.477  -2.258
  446    HB2  LYS  60           HB2      LYS  60  -1.597   6.046  -1.144
  447    HB3  LYS  60           HB1      LYS  60  -0.875   5.748   0.425
  448    HG2  LYS  60           HG2      LYS  60   0.494   7.702   0.189
  449    HG3  LYS  60           HG1      LYS  60  -0.075   7.934  -1.473
  450    HD2  LYS  60           HD2      LYS  60  -2.338   8.235  -0.697
  451    HD3  LYS  60           HD1      LYS  60  -1.848   7.910   0.962
  452    HE2  LYS  60           HE2      LYS  60  -0.792  10.138  -0.715
  453    HE3  LYS  60           HE1      LYS  60  -2.155  10.326   0.397
  454    HZ1  LYS  60           HZ1      LYS  60   0.640   9.573   1.125
  455    HZ2  LYS  60           HZ2      LYS  60  -0.631   9.616   2.190
  456    HZ3  LYS  60           HZ3      LYS  60  -0.109  11.040   1.458
  457    H    PHE  61           HN       PHE  61   2.640   5.613  -2.223
  458    HA   PHE  61           HA       PHE  61   4.110   4.789   0.106
  459    HB2  PHE  61           HB2      PHE  61   4.983   5.775  -2.603
  460    HB3  PHE  61           HB1      PHE  61   6.127   5.435  -1.310
  461    HD1  PHE  61           HD1      PHE  61   3.716   3.956  -3.673
  462    HD2  PHE  61           HD2      PHE  61   6.658   3.174  -0.676
  463    HE1  PHE  61           HE1      PHE  61   3.772   1.561  -4.332
  464    HE2  PHE  61           HE2      PHE  61   6.701   0.831  -1.320
  465    HZ   PHE  61           HZ       PHE  61   5.258   0.015  -3.155
  466    H    ALA  62           HN       ALA  62   5.799   6.111   1.031
  467    HA   ALA  62           HA       ALA  62   4.811   8.383   2.205
  468    HB1  ALA  62           HB1      ALA  62   6.581   7.002   3.150
  469    HB2  ALA  62           HB2      ALA  62   7.028   8.708   3.138
  470    HB3  ALA  62           HB3      ALA  62   7.704   7.612   1.934
  471    H    ASP  63           HN       ASP  63   6.443   8.163  -0.826
  472    HA   ASP  63           HA       ASP  63   7.275  10.917  -0.880
  473    HB2  ASP  63           HB2      ASP  63   8.196  10.474  -2.999
  474    HB3  ASP  63           HB1      ASP  63   8.447   8.998  -2.086
  475    H    GLY  64           HN       GLY  64   4.414   9.214  -1.558
  476    HA2  GLY  64           HA2      GLY  64   2.400  10.554  -1.767
  477    HA3  GLY  64           HA1      GLY  64   3.306  11.649  -2.795
  478    H    SER  65           HN       SER  65   4.389   8.823  -3.877
  479    HA   SER  65           HA       SER  65   2.563   8.838  -6.088
  480    HB2  SER  65           HB2      SER  65   5.059   8.463  -6.316
  481    HB3  SER  65           HB1      SER  65   4.827   6.931  -5.480
  482    HG   SER  65           HG       SER  65   3.707   7.707  -7.960
  483    H    THR  66           HN       THR  66   0.964   7.327  -6.489
  484    HA   THR  66           HA       THR  66   0.519   5.354  -4.349
  485    HB   THR  66           HB       THR  66  -1.674   6.496  -6.080
  486    HG1  THR  66           HG1      THR  66  -0.065   7.880  -4.642
  487   HG21  THR  66          HG21      THR  66  -1.565   5.548  -3.215
  488   HG22  THR  66          HG22      THR  66  -2.118   4.593  -4.590
  489   HG23  THR  66          HG23      THR  66  -3.014   6.037  -4.099
  490    H    LEU  67           HN       LEU  67   0.145   3.295  -5.033
  491    HA   LEU  67           HA       LEU  67   0.069   2.835  -7.926
  492    HB2  LEU  67           HB2      LEU  67   1.690   1.427  -5.842
  493    HB3  LEU  67           HB1      LEU  67   1.169   0.560  -7.264
  494    HG   LEU  67           HG       LEU  67   2.356   2.246  -8.646
  495   HD11  LEU  67          HD11      LEU  67   4.119   3.614  -7.655
  496   HD12  LEU  67          HD12      LEU  67   3.440   3.315  -6.052
  497   HD13  LEU  67          HD13      LEU  67   2.492   4.142  -7.275
  498   HD21  LEU  67          HD21      LEU  67   4.589   1.347  -8.194
  499   HD22  LEU  67          HD22      LEU  67   3.319   0.130  -8.257
  500   HD23  LEU  67          HD23      LEU  67   3.958   0.636  -6.696
  501    H    THR  68           HN       THR  68  -1.218   1.267  -8.685
  502    HA   THR  68           HA       THR  68  -3.338   0.442  -6.864
  503    HB   THR  68           HB       THR  68  -3.279   0.298  -9.887
  504    HG1  THR  68           HG1      THR  68  -3.063   2.413  -9.556
  505   HG21  THR  68          HG21      THR  68  -5.034  -0.999  -8.747
  506   HG22  THR  68          HG22      THR  68  -5.723   0.349  -9.651
  507   HG23  THR  68          HG23      THR  68  -5.554   0.456  -7.897
  508    H    ASN  69           HN       ASN  69  -3.133  -1.559  -6.071
  509    HA   ASN  69           HA       ASN  69  -2.210  -3.547  -5.683
  510    HB2  ASN  69           HB2      ASN  69  -3.319  -5.394  -6.885
  511    HB3  ASN  69           HB1      ASN  69  -4.420  -4.172  -6.291
  512   HD21  ASN  69          HD21      ASN  69  -4.760  -6.217  -8.320
  513   HD22  ASN  69          HD22      ASN  69  -5.158  -5.424  -9.803
  514    HA   PRO  70           HA       PRO  70   1.295  -4.341  -8.348
  515    HB2  PRO  70           HB2      PRO  70   3.235  -3.558  -6.744
  516    HB3  PRO  70           HB1      PRO  70   2.228  -2.325  -7.518
  517    HG2  PRO  70           HG2      PRO  70   2.063  -3.439  -4.751
  518    HG3  PRO  70           HG1      PRO  70   2.005  -1.731  -5.251
  519    HD2  PRO  70           HD2      PRO  70  -0.218  -3.298  -4.724
  520    HD3  PRO  70           HD1      PRO  70  -0.236  -1.864  -5.770
  521    H    SER  71           HN       SER  71   3.460  -5.516  -7.220
  522    HA   SER  71           HA       SER  71   2.392  -7.664  -5.527
  523    HB2  SER  71           HB2      SER  71   4.675  -7.786  -7.528
  524    HB3  SER  71           HB1      SER  71   4.045  -9.134  -6.575
  525    HG   SER  71           HG       SER  71   2.075  -8.883  -7.589
  526    H    ALA  72           HN       ALA  72   4.296  -8.729  -4.204
  527    HA   ALA  72           HA       ALA  72   5.226  -6.812  -2.409
  528    HB1  ALA  72           HB1      ALA  72   6.281  -9.612  -2.795
  529    HB2  ALA  72           HB2      ALA  72   4.873  -9.175  -1.825
  530    HB3  ALA  72           HB3      ALA  72   6.476  -8.611  -1.356
  531    H    ASP  73           HN       ASP  73   6.907  -8.424  -5.066
  532    HA   ASP  73           HA       ASP  73   9.442  -7.346  -4.479
  533    HB2  ASP  73           HB2      ASP  73   8.328  -8.499  -7.022
  534    HB3  ASP  73           HB1      ASP  73   9.951  -7.835  -6.960
  535    H    GLU  74           HN       GLU  74   6.782  -6.130  -6.309
  536    HA   GLU  74           HA       GLU  74   8.042  -3.936  -7.569
  537    HB2  GLU  74           HB2      GLU  74   5.198  -4.192  -6.577
  538    HB3  GLU  74           HB1      GLU  74   5.768  -2.963  -7.694
  539    HG2  GLU  74           HG2      GLU  74   5.659  -5.928  -8.202
  540    HG3  GLU  74           HG1      GLU  74   4.551  -4.718  -8.847
  541    H    VAL  75           HN       VAL  75   6.219  -4.264  -4.582
  542    HA   VAL  75           HA       VAL  75   6.467  -1.630  -3.678
  543    HB   VAL  75           HB       VAL  75   6.045  -4.170  -2.071
  544   HG11  VAL  75          HG11      VAL  75   6.797  -2.348  -0.632
  545   HG12  VAL  75          HG12      VAL  75   5.096  -2.716  -0.342
  546   HG13  VAL  75          HG13      VAL  75   5.544  -1.297  -1.290
  547   HG21  VAL  75          HG21      VAL  75   4.073  -2.172  -3.179
  548   HG22  VAL  75          HG22      VAL  75   3.674  -3.565  -2.172
  549   HG23  VAL  75          HG23      VAL  75   4.349  -3.804  -3.781
  550    H    LYS  76           HN       LYS  76   8.379  -4.490  -3.011
  551    HA   LYS  76           HA       LYS  76  10.159  -3.445  -1.144
  552    HB2  LYS  76           HB2      LYS  76   9.933  -5.788  -1.555
  553    HB3  LYS  76           HB1      LYS  76  10.476  -5.584  -3.217
  554    HG2  LYS  76           HG2      LYS  76  12.718  -4.993  -2.374
  555    HG3  LYS  76           HG1      LYS  76  12.148  -5.241  -0.720
  556    HD2  LYS  76           HD2      LYS  76  13.344  -7.220  -1.542
  557    HD3  LYS  76           HD1      LYS  76  11.646  -7.589  -1.241
  558    HE2  LYS  76           HE2      LYS  76  11.182  -7.308  -3.651
  559    HE3  LYS  76           HE1      LYS  76  12.888  -6.993  -3.934
  560    HZ1  LYS  76           HZ1      LYS  76  13.380  -9.258  -3.284
  561    HZ2  LYS  76           HZ2      LYS  76  12.101  -9.289  -4.413
  562    HZ3  LYS  76           HZ3      LYS  76  11.782  -9.494  -2.797
  563    H    ALA  77           HN       ALA  77  10.463  -3.517  -4.715
  564    HA   ALA  77           HA       ALA  77  13.050  -2.294  -4.682
  565    HB1  ALA  77           HB1      ALA  77  11.087  -2.629  -6.943
  566    HB2  ALA  77           HB2      ALA  77  12.388  -3.743  -6.510
  567    HB3  ALA  77           HB3      ALA  77  12.771  -2.134  -7.116
  568    H    LYS  78           HN       LYS  78   9.834  -1.090  -4.659
  569    HA   LYS  78           HA       LYS  78  10.583   1.629  -5.306
  570    HB2  LYS  78           HB2      LYS  78   8.104   0.421  -4.085
  571    HB3  LYS  78           HB1      LYS  78   8.294   2.136  -4.381
  572    HG2  LYS  78           HG2      LYS  78   8.446   0.043  -6.522
  573    HG3  LYS  78           HG1      LYS  78   6.968   0.888  -6.055
  574    HD2  LYS  78           HD2      LYS  78   8.142   3.040  -6.558
  575    HD3  LYS  78           HD1      LYS  78   9.493   2.097  -7.182
  576    HE2  LYS  78           HE2      LYS  78   6.666   1.976  -8.220
  577    HE3  LYS  78           HE1      LYS  78   7.973   2.886  -8.965
  578    HZ1  LYS  78           HZ1      LYS  78   9.152   0.826  -9.338
  579    HZ2  LYS  78           HZ2      LYS  78   7.626   0.737 -10.033
  580    HZ3  LYS  78           HZ3      LYS  78   7.941  -0.062  -8.597
  581    H    LEU  79           HN       LEU  79   9.912  -0.288  -2.463
  582    HA   LEU  79           HA       LEU  79   9.926   1.634  -0.516
  583    HB2  LEU  79           HB2      LEU  79   9.384  -0.840  -0.235
  584    HB3  LEU  79           HB1      LEU  79  11.094  -1.135  -0.291
  585    HG   LEU  79           HG       LEU  79  11.329   0.279   1.754
  586   HD11  LEU  79          HD11      LEU  79   8.334   0.093   1.774
  587   HD12  LEU  79          HD12      LEU  79   9.323   1.564   1.858
  588   HD13  LEU  79          HD13      LEU  79   9.308   0.424   3.187
  589   HD21  LEU  79          HD21      LEU  79  10.595  -1.521   3.265
  590   HD22  LEU  79          HD22      LEU  79  11.448  -2.137   1.851
  591   HD23  LEU  79          HD23      LEU  79   9.689  -2.242   1.936
  592    H    VAL  80           HN       VAL  80  12.600  -0.247  -1.827
  593    HA   VAL  80           HA       VAL  80  14.594   0.866  -0.228
  594    HB   VAL  80           HB       VAL  80  16.248  -0.022  -1.779
  595   HG11  VAL  80          HG11      VAL  80  15.596  -2.379  -1.825
  596   HG12  VAL  80          HG12      VAL  80  13.940  -1.918  -1.453
  597   HG13  VAL  80          HG13      VAL  80  15.225  -1.610  -0.280
  598   HG21  VAL  80          HG21      VAL  80  15.321   0.584  -3.903
  599   HG22  VAL  80          HG22      VAL  80  13.947  -0.480  -3.647
  600   HG23  VAL  80          HG23      VAL  80  15.561  -1.168  -3.873
  601    H    LYS  81           HN       LYS  81  13.244   2.063  -3.260
  602    HA   LYS  81           HA       LYS  81  15.274   4.078  -3.353
  603    HB2  LYS  81           HB2      LYS  81  14.174   4.967  -5.378
  604    HB3  LYS  81           HB1      LYS  81  14.532   3.249  -5.465
  605    HG2  LYS  81           HG2      LYS  81  12.322   2.644  -5.286
  606    HG3  LYS  81           HG1      LYS  81  11.819   4.247  -4.742
  607    HD2  LYS  81           HD2      LYS  81  11.227   3.819  -7.120
  608    HD3  LYS  81           HD1      LYS  81  12.320   5.188  -6.917
  609    HE2  LYS  81           HE2      LYS  81  14.209   3.692  -7.447
  610    HE3  LYS  81           HE1      LYS  81  13.051   2.398  -7.770
  611    HZ1  LYS  81           HZ1      LYS  81  12.148   3.703  -9.577
  612    HZ2  LYS  81           HZ2      LYS  81  13.809   3.573  -9.800
  613    HZ3  LYS  81           HZ3      LYS  81  13.156   4.991  -9.206
  614    H    ILE  82           HN       ILE  82  11.912   3.973  -2.323
  615    HA   ILE  82           HA       ILE  82  11.943   6.837  -2.096
  616    HB   ILE  82           HB       ILE  82   9.599   6.745  -1.354
  617   HG12  ILE  82          HG12      ILE  82   8.381   4.477  -1.753
  618   HG13  ILE  82          HG11      ILE  82   9.957   3.740  -1.551
  619   HG21  ILE  82          HG21      ILE  82  10.203   5.213  -3.862
  620   HG22  ILE  82          HG22      ILE  82  10.107   6.964  -3.675
  621   HG23  ILE  82          HG23      ILE  82   8.665   5.974  -3.467
  622   HD11  ILE  82          HD11      ILE  82   8.477   5.367   0.512
  623   HD12  ILE  82          HD12      ILE  82  10.075   4.647   0.723
  624   HD13  ILE  82          HD13      ILE  82   8.667   3.611   0.495
  625    H    ALA  83           HN       ALA  83  12.347   4.207   0.086
  626    HA   ALA  83           HA       ALA  83  12.266   6.059   2.318
  627    HB1  ALA  83           HB1      ALA  83  12.691   4.070   3.704
  628    HB2  ALA  83           HB2      ALA  83  12.843   3.097   2.238
  629    HB3  ALA  83           HB3      ALA  83  11.298   3.839   2.647
  630    H    GLY  84           HN       GLY  84  14.500   4.333   0.288
  631    HA2  GLY  84           HA2      GLY  84  16.652   5.139  -0.140
  632    HA3  GLY  84           HA1      GLY  84  16.662   5.907   1.446
  633    H    LEU  85           HN       LEU  85  18.459   5.005   2.221
  634    HA   LEU  85           HA       LEU  85  19.062   2.240   1.952
  635    HB2  LEU  85           HB2      LEU  85  20.275   4.421   3.636
  636    HB3  LEU  85           HB1      LEU  85  20.813   2.762   3.751
  637    HG   LEU  85           HG       LEU  85  22.339   4.044   2.389
  638   HD11  LEU  85          HD11      LEU  85  22.400   2.690   0.383
  639   HD12  LEU  85          HD12      LEU  85  20.759   2.134   0.700
  640   HD13  LEU  85          HD13      LEU  85  22.059   1.725   1.819
  641   HD21  LEU  85          HD21      LEU  85  21.682   5.006   0.225
  642   HD22  LEU  85          HD22      LEU  85  20.845   5.791   1.567
  643   HD23  LEU  85          HD23      LEU  85  19.997   4.610   0.569
  644    H    GLU  86           HN       GLU  86  17.400   4.146   4.315
  645    HA   GLU  86           HA       GLU  86  17.248   1.815   6.052
  646    HB2  GLU  86           HB2      GLU  86  16.227   4.602   6.560
  647    HB3  GLU  86           HB1      GLU  86  16.288   3.286   7.717
  648    HG2  GLU  86           HG2      GLU  86  18.749   3.286   7.535
  649    HG3  GLU  86           HG1      GLU  86  18.636   4.695   6.479
  650    H    HIS  87           HN       HIS  87  15.884   0.555   4.975
  651    HA   HIS  87           HA       HIS  87  13.148   1.537   4.823
  652    HB2  HIS  87           HB2      HIS  87  12.822  -0.305   3.024
  653    HB3  HIS  87           HB1      HIS  87  13.641   1.178   2.550
  654    HD1  HIS  87           HD1      HIS  87  16.164   0.968   1.908
  655    HD2  HIS  87           HD2      HIS  87  14.328  -2.605   2.992
  656    HE1  HIS  87           HE1      HIS  87  17.746  -0.858   1.234
  657    H    HIS  88           HN       HIS  88  15.137  -0.292   6.505
  658    HA   HIS  88           HA       HIS  88  12.908  -1.626   7.771
  659    HB2  HIS  88           HB2      HIS  88  15.587  -2.911   7.139
  660    HB3  HIS  88           HB1      HIS  88  14.522  -3.524   8.395
  661    HD1  HIS  88           HD1      HIS  88  12.182  -4.515   7.511
  662    HD2  HIS  88           HD2      HIS  88  15.048  -3.741   4.614
  663    HE1  HIS  88           HE1      HIS  88  11.463  -5.787   5.463
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1   2.589   0.626  18.161
    2    H2   MET   1           HT2      MET   1   3.770  -0.554  18.170
    3    H3   MET   1           HT3      MET   1   2.172  -0.968  18.504
    4    HA   MET   1           HA       MET   1   2.909  -1.612  16.287
    5    HB2  MET   1           HB2      MET   1   1.052  -0.554  14.982
    6    HB3  MET   1           HB1      MET   1   0.556  -1.249  16.513
    7    HG2  MET   1           HG2      MET   1   0.480   0.985  17.500
    8    HG3  MET   1           HG1      MET   1   1.007   1.678  15.968
    9    HE1  MET   1           HE1      MET   1  -1.784  -0.566  17.642
   10    HE2  MET   1           HE2      MET   1  -1.482  -1.413  16.121
   11    HE3  MET   1           HE3      MET   1  -3.011  -0.583  16.382
   12    H    VAL   2           HN       VAL   2   2.826  -0.465  13.949
   13    HA   VAL   2           HA       VAL   2   5.298   1.038  14.132
   14    HB   VAL   2           HB       VAL   2   5.624   0.422  11.750
   15   HG11  VAL   2          HG11      VAL   2   6.167  -1.912  12.202
   16   HG12  VAL   2          HG12      VAL   2   5.160  -1.873  13.649
   17   HG13  VAL   2          HG13      VAL   2   6.618  -0.882  13.558
   18   HG21  VAL   2          HG21      VAL   2   4.201  -1.366  10.797
   19   HG22  VAL   2          HG22      VAL   2   3.289   0.114  11.092
   20   HG23  VAL   2          HG23      VAL   2   3.141  -1.248  12.202
   21    H    THR   3           HN       THR   3   5.725   2.394  12.146
   22    HA   THR   3           HA       THR   3   3.487   3.875  11.070
   23    HB   THR   3           HB       THR   3   5.958   5.136  12.325
   24    HG1  THR   3           HG1      THR   3   3.507   4.529  13.363
   25   HG21  THR   3          HG21      THR   3   5.107   6.353  10.379
   26   HG22  THR   3          HG22      THR   3   4.824   7.269  11.860
   27   HG23  THR   3          HG23      THR   3   3.499   6.400  11.095
   28    H    ALA   4           HN       ALA   4   3.909   3.627   8.903
   29    HA   ALA   4           HA       ALA   4   6.749   3.620   8.115
   30    HB1  ALA   4           HB1      ALA   4   4.646   1.792   7.007
   31    HB2  ALA   4           HB2      ALA   4   5.906   1.334   8.155
   32    HB3  ALA   4           HB3      ALA   4   6.340   1.851   6.522
   33    H    ALA   5           HN       ALA   5   6.945   3.778   5.666
   34    HA   ALA   5           HA       ALA   5   5.609   6.172   4.810
   35    HB1  ALA   5           HB1      ALA   5   7.993   5.809   4.356
   36    HB2  ALA   5           HB2      ALA   5   7.088   6.036   2.860
   37    HB3  ALA   5           HB3      ALA   5   7.591   4.419   3.352
   38    H    LEU   6           HN       LEU   6   4.618   3.111   4.847
   39    HA   LEU   6           HA       LEU   6   3.302   3.124   2.241
   40    HB2  LEU   6           HB2      LEU   6   3.716   1.001   4.308
   41    HB3  LEU   6           HB1      LEU   6   2.446   0.848   3.121
   42    HG   LEU   6           HG       LEU   6   4.131   0.892   1.350
   43   HD11  LEU   6          HD11      LEU   6   5.892   2.149   2.525
   44   HD12  LEU   6          HD12      LEU   6   6.492   0.603   1.917
   45   HD13  LEU   6          HD13      LEU   6   6.116   0.788   3.627
   46   HD21  LEU   6          HD21      LEU   6   3.306  -1.189   2.188
   47   HD22  LEU   6          HD22      LEU   6   4.494  -1.172   3.488
   48   HD23  LEU   6          HD23      LEU   6   5.024  -1.338   1.817
   49    H    THR   7           HN       THR   7   1.585   4.396   2.386
   50    HA   THR   7           HA       THR   7  -0.243   3.929   4.625
   51    HB   THR   7           HB       THR   7  -0.433   6.003   2.418
   52    HG1  THR   7           HG1      THR   7   1.392   5.741   4.277
   53   HG21  THR   7          HG21      THR   7  -2.466   5.626   3.787
   54   HG22  THR   7          HG22      THR   7  -1.782   7.224   4.083
   55   HG23  THR   7          HG23      THR   7  -1.520   5.924   5.246
   56    H    ILE   8           HN       ILE   8  -1.551   2.242   4.126
   57    HA   ILE   8           HA       ILE   8  -2.088   1.791   1.296
   58    HB   ILE   8           HB       ILE   8  -2.117  -0.263   3.524
   59   HG12  ILE   8          HG12      ILE   8  -0.162   0.260   1.281
   60   HG13  ILE   8          HG11      ILE   8   0.149   0.409   3.008
   61   HG21  ILE   8          HG21      ILE   8  -3.737  -0.726   1.768
   62   HG22  ILE   8          HG22      ILE   8  -2.419  -1.908   1.734
   63   HG23  ILE   8          HG23      ILE   8  -2.476  -0.610   0.538
   64   HD11  ILE   8          HD11      ILE   8  -0.148  -2.024   3.234
   65   HD12  ILE   8          HD12      ILE   8   1.152  -1.605   2.113
   66   HD13  ILE   8          HD13      ILE   8  -0.411  -2.131   1.496
   67    H    TYR   9           HN       TYR   9  -3.989   1.851   0.572
   68    HA   TYR   9           HA       TYR   9  -6.205   2.240   2.376
   69    HB2  TYR   9           HB2      TYR   9  -5.769   2.640  -0.567
   70    HB3  TYR   9           HB1      TYR   9  -7.343   2.905   0.152
   71    HD1  TYR   9           HD1      TYR   9  -7.585   4.726   1.857
   72    HD2  TYR   9           HD2      TYR   9  -4.024   4.256  -0.414
   73    HE1  TYR   9           HE1      TYR   9  -6.908   7.004   2.463
   74    HE2  TYR   9           HE2      TYR   9  -3.332   6.540   0.196
   75    HH   TYR   9           HH       TYR   9  -4.484   8.668   0.927
   76    H    THR  10           HN       THR  10  -6.998   0.357   3.082
   77    HA   THR  10           HA       THR  10  -7.780  -1.623   1.097
   78    HB   THR  10           HB       THR  10  -7.187  -3.293   3.015
   79    HG1  THR  10           HG1      THR  10  -6.207  -2.335   4.642
   80   HG21  THR  10          HG21      THR  10  -6.137  -3.379   0.823
   81   HG22  THR  10          HG22      THR  10  -4.914  -3.602   2.088
   82   HG23  THR  10          HG23      THR  10  -5.074  -2.048   1.271
   83    H    THR  11           HN       THR  11  -9.754  -2.535   1.532
   84    HA   THR  11           HA       THR  11 -11.310  -1.492   3.698
   85    HB   THR  11           HB       THR  11 -12.090  -3.769   1.857
   86    HG1  THR  11           HG1      THR  11 -12.609  -2.264   0.308
   87   HG21  THR  11          HG21      THR  11 -13.642  -3.130   3.655
   88   HG22  THR  11          HG22      THR  11 -14.303  -2.758   2.063
   89   HG23  THR  11          HG23      THR  11 -13.642  -1.468   3.058
   90    H    SER  12           HN       SER  12 -12.221  -2.944   5.389
   91    HA   SER  12           HA       SER  12 -10.459  -4.831   6.409
   92    HB2  SER  12           HB2      SER  12 -12.570  -5.384   7.810
   93    HB3  SER  12           HB1      SER  12 -11.918  -3.744   7.921
   94    HG   SER  12           HG       SER  12 -13.922  -3.291   7.484
   95    H    TRP  13           HN       TRP  13 -13.584  -5.198   4.786
   96    HA   TRP  13           HA       TRP  13 -13.078  -7.993   4.402
   97    HB2  TRP  13           HB2      TRP  13 -15.315  -8.119   3.393
   98    HB3  TRP  13           HB1      TRP  13 -15.360  -7.316   4.955
   99    HD1  TRP  13           HD1      TRP  13 -15.960  -6.767   1.266
  100    HE1  TRP  13           HE1      TRP  13 -17.141  -4.599   0.890
  101    HE3  TRP  13           HE3      TRP  13 -15.729  -4.949   6.025
  102    HZ2  TRP  13           HZ2      TRP  13 -17.958  -2.320   2.428
  103    HZ3  TRP  13           HZ3      TRP  13 -16.755  -2.760   6.496
  104    HH2  TRP  13           HH2      TRP  13 -17.845  -1.477   4.735
  105    H    CYS  14           HN       CYS  14 -11.351  -8.229   3.141
  106    HA   CYS  14           HA       CYS  14 -11.832  -8.076   0.341
  107    HB2  CYS  14           HB2      CYS  14 -11.113  -5.749   0.759
  108    HB3  CYS  14           HB1      CYS  14  -9.635  -6.335   1.504
  109    H    GLY  15           HN       GLY  15 -11.066  -9.988  -0.309
  110    HA2  GLY  15           HA2      GLY  15  -9.084 -11.374   1.281
  111    HA3  GLY  15           HA1      GLY  15  -9.938 -12.016  -0.116
  112    H    TYR  16           HN       TYR  16  -9.337  -9.872  -1.849
  113    HA   TYR  16           HA       TYR  16  -6.885 -10.709  -2.932
  114    HB2  TYR  16           HB2      TYR  16  -8.738  -9.692  -4.244
  115    HB3  TYR  16           HB1      TYR  16  -8.432  -8.153  -3.463
  116    HD1  TYR  16           HD1      TYR  16  -6.915 -10.681  -5.707
  117    HD2  TYR  16           HD2      TYR  16  -6.854  -6.653  -4.373
  118    HE1  TYR  16           HE1      TYR  16  -5.356 -10.112  -7.518
  119    HE2  TYR  16           HE2      TYR  16  -5.287  -6.073  -6.179
  120    HH   TYR  16           HH       TYR  16  -4.683  -8.157  -8.771
  121    H    CYS  17           HN       CYS  17  -7.797  -7.953  -0.972
  122    HA   CYS  17           HA       CYS  17  -5.326  -6.625  -0.892
  123    HB2  CYS  17           HB2      CYS  17  -7.488  -6.681   1.209
  124    HB3  CYS  17           HB1      CYS  17  -6.257  -5.442   1.010
  125    H    LEU  18           HN       LEU  18  -6.802  -9.162   1.075
  126    HA   LEU  18           HA       LEU  18  -5.079  -9.167   3.267
  127    HB2  LEU  18           HB2      LEU  18  -7.349 -10.224   3.114
  128    HB3  LEU  18           HB1      LEU  18  -6.676 -11.448   2.074
  129    HG   LEU  18           HG       LEU  18  -7.147 -12.166   4.433
  130   HD11  LEU  18          HD11      LEU  18  -5.077 -13.403   4.793
  131   HD12  LEU  18          HD12      LEU  18  -4.278 -12.410   3.575
  132   HD13  LEU  18          HD13      LEU  18  -5.612 -13.465   3.113
  133   HD21  LEU  18          HD21      LEU  18  -4.833 -10.353   5.098
  134   HD22  LEU  18          HD22      LEU  18  -5.600 -11.492   6.206
  135   HD23  LEU  18          HD23      LEU  18  -6.514 -10.123   5.574
  136    H    ARG  19           HN       ARG  19  -4.942 -10.822   0.180
  137    HA   ARG  19           HA       ARG  19  -2.795 -12.551   0.610
  138    HB2  ARG  19           HB2      ARG  19  -3.555 -11.103  -1.928
  139    HB3  ARG  19           HB1      ARG  19  -2.398 -12.418  -1.853
  140    HG2  ARG  19           HG2      ARG  19  -4.178 -13.913  -1.056
  141    HG3  ARG  19           HG1      ARG  19  -5.332 -12.583  -1.181
  142    HD2  ARG  19           HD2      ARG  19  -5.452 -14.029  -3.153
  143    HD3  ARG  19           HD1      ARG  19  -4.881 -12.416  -3.585
  144    HE   ARG  19           HE       ARG  19  -2.712 -14.154  -3.045
  145   HH11  ARG  19          HH11      ARG  19  -5.095 -13.500  -5.567
  146   HH12  ARG  19          HH12      ARG  19  -4.100 -14.045  -6.836
  147   HH21  ARG  19          HH21      ARG  19  -1.359 -14.907  -4.783
  148   HH22  ARG  19          HH22      ARG  19  -1.932 -14.853  -6.385
  149    H    LEU  20           HN       LEU  20  -2.768  -9.134  -0.242
  150    HA   LEU  20           HA       LEU  20   0.053  -9.105  -0.588
  151    HB2  LEU  20           HB2      LEU  20  -1.243  -7.524  -1.861
  152    HB3  LEU  20           HB1      LEU  20  -1.985  -6.884  -0.412
  153    HG   LEU  20           HG       LEU  20   0.395  -6.107   0.213
  154   HD11  LEU  20          HD11      LEU  20   1.764  -5.469  -1.752
  155   HD12  LEU  20          HD12      LEU  20   0.861  -6.621  -2.719
  156   HD13  LEU  20          HD13      LEU  20   1.840  -7.162  -1.349
  157   HD21  LEU  20          HD21      LEU  20  -1.391  -4.581  -0.311
  158   HD22  LEU  20          HD22      LEU  20  -1.126  -4.816  -2.038
  159   HD23  LEU  20          HD23      LEU  20   0.107  -4.020  -1.054
  160    H    LYS  21           HN       LYS  21  -2.232  -8.041   1.860
  161    HA   LYS  21           HA       LYS  21  -0.553  -6.746   3.651
  162    HB2  LYS  21           HB2      LYS  21  -3.048  -8.359   4.169
  163    HB3  LYS  21           HB1      LYS  21  -2.245  -7.398   5.401
  164    HG2  LYS  21           HG2      LYS  21  -2.618  -5.371   4.095
  165    HG3  LYS  21           HG1      LYS  21  -3.350  -6.324   2.814
  166    HD2  LYS  21           HD2      LYS  21  -5.019  -5.190   4.258
  167    HD3  LYS  21           HD1      LYS  21  -5.195  -6.941   4.241
  168    HE2  LYS  21           HE2      LYS  21  -4.128  -7.117   6.401
  169    HE3  LYS  21           HE1      LYS  21  -3.743  -5.398   6.394
  170    HZ1  LYS  21           HZ1      LYS  21  -5.974  -4.836   6.656
  171    HZ2  LYS  21           HZ2      LYS  21  -5.724  -6.110   7.736
  172    HZ3  LYS  21           HZ3      LYS  21  -6.535  -6.389   6.289
  173    H    THR  22           HN       THR  22  -1.415 -10.174   3.615
  174    HA   THR  22           HA       THR  22   0.181 -10.831   5.838
  175    HB   THR  22           HB       THR  22  -0.034 -13.222   4.869
  176    HG1  THR  22           HG1      THR  22  -1.979 -11.918   3.223
  177   HG21  THR  22          HG21      THR  22  -2.505 -11.604   5.523
  178   HG22  THR  22          HG22      THR  22  -1.434 -12.368   6.695
  179   HG23  THR  22          HG23      THR  22  -2.390 -13.360   5.594
  180    H    ALA  23           HN       ALA  23   0.886 -10.661   2.422
  181    HA   ALA  23           HA       ALA  23   3.437 -11.930   2.444
  182    HB1  ALA  23           HB1      ALA  23   2.375  -9.778   0.619
  183    HB2  ALA  23           HB2      ALA  23   2.131 -11.508   0.382
  184    HB3  ALA  23           HB3      ALA  23   3.759 -10.823   0.290
  185    H    LEU  24           HN       LEU  24   2.401  -8.604   2.852
  186    HA   LEU  24           HA       LEU  24   4.988  -7.510   2.992
  187    HB2  LEU  24           HB2      LEU  24   2.414  -6.503   4.173
  188    HB3  LEU  24           HB1      LEU  24   3.875  -5.540   4.028
  189    HG   LEU  24           HG       LEU  24   2.146  -6.600   1.792
  190   HD11  LEU  24          HD11      LEU  24   1.217  -4.679   2.915
  191   HD12  LEU  24          HD12      LEU  24   1.781  -4.243   1.299
  192   HD13  LEU  24          HD13      LEU  24   2.735  -3.805   2.711
  193   HD21  LEU  24          HD21      LEU  24   4.730  -5.050   1.623
  194   HD22  LEU  24          HD22      LEU  24   3.640  -5.374   0.275
  195   HD23  LEU  24          HD23      LEU  24   4.463  -6.708   1.080
  196    H    THR  25           HN       THR  25   2.726  -8.480   5.576
  197    HA   THR  25           HA       THR  25   4.294  -7.959   7.781
  198    HB   THR  25           HB       THR  25   2.387 -10.279   7.337
  199    HG1  THR  25           HG1      THR  25   1.973  -7.660   8.371
  200   HG21  THR  25          HG21      THR  25   3.762 -10.617   9.354
  201   HG22  THR  25          HG22      THR  25   2.089 -10.268   9.788
  202   HG23  THR  25          HG23      THR  25   3.318  -9.010   9.929
  203    H    ALA  26           HN       ALA  26   4.313 -10.828   5.668
  204    HA   ALA  26           HA       ALA  26   6.194 -12.237   7.271
  205    HB1  ALA  26           HB1      ALA  26   6.127 -13.934   5.553
  206    HB2  ALA  26           HB2      ALA  26   5.299 -12.822   4.462
  207    HB3  ALA  26           HB3      ALA  26   4.496 -13.382   5.926
  208    H    ASN  27           HN       ASN  27   6.553  -9.797   5.024
  209    HA   ASN  27           HA       ASN  27   9.306 -10.614   4.463
  210    HB2  ASN  27           HB2      ASN  27   7.318  -9.067   2.898
  211    HB3  ASN  27           HB1      ASN  27   9.039  -8.719   2.619
  212   HD21  ASN  27          HD21      ASN  27   6.425 -10.927   2.218
  213   HD22  ASN  27          HD22      ASN  27   7.239 -12.072   1.218
  214    H    ARG  28           HN       ARG  28   7.999  -9.082   6.759
  215    HA   ARG  28           HA       ARG  28   8.580  -7.543   8.295
  216    HB2  ARG  28           HB2      ARG  28  11.161  -7.217   6.747
  217    HB3  ARG  28           HB1      ARG  28  10.841  -6.521   8.316
  218    HG2  ARG  28           HG2      ARG  28  10.533  -8.943   9.109
  219    HG3  ARG  28           HG1      ARG  28  11.300  -9.383   7.581
  220    HD2  ARG  28           HD2      ARG  28  12.460  -7.611   9.733
  221    HD3  ARG  28           HD1      ARG  28  12.983  -9.240   9.322
  222    HE   ARG  28           HE       ARG  28  13.467  -8.132   7.041
  223   HH11  ARG  28          HH11      ARG  28  13.941  -6.559  10.215
  224   HH12  ARG  28          HH12      ARG  28  15.234  -5.597   9.715
  225   HH21  ARG  28          HH21      ARG  28  15.286  -6.764   6.350
  226   HH22  ARG  28          HH22      ARG  28  16.028  -5.720   7.460
  227    H    ILE  29           HN       ILE  29   7.356  -6.755   5.642
  228    HA   ILE  29           HA       ILE  29   8.254  -4.017   5.443
  229    HB   ILE  29           HB       ILE  29   6.071  -5.456   3.888
  230   HG12  ILE  29          HG12      ILE  29   8.927  -4.802   3.091
  231   HG13  ILE  29          HG11      ILE  29   8.337  -6.398   3.513
  232   HG21  ILE  29          HG21      ILE  29   5.767  -3.028   3.963
  233   HG22  ILE  29          HG22      ILE  29   6.247  -3.541   2.341
  234   HG23  ILE  29          HG23      ILE  29   7.423  -2.792   3.419
  235   HD11  ILE  29          HD11      ILE  29   8.539  -6.143   1.111
  236   HD12  ILE  29          HD12      ILE  29   7.463  -4.747   1.150
  237   HD13  ILE  29          HD13      ILE  29   6.847  -6.347   1.566
  238    H    ALA  30           HN       ALA  30   7.428  -2.550   6.692
  239    HA   ALA  30           HA       ALA  30   5.058  -3.072   8.244
  240    HB1  ALA  30           HB1      ALA  30   5.651  -0.941   9.350
  241    HB2  ALA  30           HB2      ALA  30   6.969  -0.740   8.190
  242    HB3  ALA  30           HB3      ALA  30   6.994  -2.086   9.331
  243    H    TYR  31           HN       TYR  31   3.149  -1.851   8.099
  244    HA   TYR  31           HA       TYR  31   2.963   0.226   6.107
  245    HB2  TYR  31           HB2      TYR  31   1.168  -0.836   4.855
  246    HB3  TYR  31           HB1      TYR  31   2.653  -1.770   4.735
  247    HD1  TYR  31           HD2      TYR  31   2.823  -3.959   5.949
  248    HD2  TYR  31           HD1      TYR  31  -0.822  -1.761   5.805
  249    HE1  TYR  31           HE2      TYR  31   1.584  -5.970   6.638
  250    HE2  TYR  31           HE1      TYR  31  -2.063  -3.763   6.489
  251    HH   TYR  31           HH       TYR  31  -0.524  -6.521   7.714
  252    H    ASP  32           HN       ASP  32   1.120   1.492   6.312
  253    HA   ASP  32           HA       ASP  32  -0.496   0.966   8.705
  254    HB2  ASP  32           HB2      ASP  32   0.305   3.573   7.382
  255    HB3  ASP  32           HB1      ASP  32  -0.969   3.467   8.582
  256    H    GLU  33           HN       GLU  33  -2.445   0.204   8.104
  257    HA   GLU  33           HA       GLU  33  -3.429   1.006   5.501
  258    HB2  GLU  33           HB2      GLU  33  -5.059  -0.810   5.664
  259    HB3  GLU  33           HB1      GLU  33  -3.467  -1.393   6.051
  260    HG2  GLU  33           HG2      GLU  33  -4.021  -1.229   8.463
  261    HG3  GLU  33           HG1      GLU  33  -5.672  -0.816   7.998
  262    H    VAL  34           HN       VAL  34  -5.427   1.916   5.190
  263    HA   VAL  34           HA       VAL  34  -5.918   3.897   7.247
  264    HB   VAL  34           HB       VAL  34  -6.845   3.877   4.365
  265   HG11  VAL  34          HG11      VAL  34  -7.193   6.270   4.624
  266   HG12  VAL  34          HG12      VAL  34  -6.855   6.124   6.353
  267   HG13  VAL  34          HG13      VAL  34  -8.251   5.295   5.643
  268   HG21  VAL  34          HG21      VAL  34  -4.491   5.251   5.644
  269   HG22  VAL  34          HG22      VAL  34  -5.016   5.455   3.971
  270   HG23  VAL  34          HG23      VAL  34  -4.423   3.891   4.526
  271    H    ASP  35           HN       ASP  35  -7.852   4.615   7.895
  272    HA   ASP  35           HA       ASP  35  -9.775   3.045   9.038
  273    HB2  ASP  35           HB2      ASP  35 -10.101   5.900   8.154
  274    HB3  ASP  35           HB1      ASP  35 -10.942   5.089   9.462
  275    H    ILE  36           HN       ILE  36  -9.682   3.478   5.726
  276    HA   ILE  36           HA       ILE  36 -12.043   4.677   4.884
  277    HB   ILE  36           HB       ILE  36 -11.804   3.583   2.727
  278   HG12  ILE  36          HG12      ILE  36  -9.456   2.136   3.876
  279   HG13  ILE  36          HG11      ILE  36 -11.047   1.373   3.798
  280   HG21  ILE  36          HG21      ILE  36 -10.431   5.532   3.305
  281   HG22  ILE  36          HG22      ILE  36  -9.601   4.432   2.205
  282   HG23  ILE  36          HG23      ILE  36  -9.172   4.454   3.918
  283   HD11  ILE  36          HD11      ILE  36 -11.056   1.618   1.391
  284   HD12  ILE  36          HD12      ILE  36  -9.588   0.767   1.899
  285   HD13  ILE  36          HD13      ILE  36  -9.537   2.489   1.475
  286    H    GLU  37           HN       GLU  37 -11.854   1.477   6.148
  287    HA   GLU  37           HA       GLU  37 -14.177   0.635   4.761
  288    HB2  GLU  37           HB2      GLU  37 -14.068  -1.405   6.144
  289    HB3  GLU  37           HB1      GLU  37 -12.549  -0.999   5.361
  290    HG2  GLU  37           HG2      GLU  37 -11.859  -1.686   7.431
  291    HG3  GLU  37           HG1      GLU  37 -11.954   0.060   7.641
  292    H    HIS  38           HN       HIS  38 -13.716   2.556   7.414
  293    HA   HIS  38           HA       HIS  38 -16.612   2.651   7.678
  294    HB2  HIS  38           HB2      HIS  38 -16.431   3.298  10.079
  295    HB3  HIS  38           HB1      HIS  38 -15.843   1.675   9.777
  296    HD1  HIS  38           HD1      HIS  38 -13.335   1.243  10.230
  297    HD2  HIS  38           HD2      HIS  38 -14.550   5.152  10.920
  298    HE1  HIS  38           HE1      HIS  38 -11.469   2.341  11.527
  299    H    ASN  39           HN       ASN  39 -13.589   4.420   7.613
  300    HA   ASN  39           HA       ASN  39 -14.844   7.016   7.841
  301    HB2  ASN  39           HB2      ASN  39 -12.519   6.713   8.577
  302    HB3  ASN  39           HB1      ASN  39 -12.057   6.303   6.928
  303   HD21  ASN  39          HD21      ASN  39 -10.813   7.959   6.338
  304   HD22  ASN  39          HD22      ASN  39 -11.163   9.620   6.467
  305    H    ARG  40           HN       ARG  40 -16.109   7.586   6.273
  306    HA   ARG  40           HA       ARG  40 -15.833   6.752   3.591
  307    HB2  ARG  40           HB2      ARG  40 -17.701   8.231   3.114
  308    HB3  ARG  40           HB1      ARG  40 -17.992   7.293   4.569
  309    HG2  ARG  40           HG2      ARG  40 -17.305   9.257   5.908
  310    HG3  ARG  40           HG1      ARG  40 -17.209  10.187   4.415
  311    HD2  ARG  40           HD2      ARG  40 -19.644   8.805   5.508
  312    HD3  ARG  40           HD1      ARG  40 -19.342  10.541   5.512
  313    HE   ARG  40           HE       ARG  40 -19.235  10.071   2.932
  314   HH11  ARG  40          HH11      ARG  40 -21.560   8.825   5.327
  315   HH12  ARG  40          HH12      ARG  40 -22.830   8.675   4.207
  316   HH21  ARG  40          HH21      ARG  40 -21.013   9.859   1.414
  317   HH22  ARG  40          HH22      ARG  40 -22.527   9.280   1.971
  318    H    ALA  41           HN       ALA  41 -14.450   9.440   5.320
  319    HA   ALA  41           HA       ALA  41 -14.203  11.073   3.023
  320    HB1  ALA  41           HB1      ALA  41 -12.735  11.391   5.638
  321    HB2  ALA  41           HB2      ALA  41 -14.285  12.101   5.224
  322    HB3  ALA  41           HB3      ALA  41 -12.838  12.582   4.347
  323    H    ALA  42           HN       ALA  42 -11.944   8.916   4.572
  324    HA   ALA  42           HA       ALA  42  -9.952   9.510   2.576
  325    HB1  ALA  42           HB1      ALA  42  -9.243   8.798   4.807
  326    HB2  ALA  42           HB2      ALA  42  -8.662   7.672   3.579
  327    HB3  ALA  42           HB3      ALA  42 -10.051   7.250   4.579
  328    H    ALA  43           HN       ALA  43 -12.613   7.375   2.950
  329    HA   ALA  43           HA       ALA  43 -11.899   5.461   0.989
  330    HB1  ALA  43           HB1      ALA  43 -13.630   5.087   2.694
  331    HB2  ALA  43           HB2      ALA  43 -14.248   4.809   1.059
  332    HB3  ALA  43           HB3      ALA  43 -14.641   6.304   1.919
  333    H    GLU  44           HN       GLU  44 -13.576   8.525   0.977
  334    HA   GLU  44           HA       GLU  44 -14.402   8.667  -1.669
  335    HB2  GLU  44           HB2      GLU  44 -15.029  10.233   0.163
  336    HB3  GLU  44           HB1      GLU  44 -13.408  10.897   0.121
  337    HG2  GLU  44           HG2      GLU  44 -14.973  12.349  -1.022
  338    HG3  GLU  44           HG1      GLU  44 -13.799  11.685  -2.162
  339    H    PHE  45           HN       PHE  45 -11.334   9.418  -0.119
  340    HA   PHE  45           HA       PHE  45 -10.032  10.465  -2.397
  341    HB2  PHE  45           HB2      PHE  45  -9.160  10.917  -0.149
  342    HB3  PHE  45           HB1      PHE  45  -8.816   9.207   0.083
  343    HD1  PHE  45           HD1      PHE  45  -7.997  12.017  -2.232
  344    HD2  PHE  45           HD2      PHE  45  -6.680   8.433  -0.349
  345    HE1  PHE  45           HE1      PHE  45  -5.756  12.337  -3.192
  346    HE2  PHE  45           HE2      PHE  45  -4.439   8.749  -1.304
  347    HZ   PHE  45           HZ       PHE  45  -3.975  10.699  -2.730
  348    H    VAL  46           HN       VAL  46 -10.509   7.235  -1.226
  349    HA   VAL  46           HA       VAL  46  -8.633   5.961  -2.883
  350    HB   VAL  46           HB       VAL  46 -11.261   4.837  -1.821
  351   HG11  VAL  46          HG11      VAL  46  -8.864   3.377  -2.928
  352   HG12  VAL  46          HG12      VAL  46 -10.438   3.501  -3.704
  353   HG13  VAL  46          HG13      VAL  46 -10.267   2.619  -2.178
  354   HG21  VAL  46          HG21      VAL  46  -9.892   3.832  -0.087
  355   HG22  VAL  46          HG22      VAL  46  -9.713   5.594  -0.083
  356   HG23  VAL  46          HG23      VAL  46  -8.455   4.581  -0.775
  357    H    GLY  47           HN       GLY  47 -11.955   6.995  -3.349
  358    HA2  GLY  47           HA2      GLY  47 -12.201   5.897  -5.982
  359    HA3  GLY  47           HA1      GLY  47 -13.316   7.020  -5.214
  360    H    SER  48           HN       SER  48 -10.861   8.735  -4.633
  361    HA   SER  48           HA       SER  48 -11.014  10.349  -6.982
  362    HB2  SER  48           HB2      SER  48  -9.103  10.601  -4.651
  363    HB3  SER  48           HB1      SER  48  -9.558  11.863  -5.795
  364    HG   SER  48           HG       SER  48 -11.747  10.769  -4.655
  365    H    VAL  49           HN       VAL  49  -8.770   7.979  -5.670
  366    HA   VAL  49           HA       VAL  49  -6.893   8.560  -7.828
  367    HB   VAL  49           HB       VAL  49  -5.277   7.090  -6.688
  368   HG11  VAL  49          HG11      VAL  49  -6.466   9.204  -4.912
  369   HG12  VAL  49          HG12      VAL  49  -5.273   9.454  -6.181
  370   HG13  VAL  49          HG13      VAL  49  -4.852   8.519  -4.743
  371   HG21  VAL  49          HG21      VAL  49  -5.731   6.255  -4.416
  372   HG22  VAL  49          HG22      VAL  49  -6.819   5.536  -5.602
  373   HG23  VAL  49          HG23      VAL  49  -7.395   6.827  -4.549
  374    H    ASN  50           HN       ASN  50  -9.385   6.434  -7.187
  375    HA   ASN  50           HA       ASN  50  -8.489   4.774  -9.425
  376    HB2  ASN  50           HB2      ASN  50 -10.126   3.844  -7.044
  377    HB3  ASN  50           HB1      ASN  50  -9.904   2.912  -8.512
  378   HD21  ASN  50          HD21      ASN  50  -8.596   3.826  -5.526
  379   HD22  ASN  50          HD22      ASN  50  -7.173   2.838  -5.603
  380    H    GLY  51           HN       GLY  51  -9.585   5.485 -11.041
  381    HA2  GLY  51           HA2      GLY  51 -12.008   6.931 -10.753
  382    HA3  GLY  51           HA1      GLY  51 -11.238   6.469 -12.259
  383    H    GLY  52           HN       GLY  52 -14.012   6.370 -10.945
  384    HA2  GLY  52           HA2      GLY  52 -15.887   5.243 -11.702
  385    HA3  GLY  52           HA1      GLY  52 -14.841   4.047 -12.443
  386    H    ASN  53           HN       ASN  53 -13.502   2.913 -10.550
  387    HA   ASN  53           HA       ASN  53 -15.513   1.942  -8.623
  388    HB2  ASN  53           HB2      ASN  53 -15.246   0.381 -10.509
  389    HB3  ASN  53           HB1      ASN  53 -13.522   0.293 -10.178
  390   HD21  ASN  53          HD21      ASN  53 -16.659  -0.621  -9.178
  391   HD22  ASN  53          HD22      ASN  53 -16.207  -1.820  -8.022
  392    H    ARG  54           HN       ARG  54 -14.795   1.802  -6.572
  393    HA   ARG  54           HA       ARG  54 -12.171   2.666  -5.944
  394    HB2  ARG  54           HB2      ARG  54 -14.450   1.648  -4.285
  395    HB3  ARG  54           HB1      ARG  54 -12.868   1.844  -3.567
  396    HG2  ARG  54           HG2      ARG  54 -12.903   4.225  -4.197
  397    HG3  ARG  54           HG1      ARG  54 -14.517   4.010  -4.870
  398    HD2  ARG  54           HD2      ARG  54 -13.800   3.389  -2.013
  399    HD3  ARG  54           HD1      ARG  54 -14.416   4.952  -2.537
  400    HE   ARG  54           HE       ARG  54 -16.356   3.602  -3.407
  401   HH11  ARG  54          HH11      ARG  54 -14.537   2.444  -0.568
  402   HH12  ARG  54          HH12      ARG  54 -15.896   1.945   0.278
  403   HH21  ARG  54          HH21      ARG  54 -18.257   2.810  -2.235
  404   HH22  ARG  54          HH22      ARG  54 -18.054   2.105  -0.703
  405    H    THR  55           HN       THR  55 -10.677   1.399  -6.735
  406    HA   THR  55           HA       THR  55 -10.676  -1.444  -6.440
  407    HB   THR  55           HB       THR  55  -8.346   0.380  -7.093
  408    HG1  THR  55           HG1      THR  55 -10.656   0.147  -8.361
  409   HG21  THR  55          HG21      THR  55  -9.021  -2.482  -7.847
  410   HG22  THR  55          HG22      THR  55  -7.807  -1.987  -6.669
  411   HG23  THR  55          HG23      THR  55  -7.590  -1.598  -8.377
  412    H    VAL  56           HN       VAL  56  -9.846  -2.540  -4.702
  413    HA   VAL  56           HA       VAL  56  -8.825  -0.817  -3.132
  414    HB   VAL  56           HB       VAL  56  -8.955  -2.155  -0.927
  415   HG11  VAL  56          HG11      VAL  56  -9.407   0.056  -1.296
  416   HG12  VAL  56          HG12      VAL  56 -10.825  -0.661  -0.511
  417   HG13  VAL  56          HG13      VAL  56 -10.862  -0.262  -2.250
  418   HG21  VAL  56          HG21      VAL  56 -11.258  -2.985  -2.660
  419   HG22  VAL  56          HG22      VAL  56 -11.281  -2.924  -0.883
  420   HG23  VAL  56          HG23      VAL  56 -10.113  -3.961  -1.700
  421    HA   PRO  57           HA       PRO  57  -5.564  -2.120  -1.299
  422    HB2  PRO  57           HB2      PRO  57  -3.489  -3.583  -2.427
  423    HB3  PRO  57           HB1      PRO  57  -4.777  -4.255  -1.416
  424    HG2  PRO  57           HG2      PRO  57  -4.610  -4.070  -4.394
  425    HG3  PRO  57           HG1      PRO  57  -5.136  -5.447  -3.397
  426    HD2  PRO  57           HD2      PRO  57  -6.890  -3.766  -4.610
  427    HD3  PRO  57           HD1      PRO  57  -7.173  -4.604  -3.053
  428    H    THR  58           HN       THR  58  -5.096   0.046  -1.792
  429    HA   THR  58           HA       THR  58  -3.371   0.717  -4.056
  430    HB   THR  58           HB       THR  58  -5.359   2.563  -2.702
  431    HG1  THR  58           HG1      THR  58  -6.545   0.803  -3.600
  432   HG21  THR  58          HG21      THR  58  -3.627   3.603  -4.134
  433   HG22  THR  58          HG22      THR  58  -5.261   3.733  -4.833
  434   HG23  THR  58          HG23      THR  58  -4.146   2.536  -5.453
  435    H    VAL  59           HN       VAL  59  -1.427   1.161  -3.298
  436    HA   VAL  59           HA       VAL  59  -1.172   2.109  -0.548
  437    HB   VAL  59           HB       VAL  59  -0.027  -0.002  -0.854
  438   HG11  VAL  59          HG11      VAL  59   1.298   1.295  -3.171
  439   HG12  VAL  59          HG12      VAL  59   0.147  -0.038  -3.205
  440   HG13  VAL  59          HG13      VAL  59   1.761  -0.279  -2.501
  441   HG21  VAL  59          HG21      VAL  59   2.279   0.565  -0.280
  442   HG22  VAL  59          HG22      VAL  59   1.169   1.663   0.548
  443   HG23  VAL  59          HG23      VAL  59   2.040   2.202  -0.882
  444    H    LYS  60           HN       LYS  60  -0.268   3.928  -0.077
  445    HA   LYS  60           HA       LYS  60   0.755   5.630  -2.224
  446    HB2  LYS  60           HB2      LYS  60  -1.257   6.462  -1.069
  447    HB3  LYS  60           HB1      LYS  60  -0.460   6.256   0.472
  448    HG2  LYS  60           HG2      LYS  60   1.060   8.048  -0.045
  449    HG3  LYS  60           HG1      LYS  60   0.384   8.180  -1.673
  450    HD2  LYS  60           HD2      LYS  60  -1.806   8.720  -0.730
  451    HD3  LYS  60           HD1      LYS  60  -1.145   8.586   0.894
  452    HE2  LYS  60           HE2      LYS  60  -0.175  10.508  -1.190
  453    HE3  LYS  60           HE1      LYS  60  -1.376  10.914   0.036
  454    HZ1  LYS  60           HZ1      LYS  60   0.291  10.439   1.749
  455    HZ2  LYS  60           HZ2      LYS  60   0.825  11.637   0.679
  456    HZ3  LYS  60           HZ3      LYS  60   1.450  10.100   0.565
  457    H    PHE  61           HN       PHE  61   2.881   5.744  -2.211
  458    HA   PHE  61           HA       PHE  61   4.415   5.206   0.244
  459    HB2  PHE  61           HB2      PHE  61   5.290   5.351  -2.673
  460    HB3  PHE  61           HB1      PHE  61   6.401   5.098  -1.324
  461    HD1  PHE  61           HD2      PHE  61   3.850   3.739  -3.519
  462    HD2  PHE  61           HD1      PHE  61   6.505   2.835  -0.269
  463    HE1  PHE  61           HE2      PHE  61   3.528   1.342  -3.900
  464    HE2  PHE  61           HE1      PHE  61   6.118   0.438  -0.673
  465    HZ   PHE  61           HZ       PHE  61   4.648  -0.294  -2.472
  466    H    ALA  62           HN       ALA  62   6.541   6.579   0.227
  467    HA   ALA  62           HA       ALA  62   6.012   9.358   0.415
  468    HB1  ALA  62           HB1      ALA  62   8.692   7.970   0.190
  469    HB2  ALA  62           HB2      ALA  62   7.803   8.228   1.693
  470    HB3  ALA  62           HB3      ALA  62   8.423   9.608   0.787
  471    H    ASP  63           HN       ASP  63   6.501   7.425  -2.140
  472    HA   ASP  63           HA       ASP  63   7.805   8.893  -4.156
  473    HB2  ASP  63           HB2      ASP  63   7.353   6.518  -4.341
  474    HB3  ASP  63           HB1      ASP  63   5.636   6.795  -4.146
  475    H    GLY  64           HN       GLY  64   4.676   9.218  -2.665
  476    HA2  GLY  64           HA2      GLY  64   3.315  11.084  -2.749
  477    HA3  GLY  64           HA1      GLY  64   4.150  11.619  -4.197
  478    H    SER  65           HN       SER  65   3.709   8.865  -5.358
  479    HA   SER  65           HA       SER  65   0.981   9.380  -6.216
  480    HB2  SER  65           HB2      SER  65   2.785   9.278  -7.955
  481    HB3  SER  65           HB1      SER  65   3.112   7.618  -7.472
  482    HG   SER  65           HG       SER  65   1.612   8.213  -9.332
  483    H    THR  66           HN       THR  66  -0.128   7.234  -6.816
  484    HA   THR  66           HA       THR  66   0.137   5.458  -4.512
  485    HB   THR  66           HB       THR  66  -2.334   4.985  -4.996
  486    HG1  THR  66           HG1      THR  66  -3.073   5.951  -6.710
  487   HG21  THR  66          HG21      THR  66  -1.616   6.310  -3.067
  488   HG22  THR  66          HG22      THR  66  -3.105   6.970  -3.747
  489   HG23  THR  66          HG23      THR  66  -1.557   7.758  -4.069
  490    H    LEU  67           HN       LEU  67   0.139   3.321  -4.899
  491    HA   LEU  67           HA       LEU  67   0.124   2.539  -7.704
  492    HB2  LEU  67           HB2      LEU  67   2.321   2.355  -6.571
  493    HB3  LEU  67           HB1      LEU  67   1.602   1.296  -5.385
  494    HG   LEU  67           HG       LEU  67   1.226  -0.408  -7.131
  495   HD11  LEU  67          HD11      LEU  67   0.976   0.961  -9.107
  496   HD12  LEU  67          HD12      LEU  67   2.376  -0.088  -9.319
  497   HD13  LEU  67          HD13      LEU  67   2.599   1.606  -8.889
  498   HD21  LEU  67          HD21      LEU  67   3.268  -0.445  -5.814
  499   HD22  LEU  67          HD22      LEU  67   4.015   0.665  -6.962
  500   HD23  LEU  67          HD23      LEU  67   3.591  -0.973  -7.474
  501    H    THR  68           HN       THR  68  -1.413   1.092  -8.233
  502    HA   THR  68           HA       THR  68  -3.061   0.082  -6.032
  503    HB   THR  68           HB       THR  68  -3.920   0.232  -8.922
  504    HG1  THR  68           HG1      THR  68  -3.045   2.242  -7.680
  505   HG21  THR  68          HG21      THR  68  -6.121   0.409  -7.917
  506   HG22  THR  68          HG22      THR  68  -5.413   0.552  -6.320
  507   HG23  THR  68          HG23      THR  68  -5.298  -0.975  -7.185
  508    H    ASN  69           HN       ASN  69  -3.594  -2.069  -5.975
  509    HA   ASN  69           HA       ASN  69  -3.182  -4.266  -6.034
  510    HB2  ASN  69           HB2      ASN  69  -3.581  -5.479  -8.167
  511    HB3  ASN  69           HB1      ASN  69  -4.772  -4.224  -7.919
  512   HD21  ASN  69          HD21      ASN  69  -4.892  -2.542  -9.440
  513   HD22  ASN  69          HD22      ASN  69  -4.007  -2.537 -10.906
  514    HA   PRO  70           HA       PRO  70   1.330  -3.827  -7.276
  515    HB2  PRO  70           HB2      PRO  70   2.512  -3.269  -4.994
  516    HB3  PRO  70           HB1      PRO  70   1.627  -2.000  -5.854
  517    HG2  PRO  70           HG2      PRO  70   0.718  -3.700  -3.558
  518    HG3  PRO  70           HG1      PRO  70   0.629  -1.934  -3.722
  519    HD2  PRO  70           HD2      PRO  70  -1.469  -3.573  -4.278
  520    HD3  PRO  70           HD1      PRO  70  -1.184  -2.036  -5.128
  521    H    SER  71           HN       SER  71   3.000  -5.269  -6.884
  522    HA   SER  71           HA       SER  71   2.294  -7.660  -5.393
  523    HB2  SER  71           HB2      SER  71   4.710  -7.155  -7.136
  524    HB3  SER  71           HB1      SER  71   3.950  -8.698  -6.729
  525    HG   SER  71           HG       SER  71   3.073  -6.676  -8.445
  526    H    ALA  72           HN       ALA  72   3.942  -8.499  -3.839
  527    HA   ALA  72           HA       ALA  72   4.749  -6.548  -1.987
  528    HB1  ALA  72           HB1      ALA  72   5.694  -9.410  -2.199
  529    HB2  ALA  72           HB2      ALA  72   4.228  -8.874  -1.377
  530    HB3  ALA  72           HB3      ALA  72   5.811  -8.379  -0.772
  531    H    ASP  73           HN       ASP  73   6.493  -8.194  -4.502
  532    HA   ASP  73           HA       ASP  73   9.108  -7.394  -3.850
  533    HB2  ASP  73           HB2      ASP  73   8.766  -9.135  -5.480
  534    HB3  ASP  73           HB1      ASP  73   7.877  -8.035  -6.529
  535    H    GLU  74           HN       GLU  74   6.661  -5.875  -5.859
  536    HA   GLU  74           HA       GLU  74   8.212  -3.709  -6.811
  537    HB2  GLU  74           HB2      GLU  74   5.230  -3.848  -6.373
  538    HB3  GLU  74           HB1      GLU  74   6.076  -2.680  -7.375
  539    HG2  GLU  74           HG2      GLU  74   6.803  -4.451  -8.850
  540    HG3  GLU  74           HG1      GLU  74   5.984  -5.646  -7.844
  541    H    VAL  75           HN       VAL  75   6.095  -4.158  -4.065
  542    HA   VAL  75           HA       VAL  75   6.118  -1.579  -3.005
  543    HB   VAL  75           HB       VAL  75   5.942  -4.240  -1.545
  544   HG11  VAL  75          HG11      VAL  75   6.553  -2.442  -0.007
  545   HG12  VAL  75          HG12      VAL  75   4.910  -3.014   0.285
  546   HG13  VAL  75          HG13      VAL  75   5.174  -1.492  -0.563
  547   HG21  VAL  75          HG21      VAL  75   3.525  -3.829  -1.550
  548   HG22  VAL  75          HG22      VAL  75   4.174  -3.937  -3.190
  549   HG23  VAL  75          HG23      VAL  75   3.777  -2.365  -2.498
  550    H    LYS  76           HN       LYS  76   8.202  -4.331  -2.259
  551    HA   LYS  76           HA       LYS  76   9.895  -3.031  -0.457
  552    HB2  LYS  76           HB2      LYS  76   9.786  -5.454  -0.604
  553    HB3  LYS  76           HB1      LYS  76  10.413  -5.413  -2.241
  554    HG2  LYS  76           HG2      LYS  76  12.553  -4.641  -1.453
  555    HG3  LYS  76           HG1      LYS  76  11.947  -4.531   0.206
  556    HD2  LYS  76           HD2      LYS  76  11.547  -6.961   0.187
  557    HD3  LYS  76           HD1      LYS  76  12.174  -7.043  -1.459
  558    HE2  LYS  76           HE2      LYS  76  13.745  -6.096   0.943
  559    HE3  LYS  76           HE1      LYS  76  13.829  -7.718   0.263
  560    HZ1  LYS  76           HZ1      LYS  76  14.650  -6.788  -1.791
  561    HZ2  LYS  76           HZ2      LYS  76  15.638  -6.365  -0.525
  562    HZ3  LYS  76           HZ3      LYS  76  14.595  -5.218  -1.191
  563    H    ALA  77           HN       ALA  77  10.163  -3.443  -3.963
  564    HA   ALA  77           HA       ALA  77  12.741  -2.283  -4.200
  565    HB1  ALA  77           HB1      ALA  77  12.300  -2.241  -6.594
  566    HB2  ALA  77           HB2      ALA  77  10.587  -2.545  -6.300
  567    HB3  ALA  77           HB3      ALA  77  11.784  -3.778  -5.900
  568    H    LYS  78           HN       LYS  78   9.481  -0.909  -4.405
  569    HA   LYS  78           HA       LYS  78  10.360   1.701  -5.199
  570    HB2  LYS  78           HB2      LYS  78   7.844   0.811  -3.769
  571    HB3  LYS  78           HB1      LYS  78   8.132   2.466  -4.244
  572    HG2  LYS  78           HG2      LYS  78   7.959   0.142  -6.156
  573    HG3  LYS  78           HG1      LYS  78   6.606   1.172  -5.692
  574    HD2  LYS  78           HD2      LYS  78   9.112   2.054  -7.135
  575    HD3  LYS  78           HD1      LYS  78   7.537   1.834  -7.866
  576    HE2  LYS  78           HE2      LYS  78   6.621   3.613  -6.372
  577    HE3  LYS  78           HE1      LYS  78   8.248   3.884  -5.754
  578    HZ1  LYS  78           HZ1      LYS  78   7.365   4.272  -8.565
  579    HZ2  LYS  78           HZ2      LYS  78   8.939   4.557  -8.010
  580    HZ3  LYS  78           HZ3      LYS  78   7.669   5.495  -7.451
  581    H    LEU  79           HN       LEU  79   9.767   0.131  -2.122
  582    HA   LEU  79           HA       LEU  79   9.901   2.392  -0.493
  583    HB2  LEU  79           HB2      LEU  79   9.346  -0.238  -0.097
  584    HB3  LEU  79           HB1      LEU  79  10.945  -0.148   0.572
  585    HG   LEU  79           HG       LEU  79   8.614   1.523   1.495
  586   HD11  LEU  79          HD11      LEU  79   8.705   0.146   3.496
  587   HD12  LEU  79          HD12      LEU  79   9.898  -0.901   2.705
  588   HD13  LEU  79          HD13      LEU  79   8.263  -0.724   2.033
  589   HD21  LEU  79          HD21      LEU  79  11.401   1.265   2.642
  590   HD22  LEU  79          HD22      LEU  79  10.036   2.121   3.379
  591   HD23  LEU  79          HD23      LEU  79  10.702   2.691   1.859
  592    H    VAL  80           HN       VAL  80  12.386   0.014  -1.375
  593    HA   VAL  80           HA       VAL  80  14.413   1.224   0.124
  594    HB   VAL  80           HB       VAL  80  16.046  -0.108  -1.247
  595   HG11  VAL  80          HG11      VAL  80  15.266  -2.296  -0.504
  596   HG12  VAL  80          HG12      VAL  80  13.668  -1.608  -0.192
  597   HG13  VAL  80          HG13      VAL  80  15.062  -1.064   0.741
  598   HG21  VAL  80          HG21      VAL  80  13.567  -0.969  -2.633
  599   HG22  VAL  80          HG22      VAL  80  15.155  -1.745  -2.825
  600   HG23  VAL  80          HG23      VAL  80  14.901  -0.078  -3.369
  601    H    LYS  81           HN       LYS  81  13.369   1.856  -3.135
  602    HA   LYS  81           HA       LYS  81  15.649   3.537  -3.540
  603    HB2  LYS  81           HB2      LYS  81  14.877   3.937  -5.767
  604    HB3  LYS  81           HB1      LYS  81  14.566   2.249  -5.391
  605    HG2  LYS  81           HG2      LYS  81  12.285   2.676  -5.023
  606    HG3  LYS  81           HG1      LYS  81  12.507   4.396  -5.298
  607    HD2  LYS  81           HD2      LYS  81  13.089   2.260  -7.383
  608    HD3  LYS  81           HD1      LYS  81  11.588   3.165  -7.293
  609    HE2  LYS  81           HE2      LYS  81  12.886   4.172  -8.996
  610    HE3  LYS  81           HE1      LYS  81  12.919   5.259  -7.622
  611    HZ1  LYS  81           HZ1      LYS  81  15.122   3.356  -8.234
  612    HZ2  LYS  81           HZ2      LYS  81  15.210   4.722  -7.217
  613    HZ3  LYS  81           HZ3      LYS  81  15.045   4.890  -8.852
  614    H    ILE  82           HN       ILE  82  12.318   4.039  -2.488
  615    HA   ILE  82           HA       ILE  82  12.633   6.846  -2.863
  616    HB   ILE  82           HB       ILE  82  10.502   7.214  -1.631
  617   HG12  ILE  82          HG12      ILE  82   9.002   5.147  -1.288
  618   HG13  ILE  82          HG11      ILE  82  10.476   4.199  -1.355
  619   HG21  ILE  82          HG21      ILE  82  10.463   7.009  -3.992
  620   HG22  ILE  82          HG22      ILE  82   9.035   6.229  -3.304
  621   HG23  ILE  82          HG23      ILE  82  10.380   5.249  -3.882
  622   HD11  ILE  82          HD11      ILE  82   9.731   4.586   0.938
  623   HD12  ILE  82          HD12      ILE  82   9.851   6.330   0.689
  624   HD13  ILE  82          HD13      ILE  82  11.299   5.331   0.635
  625    H    ALA  83           HN       ALA  83  13.488   4.707  -0.454
  626    HA   ALA  83           HA       ALA  83  13.894   6.738   1.560
  627    HB1  ALA  83           HB1      ALA  83  13.289   4.446   2.208
  628    HB2  ALA  83           HB2      ALA  83  14.857   4.907   2.868
  629    HB3  ALA  83           HB3      ALA  83  14.773   3.845   1.465
  630    H    GLY  84           HN       GLY  84  15.297   6.177  -1.258
  631    HA2  GLY  84           HA2      GLY  84  17.208   7.308  -2.004
  632    HA3  GLY  84           HA1      GLY  84  17.889   7.181  -0.381
  633    H    LEU  85           HN       LEU  85  19.221   5.655   0.025
  634    HA   LEU  85           HA       LEU  85  19.019   3.109  -1.368
  635    HB2  LEU  85           HB2      LEU  85  21.539   4.759  -1.086
  636    HB3  LEU  85           HB1      LEU  85  21.584   3.033  -1.371
  637    HG   LEU  85           HG       LEU  85  20.403   5.096  -3.246
  638   HD11  LEU  85          HD11      LEU  85  22.847   5.165  -3.147
  639   HD12  LEU  85          HD12      LEU  85  22.286   4.519  -4.688
  640   HD13  LEU  85          HD13      LEU  85  22.906   3.432  -3.448
  641   HD21  LEU  85          HD21      LEU  85  20.223   3.214  -4.823
  642   HD22  LEU  85          HD22      LEU  85  19.207   2.983  -3.406
  643   HD23  LEU  85          HD23      LEU  85  20.737   2.110  -3.549
  644    H    GLU  86           HN       GLU  86  18.346   4.359   1.196
  645    HA   GLU  86           HA       GLU  86  20.031   2.875   3.057
  646    HB2  GLU  86           HB2      GLU  86  17.833   4.873   3.578
  647    HB3  GLU  86           HB1      GLU  86  18.922   4.190   4.781
  648    HG2  GLU  86           HG2      GLU  86  19.641   6.057   2.536
  649    HG3  GLU  86           HG1      GLU  86  19.583   6.441   4.255
  650    H    HIS  87           HN       HIS  87  19.094   1.298   4.393
  651    HA   HIS  87           HA       HIS  87  17.840  -0.448   4.897
  652    HB2  HIS  87           HB2      HIS  87  15.586   1.238   3.802
  653    HB3  HIS  87           HB1      HIS  87  15.299  -0.460   4.162
  654    HD1  HIS  87           HD1      HIS  87  14.341   2.422   5.749
  655    HD2  HIS  87           HD2      HIS  87  16.817  -0.694   6.981
  656    HE1  HIS  87           HE1      HIS  87  14.265   2.417   8.242
  657    H    HIS  88           HN       HIS  88  19.034   0.208   2.236
  658    HA   HIS  88           HA       HIS  88  18.041  -2.136   0.803
  659    HB2  HIS  88           HB2      HIS  88  17.910  -0.018  -0.501
  660    HB3  HIS  88           HB1      HIS  88  19.620   0.246  -0.230
  661    HD1  HIS  88           HD1      HIS  88  21.152  -0.646  -2.014
  662    HD2  HIS  88           HD2      HIS  88  17.423  -2.472  -2.063
  663    HE1  HIS  88           HE1      HIS  88  21.155  -2.182  -4.002
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1   2.307  10.617  12.525
    2    H2   MET   1           HT2      MET   1   2.888   9.570  13.719
    3    H3   MET   1           HT3      MET   1   1.461  10.419  13.970
    4    HA   MET   1           HA       MET   1   1.002   8.143  13.496
    5    HB2  MET   1           HB2      MET   1  -0.674   8.442  11.830
    6    HB3  MET   1           HB1      MET   1  -0.566   9.953  12.706
    7    HG2  MET   1           HG2      MET   1   0.596   9.384   9.982
    8    HG3  MET   1           HG1      MET   1  -0.843  10.335  10.319
    9    HE1  MET   1           HE1      MET   1   1.525  11.400   8.472
   10    HE2  MET   1           HE2      MET   1   1.633  13.061   9.056
   11    HE3  MET   1           HE3      MET   1   0.056  12.302   8.853
   12    H    VAL   2           HN       VAL   2   3.597   9.381  11.668
   13    HA   VAL   2           HA       VAL   2   3.408   7.420   9.587
   14    HB   VAL   2           HB       VAL   2   5.800   9.156  10.278
   15   HG11  VAL   2          HG11      VAL   2   6.310   7.300   8.796
   16   HG12  VAL   2          HG12      VAL   2   6.443   8.837   7.944
   17   HG13  VAL   2          HG13      VAL   2   5.033   7.811   7.690
   18   HG21  VAL   2          HG21      VAL   2   3.539   9.795   8.383
   19   HG22  VAL   2          HG22      VAL   2   5.018  10.739   8.567
   20   HG23  VAL   2          HG23      VAL   2   3.880  10.610   9.906
   21    H    THR   3           HN       THR   3   3.194   5.756  11.181
   22    HA   THR   3           HA       THR   3   5.493   4.963  12.715
   23    HB   THR   3           HB       THR   3   2.930   3.440  12.155
   24    HG1  THR   3           HG1      THR   3   1.995   4.857  13.439
   25   HG21  THR   3          HG21      THR   3   4.726   2.091  13.196
   26   HG22  THR   3          HG22      THR   3   3.403   2.376  14.327
   27   HG23  THR   3          HG23      THR   3   4.894   3.306  14.465
   28    H    ALA   4           HN       ALA   4   4.274   4.430   9.556
   29    HA   ALA   4           HA       ALA   4   6.314   2.406   9.070
   30    HB1  ALA   4           HB1      ALA   4   4.774   1.157   7.694
   31    HB2  ALA   4           HB2      ALA   4   3.471   2.289   8.084
   32    HB3  ALA   4           HB3      ALA   4   4.163   1.262   9.345
   33    H    ALA   5           HN       ALA   5   6.771   2.251   6.699
   34    HA   ALA   5           HA       ALA   5   6.740   4.948   5.576
   35    HB1  ALA   5           HB1      ALA   5   8.340   2.528   4.744
   36    HB2  ALA   5           HB2      ALA   5   8.902   3.812   5.814
   37    HB3  ALA   5           HB3      ALA   5   8.536   4.168   4.128
   38    H    LEU   6           HN       LEU   6   4.765   2.386   5.382
   39    HA   LEU   6           HA       LEU   6   4.094   2.937   2.587
   40    HB2  LEU   6           HB2      LEU   6   5.293   0.700   2.994
   41    HB3  LEU   6           HB1      LEU   6   3.839   0.238   3.870
   42    HG   LEU   6           HG       LEU   6   2.563   0.643   1.791
   43   HD11  LEU   6          HD11      LEU   6   5.337   0.882   0.674
   44   HD12  LEU   6          HD12      LEU   6   4.089   2.136   0.692
   45   HD13  LEU   6          HD13      LEU   6   3.874   0.688  -0.279
   46   HD21  LEU   6          HD21      LEU   6   3.296  -1.431   0.742
   47   HD22  LEU   6          HD22      LEU   6   3.232  -1.597   2.496
   48   HD23  LEU   6          HD23      LEU   6   4.784  -1.387   1.682
   49    H    THR   7           HN       THR   7   1.949   3.392   2.381
   50    HA   THR   7           HA       THR   7   0.189   2.777   4.641
   51    HB   THR   7           HB       THR   7  -0.004   4.950   2.543
   52    HG1  THR   7           HG1      THR   7   0.854   4.902   5.242
   53   HG21  THR   7          HG21      THR   7  -2.187   4.240   3.404
   54   HG22  THR   7          HG22      THR   7  -1.780   5.859   3.965
   55   HG23  THR   7          HG23      THR   7  -1.616   4.483   5.054
   56    H    ILE   8           HN       ILE   8  -1.396   1.348   4.184
   57    HA   ILE   8           HA       ILE   8  -2.047   0.797   1.364
   58    HB   ILE   8           HB       ILE   8  -1.859  -1.162   3.676
   59   HG12  ILE   8          HG12      ILE   8  -0.368  -1.004   1.059
   60   HG13  ILE   8          HG11      ILE   8   0.282  -0.590   2.640
   61   HG21  ILE   8          HG21      ILE   8  -3.798  -1.689   2.360
   62   HG22  ILE   8          HG22      ILE   8  -2.561  -2.934   2.148
   63   HG23  ILE   8          HG23      ILE   8  -2.852  -1.759   0.868
   64   HD11  ILE   8          HD11      ILE   8   1.049  -2.747   1.914
   65   HD12  ILE   8          HD12      ILE   8  -0.613  -3.319   1.743
   66   HD13  ILE   8          HD13      ILE   8   0.027  -2.916   3.338
   67    H    TYR   9           HN       TYR   9  -4.188   0.492   0.886
   68    HA   TYR   9           HA       TYR   9  -6.049   1.355   2.947
   69    HB2  TYR   9           HB2      TYR   9  -6.300   1.198  -0.066
   70    HB3  TYR   9           HB1      TYR   9  -7.557   1.784   1.022
   71    HD1  TYR   9           HD2      TYR   9  -4.270   2.529  -0.438
   72    HD2  TYR   9           HD1      TYR   9  -7.375   3.968   2.063
   73    HE1  TYR   9           HE2      TYR   9  -3.257   4.759  -0.491
   74    HE2  TYR   9           HE1      TYR   9  -6.370   6.215   2.019
   75    HH   TYR   9           HH       TYR   9  -4.119   7.198   1.631
   76    H    THR  10           HN       THR  10  -7.644  -0.024   3.754
   77    HA   THR  10           HA       THR  10  -7.973  -2.597   2.435
   78    HB   THR  10           HB       THR  10  -7.897  -3.624   4.752
   79    HG1  THR  10           HG1      THR  10  -6.779  -2.429   6.349
   80   HG21  THR  10          HG21      THR  10  -6.131  -4.034   3.098
   81   HG22  THR  10          HG22      THR  10  -5.442  -3.898   4.714
   82   HG23  THR  10          HG23      THR  10  -5.319  -2.546   3.588
   83    H    THR  11           HN       THR  11  -9.907  -3.734   3.009
   84    HA   THR  11           HA       THR  11 -11.856  -2.514   4.757
   85    HB   THR  11           HB       THR  11 -13.629  -3.052   3.032
   86    HG1  THR  11           HG1      THR  11 -11.688  -2.855   1.041
   87   HG21  THR  11          HG21      THR  11 -11.694  -0.869   2.224
   88   HG22  THR  11          HG22      THR  11 -13.057  -0.711   3.350
   89   HG23  THR  11          HG23      THR  11 -13.353  -1.033   1.648
   90    H    SER  12           HN       SER  12 -13.550  -4.207   5.191
   91    HA   SER  12           HA       SER  12 -12.365  -6.835   5.260
   92    HB2  SER  12           HB2      SER  12 -14.436  -7.376   6.570
   93    HB3  SER  12           HB1      SER  12 -13.476  -6.048   7.225
   94    HG   SER  12           HG       SER  12 -14.926  -4.578   6.360
   95    H    TRP  13           HN       TRP  13 -13.924  -5.257   2.895
   96    HA   TRP  13           HA       TRP  13 -15.862  -7.318   2.130
   97    HB2  TRP  13           HB2      TRP  13 -15.231  -4.845   0.522
   98    HB3  TRP  13           HB1      TRP  13 -16.730  -5.751   0.592
   99    HD1  TRP  13           HD1      TRP  13 -17.097  -5.663   3.790
  100    HE1  TRP  13           HE1      TRP  13 -17.735  -3.451   4.901
  101    HE3  TRP  13           HE3      TRP  13 -15.637  -2.469   0.088
  102    HZ2  TRP  13           HZ2      TRP  13 -17.663  -0.685   4.277
  103    HZ3  TRP  13           HZ3      TRP  13 -15.961  -0.052   0.422
  104    HH2  TRP  13           HH2      TRP  13 -16.956   0.814   2.470
  105    H    CYS  14           HN       CYS  14 -12.953  -7.834   2.018
  106    HA   CYS  14           HA       CYS  14 -12.524  -8.171  -0.831
  107    HB2  CYS  14           HB2      CYS  14 -11.756  -6.011  -0.615
  108    HB3  CYS  14           HB1      CYS  14 -11.033  -6.309   0.960
  109    H    GLY  15           HN       GLY  15 -10.938  -9.650  -1.330
  110    HA2  GLY  15           HA2      GLY  15  -9.635 -11.057   0.911
  111    HA3  GLY  15           HA1      GLY  15 -10.330 -11.901  -0.474
  112    H    TYR  16           HN       TYR  16  -9.404  -9.802  -2.339
  113    HA   TYR  16           HA       TYR  16  -6.956 -10.961  -3.099
  114    HB2  TYR  16           HB2      TYR  16  -8.519  -9.969  -4.716
  115    HB3  TYR  16           HB1      TYR  16  -8.271  -8.384  -4.007
  116    HD1  TYR  16           HD1      TYR  16  -6.514 -11.120  -5.810
  117    HD2  TYR  16           HD2      TYR  16  -6.580  -6.991  -4.827
  118    HE1  TYR  16           HE1      TYR  16  -4.694 -10.721  -7.411
  119    HE2  TYR  16           HE2      TYR  16  -4.749  -6.571  -6.425
  120    HH   TYR  16           HH       TYR  16  -3.830  -8.826  -8.740
  121    H    CYS  17           HN       CYS  17  -7.759  -8.043  -1.342
  122    HA   CYS  17           HA       CYS  17  -5.322  -6.773  -1.358
  123    HB2  CYS  17           HB2      CYS  17  -6.250  -5.861   0.936
  124    HB3  CYS  17           HB1      CYS  17  -7.075  -5.446  -0.557
  125    H    LEU  18           HN       LEU  18  -6.564  -9.422   0.556
  126    HA   LEU  18           HA       LEU  18  -4.776  -9.341   2.724
  127    HB2  LEU  18           HB2      LEU  18  -6.373 -11.626   1.635
  128    HB3  LEU  18           HB1      LEU  18  -5.562 -11.601   3.191
  129    HG   LEU  18           HG       LEU  18  -7.861  -9.840   2.350
  130   HD11  LEU  18          HD11      LEU  18  -8.482 -12.117   2.796
  131   HD12  LEU  18          HD12      LEU  18  -9.048 -11.052   4.104
  132   HD13  LEU  18          HD13      LEU  18  -7.590 -12.046   4.318
  133   HD21  LEU  18          HD21      LEU  18  -6.352  -9.942   4.969
  134   HD22  LEU  18          HD22      LEU  18  -7.845  -9.054   4.687
  135   HD23  LEU  18          HD23      LEU  18  -6.380  -8.590   3.833
  136    H    ARG  19           HN       ARG  19  -4.587 -10.724  -0.456
  137    HA   ARG  19           HA       ARG  19  -2.515 -12.589  -0.096
  138    HB2  ARG  19           HB2      ARG  19  -3.828 -12.408  -2.181
  139    HB3  ARG  19           HB1      ARG  19  -3.081 -10.853  -2.509
  140    HG2  ARG  19           HG2      ARG  19  -0.851 -12.106  -2.430
  141    HG3  ARG  19           HG1      ARG  19  -1.819 -13.572  -2.546
  142    HD2  ARG  19           HD2      ARG  19  -1.821 -11.276  -4.492
  143    HD3  ARG  19           HD1      ARG  19  -1.031 -12.831  -4.739
  144    HE   ARG  19           HE       ARG  19  -3.785 -13.193  -4.219
  145   HH11  ARG  19          HH11      ARG  19  -1.640 -11.983  -6.748
  146   HH12  ARG  19          HH12      ARG  19  -2.657 -12.389  -8.037
  147   HH21  ARG  19          HH21      ARG  19  -5.210 -13.741  -5.939
  148   HH22  ARG  19          HH22      ARG  19  -4.776 -13.466  -7.563
  149    H    LEU  20           HN       LEU  20  -2.415  -9.246  -1.210
  150    HA   LEU  20           HA       LEU  20   0.372  -9.096  -1.316
  151    HB2  LEU  20           HB2      LEU  20  -1.037  -7.613  -2.631
  152    HB3  LEU  20           HB1      LEU  20  -1.737  -6.941  -1.183
  153    HG   LEU  20           HG       LEU  20   0.666  -6.098  -0.690
  154   HD11  LEU  20          HD11      LEU  20   2.024  -7.181  -2.345
  155   HD12  LEU  20          HD12      LEU  20   1.894  -5.495  -2.776
  156   HD13  LEU  20          HD13      LEU  20   0.919  -6.671  -3.624
  157   HD21  LEU  20          HD21      LEU  20  -1.010  -4.907  -2.890
  158   HD22  LEU  20          HD22      LEU  20   0.242  -4.055  -1.989
  159   HD23  LEU  20          HD23      LEU  20  -1.203  -4.635  -1.159
  160    H    LYS  21           HN       LYS  21  -2.017  -8.222   1.061
  161    HA   LYS  21           HA       LYS  21  -0.517  -6.723   2.857
  162    HB2  LYS  21           HB2      LYS  21  -3.046  -7.185   2.699
  163    HB3  LYS  21           HB1      LYS  21  -2.713  -8.603   3.675
  164    HG2  LYS  21           HG2      LYS  21  -1.826  -7.196   5.438
  165    HG3  LYS  21           HG1      LYS  21  -2.105  -5.770   4.441
  166    HD2  LYS  21           HD2      LYS  21  -4.522  -6.399   4.383
  167    HD3  LYS  21           HD1      LYS  21  -4.155  -7.639   5.590
  168    HE2  LYS  21           HE2      LYS  21  -3.664  -4.686   5.903
  169    HE3  LYS  21           HE1      LYS  21  -5.039  -5.548   6.569
  170    HZ1  LYS  21           HZ1      LYS  21  -3.368  -5.158   8.177
  171    HZ2  LYS  21           HZ2      LYS  21  -2.177  -6.013   7.317
  172    HZ3  LYS  21           HZ3      LYS  21  -3.530  -6.812   7.956
  173    H    THR  22           HN       THR  22  -1.100 -10.232   2.775
  174    HA   THR  22           HA       THR  22   0.507 -10.736   5.061
  175    HB   THR  22           HB       THR  22   0.375 -13.178   4.266
  176    HG1  THR  22           HG1      THR  22  -1.470 -12.023   2.419
  177   HG21  THR  22          HG21      THR  22  -2.193 -11.645   4.719
  178   HG22  THR  22          HG22      THR  22  -1.124 -12.278   5.975
  179   HG23  THR  22          HG23      THR  22  -1.993 -13.386   4.916
  180    H    ALA  23           HN       ALA  23   1.124 -10.793   1.616
  181    HA   ALA  23           HA       ALA  23   3.714 -11.925   1.598
  182    HB1  ALA  23           HB1      ALA  23   2.575  -9.808  -0.226
  183    HB2  ALA  23           HB2      ALA  23   2.341 -11.545  -0.428
  184    HB3  ALA  23           HB3      ALA  23   3.959 -10.849  -0.562
  185    H    LEU  24           HN       LEU  24   2.668  -8.604   2.007
  186    HA   LEU  24           HA       LEU  24   5.307  -7.582   2.082
  187    HB2  LEU  24           HB2      LEU  24   2.762  -6.363   3.128
  188    HB3  LEU  24           HB1      LEU  24   4.266  -5.501   2.884
  189    HG   LEU  24           HG       LEU  24   2.514  -6.715   0.763
  190   HD11  LEU  24          HD11      LEU  24   3.218  -3.875   1.396
  191   HD12  LEU  24          HD12      LEU  24   1.654  -4.668   1.618
  192   HD13  LEU  24          HD13      LEU  24   2.293  -4.409  -0.005
  193   HD21  LEU  24          HD21      LEU  24   4.060  -5.795  -0.869
  194   HD22  LEU  24          HD22      LEU  24   4.859  -6.993   0.153
  195   HD23  LEU  24          HD23      LEU  24   5.122  -5.266   0.432
  196    H    THR  25           HN       THR  25   3.021  -8.499   4.637
  197    HA   THR  25           HA       THR  25   4.664  -7.743   6.767
  198    HB   THR  25           HB       THR  25   2.664 -10.028   6.722
  199    HG1  THR  25           HG1      THR  25   1.318  -8.436   6.388
  200   HG21  THR  25          HG21      THR  25   3.711  -8.325   8.997
  201   HG22  THR  25          HG22      THR  25   4.128 -10.010   8.705
  202   HG23  THR  25          HG23      THR  25   2.474  -9.573   9.135
  203    H    ALA  26           HN       ALA  26   4.447 -10.792   4.949
  204    HA   ALA  26           HA       ALA  26   6.343 -12.229   6.489
  205    HB1  ALA  26           HB1      ALA  26   6.363 -13.819   4.642
  206    HB2  ALA  26           HB2      ALA  26   5.535 -12.647   3.614
  207    HB3  ALA  26           HB3      ALA  26   4.713 -13.323   5.022
  208    H    ASN  27           HN       ASN  27   6.667  -9.811   4.146
  209    HA   ASN  27           HA       ASN  27   9.475 -10.425   3.691
  210    HB2  ASN  27           HB2      ASN  27   7.435  -8.873   2.258
  211    HB3  ASN  27           HB1      ASN  27   9.095  -8.235   2.153
  212   HD21  ASN  27          HD21      ASN  27   6.869 -10.712   1.312
  213   HD22  ASN  27          HD22      ASN  27   7.887 -11.572   0.210
  214    H    ARG  28           HN       ARG  28   7.947  -9.060   6.084
  215    HA   ARG  28           HA       ARG  28   8.510  -7.695   7.764
  216    HB2  ARG  28           HB2      ARG  28  11.208  -7.647   6.400
  217    HB3  ARG  28           HB1      ARG  28  10.902  -6.894   7.954
  218    HG2  ARG  28           HG2      ARG  28  10.411  -9.821   7.449
  219    HG3  ARG  28           HG1      ARG  28  11.978  -9.200   7.954
  220    HD2  ARG  28           HD2      ARG  28  10.659 -10.066   9.843
  221    HD3  ARG  28           HD1      ARG  28  11.007  -8.359  10.021
  222    HE   ARG  28           HE       ARG  28   8.719  -7.882   9.519
  223   HH11  ARG  28          HH11      ARG  28   9.380 -11.309  10.150
  224   HH12  ARG  28          HH12      ARG  28   7.746 -11.689  10.459
  225   HH21  ARG  28          HH21      ARG  28   6.536  -8.406  10.024
  226   HH22  ARG  28          HH22      ARG  28   6.097 -10.014  10.411
  227    H    ILE  29           HN       ILE  29   7.437  -6.656   5.226
  228    HA   ILE  29           HA       ILE  29   8.417  -3.945   5.161
  229    HB   ILE  29           HB       ILE  29   6.183  -5.308   3.619
  230   HG12  ILE  29          HG12      ILE  29   8.994  -4.520   2.753
  231   HG13  ILE  29          HG11      ILE  29   8.432  -6.151   3.049
  232   HG21  ILE  29          HG21      ILE  29   7.336  -2.533   3.293
  233   HG22  ILE  29          HG22      ILE  29   5.713  -2.939   3.835
  234   HG23  ILE  29          HG23      ILE  29   6.201  -3.293   2.176
  235   HD11  ILE  29          HD11      ILE  29   6.920  -5.991   1.178
  236   HD12  ILE  29          HD12      ILE  29   8.579  -5.637   0.690
  237   HD13  ILE  29          HD13      ILE  29   7.417  -4.323   0.898
  238    H    ALA  30           HN       ALA  30   7.635  -2.477   6.475
  239    HA   ALA  30           HA       ALA  30   5.289  -3.065   8.048
  240    HB1  ALA  30           HB1      ALA  30   5.968  -1.116   9.348
  241    HB2  ALA  30           HB2      ALA  30   7.241  -0.785   8.167
  242    HB3  ALA  30           HB3      ALA  30   7.307  -2.250   9.147
  243    H    TYR  31           HN       TYR  31   3.367  -2.205   7.675
  244    HA   TYR  31           HA       TYR  31   3.140   0.174   6.010
  245    HB2  TYR  31           HB2      TYR  31   1.286  -0.872   4.763
  246    HB3  TYR  31           HB1      TYR  31   2.807  -1.724   4.511
  247    HD1  TYR  31           HD2      TYR  31  -0.517  -1.904   6.080
  248    HD2  TYR  31           HD1      TYR  31   3.105  -3.981   5.273
  249    HE1  TYR  31           HE2      TYR  31  -1.579  -4.012   6.761
  250    HE2  TYR  31           HE1      TYR  31   2.059  -6.080   5.949
  251    HH   TYR  31           HH       TYR  31   0.243  -6.822   7.317
  252    H    ASP  32           HN       ASP  32   1.284   1.370   6.428
  253    HA   ASP  32           HA       ASP  32  -0.254   0.510   8.770
  254    HB2  ASP  32           HB2      ASP  32  -0.700   2.835   9.299
  255    HB3  ASP  32           HB1      ASP  32   1.025   2.697   9.039
  256    H    GLU  33           HN       GLU  33  -2.475   0.385   8.531
  257    HA   GLU  33           HA       GLU  33  -3.327   0.661   5.756
  258    HB2  GLU  33           HB2      GLU  33  -5.123  -0.951   6.278
  259    HB3  GLU  33           HB1      GLU  33  -3.512  -1.607   6.484
  260    HG2  GLU  33           HG2      GLU  33  -3.737  -1.334   8.910
  261    HG3  GLU  33           HG1      GLU  33  -5.375  -0.716   8.671
  262    H    VAL  34           HN       VAL  34  -5.291   1.572   5.260
  263    HA   VAL  34           HA       VAL  34  -5.891   3.688   7.153
  264    HB   VAL  34           HB       VAL  34  -6.646   3.625   4.220
  265   HG11  VAL  34          HG11      VAL  34  -7.012   5.987   4.448
  266   HG12  VAL  34          HG12      VAL  34  -6.617   5.908   6.161
  267   HG13  VAL  34          HG13      VAL  34  -8.060   5.084   5.547
  268   HG21  VAL  34          HG21      VAL  34  -4.359   4.988   5.612
  269   HG22  VAL  34          HG22      VAL  34  -4.782   5.149   3.907
  270   HG23  VAL  34          HG23      VAL  34  -4.235   3.597   4.536
  271    H    ASP  35           HN       ASP  35  -7.633   4.103   7.991
  272    HA   ASP  35           HA       ASP  35  -9.682   2.408   8.656
  273    HB2  ASP  35           HB2      ASP  35  -9.506   5.397   8.853
  274    HB3  ASP  35           HB1      ASP  35 -10.807   4.459   9.558
  275    H    ILE  36           HN       ILE  36  -9.561   3.528   5.608
  276    HA   ILE  36           HA       ILE  36 -11.686   5.163   4.960
  277    HB   ILE  36           HB       ILE  36 -11.749   4.230   2.698
  278   HG12  ILE  36          HG12      ILE  36  -9.619   2.291   3.453
  279   HG13  ILE  36          HG11      ILE  36 -11.308   1.827   3.662
  280   HG21  ILE  36          HG21      ILE  36  -8.980   4.509   3.826
  281   HG22  ILE  36          HG22      ILE  36 -10.037   5.825   3.317
  282   HG23  ILE  36          HG23      ILE  36  -9.425   4.673   2.129
  283   HD11  ILE  36          HD11      ILE  36 -10.100   2.747   1.046
  284   HD12  ILE  36          HD12      ILE  36 -11.743   2.183   1.322
  285   HD13  ILE  36          HD13      ILE  36 -10.403   1.064   1.504
  286    H    GLU  37           HN       GLU  37 -12.042   1.780   5.747
  287    HA   GLU  37           HA       GLU  37 -14.533   1.262   4.579
  288    HB2  GLU  37           HB2      GLU  37 -13.033  -0.422   5.647
  289    HB3  GLU  37           HB1      GLU  37 -13.410   0.291   7.198
  290    HG2  GLU  37           HG2      GLU  37 -15.711  -0.361   7.001
  291    HG3  GLU  37           HG1      GLU  37 -15.410  -1.009   5.385
  292    H    HIS  38           HN       HIS  38 -13.615   2.619   7.685
  293    HA   HIS  38           HA       HIS  38 -16.383   3.334   8.285
  294    HB2  HIS  38           HB2      HIS  38 -15.223   2.061  10.026
  295    HB3  HIS  38           HB1      HIS  38 -13.919   3.235  10.035
  296    HD1  HIS  38           HD1      HIS  38 -14.042   4.590  12.086
  297    HD2  HIS  38           HD2      HIS  38 -17.817   3.626  10.666
  298    HE1  HIS  38           HE1      HIS  38 -15.682   5.687  13.667
  299    H    ASN  39           HN       ASN  39 -13.234   4.668   7.623
  300    HA   ASN  39           HA       ASN  39 -14.110   7.380   8.245
  301    HB2  ASN  39           HB2      ASN  39 -11.776   6.753   8.738
  302    HB3  ASN  39           HB1      ASN  39 -11.506   6.463   7.022
  303   HD21  ASN  39          HD21      ASN  39 -10.157   8.038   6.456
  304   HD22  ASN  39          HD22      ASN  39 -10.312   9.704   6.781
  305    H    ARG  40           HN       ARG  40 -15.482   8.178   6.798
  306    HA   ARG  40           HA       ARG  40 -15.410   7.378   4.064
  307    HB2  ARG  40           HB2      ARG  40 -17.273   8.864   3.690
  308    HB3  ARG  40           HB1      ARG  40 -17.517   8.004   5.199
  309    HG2  ARG  40           HG2      ARG  40 -16.874   9.968   6.464
  310    HG3  ARG  40           HG1      ARG  40 -16.505  10.830   4.969
  311    HD2  ARG  40           HD2      ARG  40 -19.210   9.790   5.812
  312    HD3  ARG  40           HD1      ARG  40 -18.686  11.474   5.840
  313    HE   ARG  40           HE       ARG  40 -18.315  10.785   3.265
  314   HH11  ARG  40          HH11      ARG  40 -21.131  10.649   5.407
  315   HH12  ARG  40          HH12      ARG  40 -22.275  10.698   4.138
  316   HH21  ARG  40          HH21      ARG  40 -19.926  10.845   1.503
  317   HH22  ARG  40          HH22      ARG  40 -21.569  10.805   1.910
  318    H    ALA  41           HN       ALA  41 -13.713   9.785   5.794
  319    HA   ALA  41           HA       ALA  41 -13.554  11.591   3.629
  320    HB1  ALA  41           HB1      ALA  41 -11.792  11.602   6.084
  321    HB2  ALA  41           HB2      ALA  41 -13.366  12.366   5.947
  322    HB3  ALA  41           HB3      ALA  41 -12.038  12.913   4.933
  323    H    ALA  42           HN       ALA  42 -11.254   9.243   4.858
  324    HA   ALA  42           HA       ALA  42  -9.413   9.804   2.738
  325    HB1  ALA  42           HB1      ALA  42  -8.616   8.846   4.841
  326    HB2  ALA  42           HB2      ALA  42  -8.229   7.777   3.491
  327    HB3  ALA  42           HB3      ALA  42  -9.582   7.402   4.560
  328    H    ALA  43           HN       ALA  43 -12.186   7.813   3.127
  329    HA   ALA  43           HA       ALA  43 -11.714   5.971   1.041
  330    HB1  ALA  43           HB1      ALA  43 -14.079   5.452   1.233
  331    HB2  ALA  43           HB2      ALA  43 -14.344   6.949   2.129
  332    HB3  ALA  43           HB3      ALA  43 -13.375   5.666   2.844
  333    H    GLU  44           HN       GLU  44 -13.044   9.178   1.192
  334    HA   GLU  44           HA       GLU  44 -14.166   9.353  -1.394
  335    HB2  GLU  44           HB2      GLU  44 -14.430  10.926   0.627
  336    HB3  GLU  44           HB1      GLU  44 -12.895  11.622   0.129
  337    HG2  GLU  44           HG2      GLU  44 -14.650  12.976  -0.727
  338    HG3  GLU  44           HG1      GLU  44 -13.909  12.118  -2.079
  339    H    PHE  45           HN       PHE  45 -11.013  10.012  -0.022
  340    HA   PHE  45           HA       PHE  45  -9.704  11.064  -2.266
  341    HB2  PHE  45           HB2      PHE  45  -8.733  11.287  -0.058
  342    HB3  PHE  45           HB1      PHE  45  -8.667   9.543   0.138
  343    HD1  PHE  45           HD2      PHE  45  -7.371  12.229  -2.082
  344    HD2  PHE  45           HD1      PHE  45  -6.661   8.469  -0.238
  345    HE1  PHE  45           HE2      PHE  45  -5.075  12.238  -2.957
  346    HE2  PHE  45           HE1      PHE  45  -4.358   8.471  -1.105
  347    HZ   PHE  45           HZ       PHE  45  -3.562  10.360  -2.468
  348    H    VAL  46           HN       VAL  46  -9.959   7.780  -1.032
  349    HA   VAL  46           HA       VAL  46  -8.459   6.424  -2.952
  350    HB   VAL  46           HB       VAL  46 -10.929   5.427  -1.491
  351   HG11  VAL  46          HG11      VAL  46 -10.415   3.985  -3.371
  352   HG12  VAL  46          HG12      VAL  46  -9.989   3.174  -1.858
  353   HG13  VAL  46          HG13      VAL  46  -8.730   3.900  -2.862
  354   HG21  VAL  46          HG21      VAL  46  -9.234   6.186   0.048
  355   HG22  VAL  46          HG22      VAL  46  -8.012   5.246  -0.802
  356   HG23  VAL  46          HG23      VAL  46  -9.307   4.423   0.058
  357    H    GLY  47           HN       GLY  47 -11.878   7.317  -2.974
  358    HA2  GLY  47           HA2      GLY  47 -12.639   6.091  -5.379
  359    HA3  GLY  47           HA1      GLY  47 -13.400   7.516  -4.684
  360    H    SER  48           HN       SER  48 -10.974   9.132  -4.808
  361    HA   SER  48           HA       SER  48 -11.224   9.958  -7.550
  362    HB2  SER  48           HB2      SER  48  -9.548  11.095  -5.307
  363    HB3  SER  48           HB1      SER  48  -9.883  11.884  -6.851
  364    HG   SER  48           HG       SER  48 -12.112  11.000  -5.536
  365    H    VAL  49           HN       VAL  49  -8.946   8.174  -5.631
  366    HA   VAL  49           HA       VAL  49  -6.764   8.447  -7.490
  367    HB   VAL  49           HB       VAL  49  -7.109   6.536  -5.148
  368   HG11  VAL  49          HG11      VAL  49  -4.688   6.145  -5.310
  369   HG12  VAL  49          HG12      VAL  49  -4.624   7.140  -6.764
  370   HG13  VAL  49          HG13      VAL  49  -5.521   5.622  -6.772
  371   HG21  VAL  49          HG21      VAL  49  -5.539   8.022  -3.994
  372   HG22  VAL  49          HG22      VAL  49  -7.011   8.869  -4.472
  373   HG23  VAL  49          HG23      VAL  49  -5.525   9.088  -5.398
  374    H    ASN  50           HN       ASN  50  -9.231   6.080  -6.791
  375    HA   ASN  50           HA       ASN  50  -8.181   4.213  -8.744
  376    HB2  ASN  50           HB2      ASN  50 -10.700   4.131  -7.090
  377    HB3  ASN  50           HB1      ASN  50 -10.172   2.845  -8.156
  378   HD21  ASN  50          HD21      ASN  50  -7.282   3.186  -7.365
  379   HD22  ASN  50          HD22      ASN  50  -7.216   2.527  -5.782
  380    H    GLY  51           HN       GLY  51 -10.254   3.172 -10.025
  381    HA2  GLY  51           HA2      GLY  51 -10.908   5.301 -11.880
  382    HA3  GLY  51           HA1      GLY  51 -11.081   3.574 -12.158
  383    H    GLY  52           HN       GLY  52 -12.961   2.527 -11.460
  384    HA2  GLY  52           HA2      GLY  52 -15.210   4.373 -11.390
  385    HA3  GLY  52           HA1      GLY  52 -15.289   2.665 -11.775
  386    H    ASN  53           HN       ASN  53 -14.060   1.571  -9.548
  387    HA   ASN  53           HA       ASN  53 -15.821   2.424  -7.357
  388    HB2  ASN  53           HB2      ASN  53 -16.771   0.417  -8.473
  389    HB3  ASN  53           HB1      ASN  53 -15.255  -0.434  -8.241
  390   HD21  ASN  53          HD21      ASN  53 -18.134   0.779  -6.681
  391   HD22  ASN  53          HD22      ASN  53 -17.983  -0.133  -5.241
  392    H    ARG  54           HN       ARG  54 -14.976   1.982  -5.241
  393    HA   ARG  54           HA       ARG  54 -12.250   2.493  -4.990
  394    HB2  ARG  54           HB2      ARG  54 -14.220   1.485  -2.924
  395    HB3  ARG  54           HB1      ARG  54 -12.570   1.919  -2.525
  396    HG2  ARG  54           HG2      ARG  54 -12.996   4.219  -3.281
  397    HG3  ARG  54           HG1      ARG  54 -14.637   3.755  -3.719
  398    HD2  ARG  54           HD2      ARG  54 -13.476   3.718  -0.927
  399    HD3  ARG  54           HD1      ARG  54 -14.570   4.941  -1.563
  400    HE   ARG  54           HE       ARG  54 -15.550   2.226  -1.681
  401   HH11  ARG  54          HH11      ARG  54 -15.687   5.288   0.131
  402   HH12  ARG  54          HH12      ARG  54 -16.955   4.778   1.130
  403   HH21  ARG  54          HH21      ARG  54 -17.334   1.593  -0.346
  404   HH22  ARG  54          HH22      ARG  54 -17.908   2.639   0.867
  405    H    THR  55           HN       THR  55 -10.651   1.296  -5.452
  406    HA   THR  55           HA       THR  55 -10.783  -1.599  -5.450
  407    HB   THR  55           HB       THR  55  -8.521   0.280  -6.200
  408    HG1  THR  55           HG1      THR  55 -10.838   0.166  -7.329
  409   HG21  THR  55          HG21      THR  55  -7.776  -1.613  -7.583
  410   HG22  THR  55          HG22      THR  55  -9.139  -2.579  -6.995
  411   HG23  THR  55          HG23      THR  55  -7.874  -2.062  -5.880
  412    H    VAL  56           HN       VAL  56  -9.648  -2.787  -3.862
  413    HA   VAL  56           HA       VAL  56  -9.230  -1.217  -1.541
  414    HB   VAL  56           HB       VAL  56  -8.732  -4.157  -1.704
  415   HG11  VAL  56          HG11      VAL  56  -7.638  -2.928   0.155
  416   HG12  VAL  56          HG12      VAL  56  -8.906  -4.017   0.745
  417   HG13  VAL  56          HG13      VAL  56  -9.204  -2.281   0.610
  418   HG21  VAL  56          HG21      VAL  56 -10.987  -2.503  -0.846
  419   HG22  VAL  56          HG22      VAL  56 -10.826  -4.265  -0.615
  420   HG23  VAL  56          HG23      VAL  56 -10.968  -3.569  -2.276
  421    HA   PRO  57           HA       PRO  57  -5.369  -2.830  -1.094
  422    HB2  PRO  57           HB2      PRO  57  -3.605  -4.225  -2.590
  423    HB3  PRO  57           HB1      PRO  57  -4.976  -4.923  -1.725
  424    HG2  PRO  57           HG2      PRO  57  -4.863  -4.089  -4.611
  425    HG3  PRO  57           HG1      PRO  57  -5.507  -5.588  -3.915
  426    HD2  PRO  57           HD2      PRO  57  -7.054  -3.433  -4.565
  427    HD3  PRO  57           HD1      PRO  57  -7.429  -4.660  -3.314
  428    H    THR  58           HN       THR  58  -5.661  -0.543  -2.292
  429    HA   THR  58           HA       THR  58  -3.776   0.395  -4.191
  430    HB   THR  58           HB       THR  58  -5.859   1.624  -2.372
  431    HG1  THR  58           HG1      THR  58  -7.172   0.838  -3.814
  432   HG21  THR  58          HG21      THR  58  -4.204   3.339  -3.075
  433   HG22  THR  58          HG22      THR  58  -5.767   3.596  -3.871
  434   HG23  THR  58          HG23      THR  58  -4.442   2.851  -4.757
  435    H    VAL  59           HN       VAL  59  -1.904   1.472  -3.561
  436    HA   VAL  59           HA       VAL  59  -1.386   1.606  -0.676
  437    HB   VAL  59           HB       VAL  59  -0.260  -0.376  -1.766
  438   HG11  VAL  59          HG11      VAL  59   1.141   1.697  -3.306
  439   HG12  VAL  59          HG12      VAL  59   0.083   0.419  -3.911
  440   HG13  VAL  59          HG13      VAL  59   1.656   0.006  -3.187
  441   HG21  VAL  59          HG21      VAL  59   1.955  -0.020  -0.784
  442   HG22  VAL  59          HG22      VAL  59   0.727   0.640   0.281
  443   HG23  VAL  59          HG23      VAL  59   1.668   1.707  -0.734
  444    H    LYS  60           HN       LYS  60  -0.070   3.234  -0.006
  445    HA   LYS  60           HA       LYS  60   0.678   5.274  -1.948
  446    HB2  LYS  60           HB2      LYS  60  -1.331   6.012  -0.746
  447    HB3  LYS  60           HB1      LYS  60  -0.585   5.627   0.786
  448    HG2  LYS  60           HG2      LYS  60   0.936   7.461   0.546
  449    HG3  LYS  60           HG1      LYS  60   0.369   7.754  -1.104
  450    HD2  LYS  60           HD2      LYS  60  -1.871   8.240  -0.268
  451    HD3  LYS  60           HD1      LYS  60  -1.339   7.915   1.379
  452    HE2  LYS  60           HE2      LYS  60  -0.177  10.028  -0.393
  453    HE3  LYS  60           HE1      LYS  60  -1.483  10.326   0.755
  454    HZ1  LYS  60           HZ1      LYS  60   1.261   9.369   1.465
  455    HZ2  LYS  60           HZ2      LYS  60  -0.002   9.615   2.536
  456    HZ3  LYS  60           HZ3      LYS  60   0.646  10.916   1.728
  457    H    PHE  61           HN       PHE  61   2.786   5.549  -1.884
  458    HA   PHE  61           HA       PHE  61   4.374   4.410   0.278
  459    HB2  PHE  61           HB2      PHE  61   5.145   5.622  -2.389
  460    HB3  PHE  61           HB1      PHE  61   6.316   5.059  -1.206
  461    HD1  PHE  61           HD2      PHE  61   3.514   3.959  -3.358
  462    HD2  PHE  61           HD1      PHE  61   6.910   2.802  -1.083
  463    HE1  PHE  61           HE2      PHE  61   3.336   1.688  -4.242
  464    HE2  PHE  61           HE1      PHE  61   6.741   0.546  -1.951
  465    HZ   PHE  61           HZ       PHE  61   4.935  -0.035  -3.564
  466    H    ALA  62           HN       ALA  62   6.101   5.613   1.273
  467    HA   ALA  62           HA       ALA  62   5.446   8.118   2.313
  468    HB1  ALA  62           HB1      ALA  62   6.989   6.554   3.395
  469    HB2  ALA  62           HB2      ALA  62   7.735   8.143   3.198
  470    HB3  ALA  62           HB3      ALA  62   8.166   6.827   2.113
  471    H    ASP  63           HN       ASP  63   6.644   7.376  -0.698
  472    HA   ASP  63           HA       ASP  63   8.069   9.797  -1.330
  473    HB2  ASP  63           HB2      ASP  63   8.549   7.743  -2.547
  474    HB3  ASP  63           HB1      ASP  63   6.873   7.610  -3.052
  475    H    GLY  64           HN       GLY  64   4.775   8.866  -1.077
  476    HA2  GLY  64           HA2      GLY  64   3.025  10.445  -1.109
  477    HA3  GLY  64           HA1      GLY  64   3.942  11.413  -2.255
  478    H    SER  65           HN       SER  65   4.459   8.632  -3.523
  479    HA   SER  65           HA       SER  65   2.395   8.901  -5.488
  480    HB2  SER  65           HB2      SER  65   4.692   6.964  -5.289
  481    HB3  SER  65           HB1      SER  65   3.668   7.217  -6.709
  482    HG   SER  65           HG       SER  65   5.728   8.793  -5.699
  483    H    THR  66           HN       THR  66   0.809   7.423  -6.015
  484    HA   THR  66           HA       THR  66   0.302   5.281  -4.090
  485    HB   THR  66           HB       THR  66  -2.088   5.548  -4.920
  486    HG1  THR  66           HG1      THR  66  -1.333   8.126  -5.734
  487   HG21  THR  66          HG21      THR  66  -2.552   7.534  -3.523
  488   HG22  THR  66          HG22      THR  66  -0.828   7.916  -3.511
  489   HG23  THR  66          HG23      THR  66  -1.410   6.439  -2.749
  490    H    LEU  67           HN       LEU  67  -0.334   3.295  -4.908
  491    HA   LEU  67           HA       LEU  67  -0.381   2.954  -7.833
  492    HB2  LEU  67           HB2      LEU  67   0.928   1.077  -5.860
  493    HB3  LEU  67           HB1      LEU  67   0.655   0.689  -7.550
  494    HG   LEU  67           HG       LEU  67   2.575   2.665  -6.353
  495   HD11  LEU  67          HD11      LEU  67   4.281   1.249  -7.356
  496   HD12  LEU  67          HD12      LEU  67   3.036   0.256  -8.090
  497   HD13  LEU  67          HD13      LEU  67   3.224   0.243  -6.350
  498   HD21  LEU  67          HD21      LEU  67   1.715   3.701  -8.386
  499   HD22  LEU  67          HD22      LEU  67   1.963   2.199  -9.279
  500   HD23  LEU  67          HD23      LEU  67   3.345   3.101  -8.676
  501    H    THR  68           HN       THR  68  -2.005   1.761  -8.576
  502    HA   THR  68           HA       THR  68  -3.830   0.621  -6.608
  503    HB   THR  68           HB       THR  68  -4.266   1.243  -9.560
  504    HG1  THR  68           HG1      THR  68  -4.282   3.193  -8.638
  505   HG21  THR  68          HG21      THR  68  -6.239   0.455  -7.401
  506   HG22  THR  68          HG22      THR  68  -5.713  -0.571  -8.737
  507   HG23  THR  68          HG23      THR  68  -6.649   0.885  -9.063
  508    H    ASN  69           HN       ASN  69  -3.679  -1.498  -6.307
  509    HA   ASN  69           HA       ASN  69  -3.183  -3.673  -6.470
  510    HB2  ASN  69           HB2      ASN  69  -3.813  -3.294  -9.414
  511    HB3  ASN  69           HB1      ASN  69  -3.569  -4.854  -8.649
  512   HD21  ASN  69          HD21      ASN  69  -5.840  -3.811 -10.065
  513   HD22  ASN  69          HD22      ASN  69  -7.182  -3.908  -8.984
  514    HA   PRO  70           HA       PRO  70   1.083  -3.184  -8.137
  515    HB2  PRO  70           HB2      PRO  70   2.472  -2.796  -5.935
  516    HB3  PRO  70           HB1      PRO  70   1.518  -1.461  -6.610
  517    HG2  PRO  70           HG2      PRO  70   0.814  -3.340  -4.382
  518    HG3  PRO  70           HG1      PRO  70   0.712  -1.566  -4.395
  519    HD2  PRO  70           HD2      PRO  70  -1.431  -3.188  -4.899
  520    HD3  PRO  70           HD1      PRO  70  -1.220  -1.568  -5.614
  521    H    SER  71           HN       SER  71   2.700  -4.760  -8.024
  522    HA   SER  71           HA       SER  71   1.973  -7.262  -6.820
  523    HB2  SER  71           HB2      SER  71   4.045  -8.059  -8.042
  524    HB3  SER  71           HB1      SER  71   2.870  -7.274  -9.097
  525    HG   SER  71           HG       SER  71   4.118  -5.554  -9.251
  526    H    ALA  72           HN       ALA  72   3.326  -8.342  -5.269
  527    HA   ALA  72           HA       ALA  72   4.265  -6.707  -3.186
  528    HB1  ALA  72           HB1      ALA  72   4.844  -9.627  -3.684
  529    HB2  ALA  72           HB2      ALA  72   3.435  -8.992  -2.830
  530    HB3  ALA  72           HB3      ALA  72   5.053  -8.778  -2.152
  531    H    ASP  73           HN       ASP  73   5.818  -8.255  -5.853
  532    HA   ASP  73           HA       ASP  73   8.494  -7.920  -5.086
  533    HB2  ASP  73           HB2      ASP  73   7.277  -8.063  -7.846
  534    HB3  ASP  73           HB1      ASP  73   9.009  -8.035  -7.553
  535    H    GLU  74           HN       GLU  74   6.392  -5.832  -7.092
  536    HA   GLU  74           HA       GLU  74   8.381  -3.858  -7.336
  537    HB2  GLU  74           HB2      GLU  74   5.404  -3.589  -7.637
  538    HB3  GLU  74           HB1      GLU  74   6.514  -2.257  -7.863
  539    HG2  GLU  74           HG2      GLU  74   7.661  -3.896  -9.562
  540    HG3  GLU  74           HG1      GLU  74   6.063  -4.654  -9.550
  541    H    VAL  75           HN       VAL  75   5.790  -4.291  -4.994
  542    HA   VAL  75           HA       VAL  75   6.107  -1.815  -3.748
  543    HB   VAL  75           HB       VAL  75   5.264  -4.427  -2.437
  544   HG11  VAL  75          HG11      VAL  75   4.256  -3.033  -0.694
  545   HG12  VAL  75          HG12      VAL  75   4.915  -1.589  -1.460
  546   HG13  VAL  75          HG13      VAL  75   6.002  -2.795  -0.767
  547   HG21  VAL  75          HG21      VAL  75   2.991  -3.529  -2.705
  548   HG22  VAL  75          HG22      VAL  75   3.800  -3.781  -4.251
  549   HG23  VAL  75          HG23      VAL  75   3.652  -2.153  -3.585
  550    H    LYS  76           HN       LYS  76   7.751  -4.865  -3.139
  551    HA   LYS  76           HA       LYS  76   9.309  -3.944  -0.987
  552    HB2  LYS  76           HB2      LYS  76   8.914  -6.284  -1.377
  553    HB3  LYS  76           HB1      LYS  76   9.749  -6.220  -2.924
  554    HG2  LYS  76           HG2      LYS  76  11.838  -5.818  -1.796
  555    HG3  LYS  76           HG1      LYS  76  11.020  -5.764  -0.225
  556    HD2  LYS  76           HD2      LYS  76  10.275  -8.091  -0.598
  557    HD3  LYS  76           HD1      LYS  76  11.172  -8.100  -2.117
  558    HE2  LYS  76           HE2      LYS  76  13.244  -7.741  -0.913
  559    HE3  LYS  76           HE1      LYS  76  12.356  -7.649   0.605
  560    HZ1  LYS  76           HZ1      LYS  76  12.535 -10.017  -1.168
  561    HZ2  LYS  76           HZ2      LYS  76  11.623  -9.945   0.238
  562    HZ3  LYS  76           HZ3      LYS  76  13.316  -9.827   0.316
  563    H    ALA  77           HN       ALA  77   9.986  -4.148  -4.470
  564    HA   ALA  77           HA       ALA  77  12.638  -3.167  -4.292
  565    HB1  ALA  77           HB1      ALA  77  11.814  -4.439  -6.225
  566    HB2  ALA  77           HB2      ALA  77  12.515  -2.892  -6.712
  567    HB3  ALA  77           HB3      ALA  77  10.764  -3.092  -6.660
  568    H    LYS  78           HN       LYS  78   9.543  -1.554  -4.624
  569    HA   LYS  78           HA       LYS  78  10.746   1.015  -5.078
  570    HB2  LYS  78           HB2      LYS  78   7.928   0.289  -4.232
  571    HB3  LYS  78           HB1      LYS  78   8.434   1.916  -4.681
  572    HG2  LYS  78           HG2      LYS  78   8.469  -0.501  -6.484
  573    HG3  LYS  78           HG1      LYS  78   7.177   0.692  -6.428
  574    HD2  LYS  78           HD2      LYS  78   8.605   2.396  -7.225
  575    HD3  LYS  78           HD1      LYS  78  10.039   1.385  -7.038
  576    HE2  LYS  78           HE2      LYS  78   9.305   1.534  -9.398
  577    HE3  LYS  78           HE1      LYS  78   9.270  -0.117  -8.786
  578    HZ1  LYS  78           HZ1      LYS  78   6.813   0.231  -8.429
  579    HZ2  LYS  78           HZ2      LYS  78   7.292   0.208 -10.010
  580    HZ3  LYS  78           HZ3      LYS  78   6.938   1.673  -9.290
  581    H    LEU  79           HN       LEU  79   9.521  -0.772  -2.287
  582    HA   LEU  79           HA       LEU  79   9.616   1.211  -0.356
  583    HB2  LEU  79           HB2      LEU  79   8.777  -1.193   0.009
  584    HB3  LEU  79           HB1      LEU  79  10.449  -1.656   0.051
  585    HG   LEU  79           HG       LEU  79  10.691  -0.006   1.963
  586   HD11  LEU  79          HD11      LEU  79   7.703  -0.271   1.970
  587   HD12  LEU  79          HD12      LEU  79   8.654   1.224   1.918
  588   HD13  LEU  79          HD13      LEU  79   8.651   0.229   3.358
  589   HD21  LEU  79          HD21      LEU  79   9.146  -2.559   2.270
  590   HD22  LEU  79          HD22      LEU  79   9.937  -1.712   3.600
  591   HD23  LEU  79          HD23      LEU  79  10.902  -2.377   2.277
  592    H    VAL  80           HN       VAL  80  12.122  -1.031  -1.434
  593    HA   VAL  80           HA       VAL  80  14.043  -0.212   0.412
  594    HB   VAL  80           HB       VAL  80  15.741  -1.363  -0.952
  595   HG11  VAL  80          HG11      VAL  80  13.182  -2.876  -0.660
  596   HG12  VAL  80          HG12      VAL  80  14.439  -2.665   0.562
  597   HG13  VAL  80          HG13      VAL  80  14.775  -3.594  -0.901
  598   HG21  VAL  80          HG21      VAL  80  15.051  -2.548  -3.012
  599   HG22  VAL  80          HG22      VAL  80  15.084  -0.792  -3.158
  600   HG23  VAL  80          HG23      VAL  80  13.540  -1.619  -2.961
  601    H    LYS  81           HN       LYS  81  13.302   1.094  -2.738
  602    HA   LYS  81           HA       LYS  81  15.604   2.800  -2.600
  603    HB2  LYS  81           HB2      LYS  81  14.925   3.745  -4.710
  604    HB3  LYS  81           HB1      LYS  81  14.833   1.993  -4.781
  605    HG2  LYS  81           HG2      LYS  81  12.462   2.029  -4.621
  606    HG3  LYS  81           HG1      LYS  81  12.455   3.767  -4.348
  607    HD2  LYS  81           HD2      LYS  81  13.422   2.398  -6.863
  608    HD3  LYS  81           HD1      LYS  81  11.863   3.208  -6.671
  609    HE2  LYS  81           HE2      LYS  81  13.056   5.326  -6.201
  610    HE3  LYS  81           HE1      LYS  81  14.586   4.491  -6.443
  611    HZ1  LYS  81           HZ1      LYS  81  12.486   4.872  -8.470
  612    HZ2  LYS  81           HZ2      LYS  81  13.940   4.031  -8.700
  613    HZ3  LYS  81           HZ3      LYS  81  13.963   5.686  -8.379
  614    H    ILE  82           HN       ILE  82  12.117   3.194  -1.999
  615    HA   ILE  82           HA       ILE  82  12.423   6.019  -1.746
  616    HB   ILE  82           HB       ILE  82  10.068   6.163  -1.038
  617   HG12  ILE  82          HG12      ILE  82   8.629   4.036  -1.350
  618   HG13  ILE  82          HG11      ILE  82  10.125   3.139  -1.158
  619   HG21  ILE  82          HG21      ILE  82  10.590   6.265  -3.361
  620   HG22  ILE  82          HG22      ILE  82   9.058   5.432  -3.134
  621   HG23  ILE  82          HG23      ILE  82  10.515   4.508  -3.499
  622   HD11  ILE  82          HD11      ILE  82   8.885   4.964   0.893
  623   HD12  ILE  82          HD12      ILE  82  10.371   4.038   1.102
  624   HD13  ILE  82          HD13      ILE  82   8.829   3.201   0.910
  625    H    ALA  83           HN       ALA  83  13.062   3.554   0.326
  626    HA   ALA  83           HA       ALA  83  12.631   5.071   2.732
  627    HB1  ALA  83           HB1      ALA  83  12.460   2.634   2.746
  628    HB2  ALA  83           HB2      ALA  83  13.690   3.193   3.870
  629    HB3  ALA  83           HB3      ALA  83  14.162   2.506   2.305
  630    H    GLY  84           HN       GLY  84  14.727   5.492   0.314
  631    HA2  GLY  84           HA2      GLY  84  16.514   6.955   0.196
  632    HA3  GLY  84           HA1      GLY  84  16.529   7.036   1.955
  633    H    LEU  85           HN       LEU  85  18.734   6.731   2.147
  634    HA   LEU  85           HA       LEU  85  19.793   4.205   1.158
  635    HB2  LEU  85           HB2      LEU  85  21.039   6.444   0.933
  636    HB3  LEU  85           HB1      LEU  85  21.237   6.412   2.667
  637    HG   LEU  85           HG       LEU  85  22.379   4.285   0.834
  638   HD11  LEU  85          HD11      LEU  85  23.694   6.762   1.936
  639   HD12  LEU  85          HD12      LEU  85  23.314   6.452   0.245
  640   HD13  LEU  85          HD13      LEU  85  24.516   5.464   1.073
  641   HD21  LEU  85          HD21      LEU  85  23.839   3.791   2.717
  642   HD22  LEU  85          HD22      LEU  85  22.145   3.663   3.213
  643   HD23  LEU  85          HD23      LEU  85  23.090   5.082   3.657
  644    H    GLU  86           HN       GLU  86  19.201   2.615   2.406
  645    HA   GLU  86           HA       GLU  86  19.657   2.704   5.283
  646    HB2  GLU  86           HB2      GLU  86  17.379   3.576   5.027
  647    HB3  GLU  86           HB1      GLU  86  16.953   2.164   4.065
  648    HG2  GLU  86           HG2      GLU  86  16.074   1.927   6.291
  649    HG3  GLU  86           HG1      GLU  86  17.347   0.741   6.017
  650    H    HIS  87           HN       HIS  87  18.238   0.887   2.616
  651    HA   HIS  87           HA       HIS  87  18.811  -1.655   3.811
  652    HB2  HIS  87           HB2      HIS  87  17.877  -0.917   1.044
  653    HB3  HIS  87           HB1      HIS  87  17.941  -2.555   1.677
  654    HD1  HIS  87           HD1      HIS  87  15.744   0.415   1.530
  655    HD2  HIS  87           HD2      HIS  87  16.084  -3.038   3.827
  656    HE1  HIS  87           HE1      HIS  87  13.552   0.157   2.758
  657    H    HIS  88           HN       HIS  88  19.998   0.211   1.070
  658    HA   HIS  88           HA       HIS  88  22.450  -1.360   1.140
  659    HB2  HIS  88           HB2      HIS  88  20.956  -2.039  -0.776
  660    HB3  HIS  88           HB1      HIS  88  21.022  -0.389  -1.361
  661    HD1  HIS  88           HD1      HIS  88  22.978  -3.553  -1.227
  662    HD2  HIS  88           HD2      HIS  88  23.462   0.346  -2.574
  663    HE1  HIS  88           HE1      HIS  88  24.981  -3.587  -2.754
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1   3.115  -0.214  14.004
    2    H2   MET   1           HT2      MET   1   3.836   0.712  12.777
    3    H3   MET   1           HT3      MET   1   2.656   1.377  13.732
    4    HA   MET   1           HA       MET   1   3.948   1.365  15.656
    5    HB2  MET   1           HB2      MET   1   6.208   0.286  13.959
    6    HB3  MET   1           HB1      MET   1   6.306   0.768  15.636
    7    HG2  MET   1           HG2      MET   1   6.266  -1.552  15.707
    8    HG3  MET   1           HG1      MET   1   4.608  -1.091  16.082
    9    HE1  MET   1           HE1      MET   1   7.067  -2.643  13.484
   10    HE2  MET   1           HE2      MET   1   6.519  -1.230  12.573
   11    HE3  MET   1           HE3      MET   1   6.054  -2.845  12.056
   12    H    VAL   2           HN       VAL   2   5.663   1.866  12.550
   13    HA   VAL   2           HA       VAL   2   6.343   4.527  13.530
   14    HB   VAL   2           HB       VAL   2   8.063   4.556  11.734
   15   HG11  VAL   2          HG11      VAL   2   8.636   3.882  13.988
   16   HG12  VAL   2          HG12      VAL   2   9.568   2.967  12.804
   17   HG13  VAL   2          HG13      VAL   2   8.191   2.215  13.619
   18   HG21  VAL   2          HG21      VAL   2   7.244   1.674  11.327
   19   HG22  VAL   2          HG22      VAL   2   8.637   2.459  10.582
   20   HG23  VAL   2          HG23      VAL   2   7.005   2.983  10.171
   21    H    THR   3           HN       THR   3   6.824   5.994  11.416
   22    HA   THR   3           HA       THR   3   4.425   6.956  10.497
   23    HB   THR   3           HB       THR   3   7.045   7.131   8.997
   24    HG1  THR   3           HG1      THR   3   6.176   8.269  11.433
   25   HG21  THR   3          HG21      THR   3   4.804   9.124   9.440
   26   HG22  THR   3          HG22      THR   3   5.071   8.201   7.964
   27   HG23  THR   3          HG23      THR   3   6.258   9.401   8.481
   28    H    ALA   4           HN       ALA   4   3.114   6.437   8.822
   29    HA   ALA   4           HA       ALA   4   3.345   3.975   7.481
   30    HB1  ALA   4           HB1      ALA   4   1.306   4.608   6.345
   31    HB2  ALA   4           HB2      ALA   4   1.506   6.277   6.875
   32    HB3  ALA   4           HB3      ALA   4   1.202   5.009   8.060
   33    H    ALA   5           HN       ALA   5   5.315   4.047   6.379
   34    HA   ALA   5           HA       ALA   5   5.834   5.878   4.261
   35    HB1  ALA   5           HB1      ALA   5   6.906   3.084   4.741
   36    HB2  ALA   5           HB2      ALA   5   7.636   4.588   5.292
   37    HB3  ALA   5           HB3      ALA   5   7.552   4.229   3.570
   38    H    LEU   6           HN       LEU   6   4.159   2.888   4.607
   39    HA   LEU   6           HA       LEU   6   3.243   3.038   1.825
   40    HB2  LEU   6           HB2      LEU   6   3.144   0.580   3.613
   41    HB3  LEU   6           HB1      LEU   6   2.696   0.710   1.926
   42    HG   LEU   6           HG       LEU   6   4.668  -0.525   2.011
   43   HD11  LEU   6          HD11      LEU   6   5.317   2.255   1.214
   44   HD12  LEU   6          HD12      LEU   6   4.574   0.987   0.223
   45   HD13  LEU   6          HD13      LEU   6   6.241   0.810   0.797
   46   HD21  LEU   6          HD21      LEU   6   5.887   1.654   3.678
   47   HD22  LEU   6          HD22      LEU   6   6.748   0.275   3.000
   48   HD23  LEU   6          HD23      LEU   6   5.509   0.005   4.201
   49    H    THR   7           HN       THR   7   1.274   3.903   1.833
   50    HA   THR   7           HA       THR   7  -0.447   3.473   4.167
   51    HB   THR   7           HB       THR   7  -0.982   5.254   1.793
   52    HG1  THR   7           HG1      THR   7   0.947   5.499   3.695
   53   HG21  THR   7          HG21      THR   7  -2.835   4.837   3.341
   54   HG22  THR   7          HG22      THR   7  -2.310   6.517   3.413
   55   HG23  THR   7          HG23      THR   7  -1.842   5.391   4.685
   56    H    ILE   8           HN       ILE   8  -1.638   1.641   3.887
   57    HA   ILE   8           HA       ILE   8  -2.341   0.878   1.151
   58    HB   ILE   8           HB       ILE   8  -2.197  -0.853   3.638
   59   HG12  ILE   8          HG12      ILE   8  -0.397  -0.703   1.213
   60   HG13  ILE   8          HG11      ILE   8   0.007  -0.139   2.829
   61   HG21  ILE   8          HG21      ILE   8  -3.908  -1.623   2.054
   62   HG22  ILE   8          HG22      ILE   8  -2.552  -2.749   2.139
   63   HG23  ILE   8          HG23      ILE   8  -2.705  -1.656   0.762
   64   HD11  ILE   8          HD11      ILE   8   1.042  -2.271   2.345
   65   HD12  ILE   8          HD12      ILE   8  -0.543  -2.979   2.022
   66   HD13  ILE   8          HD13      ILE   8  -0.132  -2.429   3.650
   67    H    TYR   9           HN       TYR   9  -4.350   0.748   0.566
   68    HA   TYR   9           HA       TYR   9  -6.385   1.521   2.477
   69    HB2  TYR   9           HB2      TYR   9  -6.341   1.345  -0.539
   70    HB3  TYR   9           HB1      TYR   9  -7.741   1.899   0.356
   71    HD1  TYR   9           HD2      TYR   9  -7.479   4.011   1.791
   72    HD2  TYR   9           HD1      TYR   9  -4.535   2.784  -1.022
   73    HE1  TYR   9           HE2      TYR   9  -6.478   6.256   1.857
   74    HE2  TYR   9           HE1      TYR   9  -3.528   5.015  -0.954
   75    HH   TYR   9           HH       TYR   9  -4.426   7.355   1.394
   76    H    THR  10           HN       THR  10  -7.616  -0.019   3.421
   77    HA   THR  10           HA       THR  10  -8.248  -2.436   1.929
   78    HB   THR  10           HB       THR  10  -7.975  -3.693   4.135
   79    HG1  THR  10           HG1      THR  10  -7.642  -1.669   5.346
   80   HG21  THR  10          HG21      THR  10  -6.449  -4.080   2.261
   81   HG22  THR  10          HG22      THR  10  -5.567  -4.118   3.787
   82   HG23  THR  10          HG23      THR  10  -5.477  -2.692   2.753
   83    H    THR  11           HN       THR  11 -10.145  -3.533   2.768
   84    HA   THR  11           HA       THR  11 -11.807  -2.029   4.647
   85    HB   THR  11           HB       THR  11 -13.730  -2.466   3.089
   86    HG1  THR  11           HG1      THR  11 -12.129  -2.637   0.878
   87   HG21  THR  11          HG21      THR  11 -13.309  -0.625   1.544
   88   HG22  THR  11          HG22      THR  11 -11.581  -0.736   1.867
   89   HG23  THR  11          HG23      THR  11 -12.672  -0.199   3.137
   90    H    SER  12           HN       SER  12 -13.889  -3.535   4.930
   91    HA   SER  12           HA       SER  12 -13.092  -6.160   5.507
   92    HB2  SER  12           HB2      SER  12 -15.641  -6.355   5.911
   93    HB3  SER  12           HB1      SER  12 -14.713  -5.255   6.925
   94    HG   SER  12           HG       SER  12 -15.760  -3.683   6.199
   95    H    TRP  13           HN       TRP  13 -13.652  -4.760   2.585
   96    HA   TRP  13           HA       TRP  13 -15.031  -6.998   1.334
   97    HB2  TRP  13           HB2      TRP  13 -13.789  -4.631  -0.090
   98    HB3  TRP  13           HB1      TRP  13 -15.094  -5.665  -0.645
   99    HD1  TRP  13           HD1      TRP  13 -17.005  -5.376   1.890
  100    HE1  TRP  13           HE1      TRP  13 -18.195  -3.160   2.327
  101    HE3  TRP  13           HE3      TRP  13 -14.001  -2.298  -0.867
  102    HZ2  TRP  13           HZ2      TRP  13 -17.919  -0.440   1.594
  103    HZ3  TRP  13           HZ3      TRP  13 -14.540   0.100  -0.955
  104    HH2  TRP  13           HH2      TRP  13 -16.456   1.008   0.251
  105    H    CYS  14           HN       CYS  14 -12.113  -6.546   2.541
  106    HA   CYS  14           HA       CYS  14 -10.556  -7.216   0.219
  107    HB2  CYS  14           HB2      CYS  14  -9.906  -6.232   2.922
  108    HB3  CYS  14           HB1      CYS  14  -8.681  -7.155   2.059
  109    H    GLY  15           HN       GLY  15 -10.396  -9.104  -0.377
  110    HA2  GLY  15           HA2      GLY  15  -9.685 -11.192   1.549
  111    HA3  GLY  15           HA1      GLY  15 -10.542 -11.491   0.025
  112    H    TYR  16           HN       TYR  16  -9.362 -10.242  -1.880
  113    HA   TYR  16           HA       TYR  16  -6.866 -11.542  -2.132
  114    HB2  TYR  16           HB2      TYR  16  -6.636 -10.524  -4.349
  115    HB3  TYR  16           HB1      TYR  16  -8.236 -11.197  -4.132
  116    HD1  TYR  16           HD2      TYR  16 -10.127  -9.550  -3.659
  117    HD2  TYR  16           HD1      TYR  16  -6.325  -8.269  -5.068
  118    HE1  TYR  16           HE2      TYR  16 -11.125  -7.432  -4.484
  119    HE2  TYR  16           HE1      TYR  16  -7.292  -6.238  -5.911
  120    HH   TYR  16           HH       TYR  16  -9.416  -5.380  -6.592
  121    H    CYS  17           HN       CYS  17  -7.640  -8.522  -0.833
  122    HA   CYS  17           HA       CYS  17  -5.239  -7.101  -1.257
  123    HB2  CYS  17           HB2      CYS  17  -6.904  -6.984   1.260
  124    HB3  CYS  17           HB1      CYS  17  -5.873  -5.730   0.611
  125    H    LEU  18           HN       LEU  18  -6.125  -9.716   0.908
  126    HA   LEU  18           HA       LEU  18  -4.207  -9.268   2.913
  127    HB2  LEU  18           HB2      LEU  18  -5.750 -11.712   2.196
  128    HB3  LEU  18           HB1      LEU  18  -4.833 -11.485   3.676
  129    HG   LEU  18           HG       LEU  18  -7.225  -9.863   2.818
  130   HD11  LEU  18          HD11      LEU  18  -6.816 -11.915   4.922
  131   HD12  LEU  18          HD12      LEU  18  -7.782 -12.089   3.445
  132   HD13  LEU  18          HD13      LEU  18  -8.283 -10.953   4.714
  133   HD21  LEU  18          HD21      LEU  18  -5.576  -9.756   5.346
  134   HD22  LEU  18          HD22      LEU  18  -7.102  -8.919   5.090
  135   HD23  LEU  18          HD23      LEU  18  -5.697  -8.489   4.122
  136    H    ARG  19           HN       ARG  19  -4.156 -10.965  -0.096
  137    HA   ARG  19           HA       ARG  19  -1.973 -12.693   0.403
  138    HB2  ARG  19           HB2      ARG  19  -2.912 -11.502  -2.207
  139    HB3  ARG  19           HB1      ARG  19  -1.782 -12.839  -2.062
  140    HG2  ARG  19           HG2      ARG  19  -4.651 -12.856  -1.136
  141    HG3  ARG  19           HG1      ARG  19  -4.021 -13.606  -2.605
  142    HD2  ARG  19           HD2      ARG  19  -3.165 -14.312   0.199
  143    HD3  ARG  19           HD1      ARG  19  -4.330 -15.220  -0.762
  144    HE   ARG  19           HE       ARG  19  -2.336 -15.277  -2.410
  145   HH11  ARG  19          HH11      ARG  19  -2.105 -15.644   1.126
  146   HH12  ARG  19          HH12      ARG  19  -0.825 -16.742   1.071
  147   HH21  ARG  19          HH21      ARG  19  -0.540 -16.800  -2.485
  148   HH22  ARG  19          HH22      ARG  19   0.119 -17.378  -1.031
  149    H    LEU  20           HN       LEU  20  -2.157  -9.377  -0.577
  150    HA   LEU  20           HA       LEU  20   0.666  -9.171  -1.037
  151    HB2  LEU  20           HB2      LEU  20  -0.750  -7.771  -2.340
  152    HB3  LEU  20           HB1      LEU  20  -1.578  -7.167  -0.920
  153    HG   LEU  20           HG       LEU  20   0.762  -6.190  -0.322
  154   HD11  LEU  20          HD11      LEU  20   1.095  -6.581  -3.280
  155   HD12  LEU  20          HD12      LEU  20   2.215  -7.081  -1.991
  156   HD13  LEU  20          HD13      LEU  20   1.968  -5.395  -2.343
  157   HD21  LEU  20          HD21      LEU  20  -1.170  -4.853  -0.684
  158   HD22  LEU  20          HD22      LEU  20  -1.059  -5.070  -2.421
  159   HD23  LEU  20          HD23      LEU  20   0.180  -4.129  -1.562
  160    H    LYS  21           HN       LYS  21  -1.716  -8.226   1.345
  161    HA   LYS  21           HA       LYS  21  -0.225  -6.628   3.040
  162    HB2  LYS  21           HB2      LYS  21  -2.705  -6.940   3.054
  163    HB3  LYS  21           HB1      LYS  21  -2.456  -8.504   3.815
  164    HG2  LYS  21           HG2      LYS  21  -1.407  -7.393   5.721
  165    HG3  LYS  21           HG1      LYS  21  -1.698  -5.834   4.963
  166    HD2  LYS  21           HD2      LYS  21  -4.115  -6.277   5.005
  167    HD3  LYS  21           HD1      LYS  21  -3.809  -7.824   5.798
  168    HE2  LYS  21           HE2      LYS  21  -3.133  -5.094   6.883
  169    HE3  LYS  21           HE1      LYS  21  -4.446  -6.136   7.435
  170    HZ1  LYS  21           HZ1      LYS  21  -1.539  -6.713   7.631
  171    HZ2  LYS  21           HZ2      LYS  21  -2.751  -7.770   8.087
  172    HZ3  LYS  21           HZ3      LYS  21  -2.564  -6.317   8.912
  173    H    THR  22           HN       THR  22  -0.900 -10.141   3.398
  174    HA   THR  22           HA       THR  22   0.703 -10.528   5.641
  175    HB   THR  22           HB       THR  22  -0.026 -12.558   3.515
  176    HG1  THR  22           HG1      THR  22  -1.977 -12.716   4.534
  177   HG21  THR  22          HG21      THR  22  -0.029 -14.128   5.410
  178   HG22  THR  22          HG22      THR  22   0.432 -12.817   6.500
  179   HG23  THR  22          HG23      THR  22   1.550 -13.355   5.244
  180    H    ALA  23           HN       ALA  23   1.454 -10.448   2.226
  181    HA   ALA  23           HA       ALA  23   4.047 -11.674   2.333
  182    HB1  ALA  23           HB1      ALA  23   4.347 -10.719   0.124
  183    HB2  ALA  23           HB2      ALA  23   2.928  -9.694   0.364
  184    HB3  ALA  23           HB3      ALA  23   2.743 -11.449   0.249
  185    H    LEU  24           HN       LEU  24   2.866  -8.407   2.621
  186    HA   LEU  24           HA       LEU  24   5.448  -7.255   2.741
  187    HB2  LEU  24           HB2      LEU  24   2.808  -6.207   3.727
  188    HB3  LEU  24           HB1      LEU  24   4.259  -5.233   3.544
  189    HG   LEU  24           HG       LEU  24   2.597  -6.505   1.375
  190   HD11  LEU  24          HD11      LEU  24   2.252  -4.219   0.636
  191   HD12  LEU  24          HD12      LEU  24   3.195  -3.634   2.004
  192   HD13  LEU  24          HD13      LEU  24   1.671  -4.483   2.279
  193   HD21  LEU  24          HD21      LEU  24   5.175  -4.974   1.076
  194   HD22  LEU  24          HD22      LEU  24   4.122  -5.482  -0.241
  195   HD23  LEU  24          HD23      LEU  24   4.943  -6.692   0.743
  196    H    THR  25           HN       THR  25   3.124  -8.349   5.172
  197    HA   THR  25           HA       THR  25   4.515  -7.698   7.480
  198    HB   THR  25           HB       THR  25   2.834 -10.164   6.927
  199    HG1  THR  25           HG1      THR  25   2.183  -7.599   7.873
  200   HG21  THR  25          HG21      THR  25   4.087 -10.330   9.055
  201   HG22  THR  25          HG22      THR  25   2.360 -10.132   9.352
  202   HG23  THR  25          HG23      THR  25   3.451  -8.759   9.542
  203    H    ALA  26           HN       ALA  26   4.768 -10.563   5.397
  204    HA   ALA  26           HA       ALA  26   6.753 -11.910   6.896
  205    HB1  ALA  26           HB1      ALA  26   5.341 -13.038   5.252
  206    HB2  ALA  26           HB2      ALA  26   7.053 -13.289   4.901
  207    HB3  ALA  26           HB3      ALA  26   6.120 -12.130   3.956
  208    H    ASN  27           HN       ASN  27   6.900  -9.599   4.302
  209    HA   ASN  27           HA       ASN  27   9.748  -9.754   3.946
  210    HB2  ASN  27           HB2      ASN  27   7.502  -8.285   2.786
  211    HB3  ASN  27           HB1      ASN  27   9.085  -7.489   2.608
  212   HD21  ASN  27          HD21      ASN  27   6.980 -10.036   1.680
  213   HD22  ASN  27          HD22      ASN  27   7.927 -10.683   0.401
  214    H    ARG  28           HN       ARG  28   8.139  -8.598   6.462
  215    HA   ARG  28           HA       ARG  28   8.546  -7.185   8.181
  216    HB2  ARG  28           HB2      ARG  28  11.319  -7.012   6.953
  217    HB3  ARG  28           HB1      ARG  28  10.893  -6.245   8.463
  218    HG2  ARG  28           HG2      ARG  28  12.024  -8.213   9.062
  219    HG3  ARG  28           HG1      ARG  28  10.324  -8.592   9.301
  220    HD2  ARG  28           HD2      ARG  28  11.466 -10.449   8.225
  221    HD3  ARG  28           HD1      ARG  28  10.293  -9.732   7.120
  222    HE   ARG  28           HE       ARG  28  12.918  -8.636   6.831
  223   HH11  ARG  28          HH11      ARG  28  10.789 -11.283   5.769
  224   HH12  ARG  28          HH12      ARG  28  11.718 -11.662   4.401
  225   HH21  ARG  28          HH21      ARG  28  14.153  -9.142   4.907
  226   HH22  ARG  28          HH22      ARG  28  13.646 -10.400   3.888
  227    H    ILE  29           HN       ILE  29   7.466  -6.131   5.686
  228    HA   ILE  29           HA       ILE  29   8.564  -3.463   5.514
  229    HB   ILE  29           HB       ILE  29   6.319  -4.839   3.989
  230   HG12  ILE  29          HG12      ILE  29   9.089  -3.963   3.104
  231   HG13  ILE  29          HG11      ILE  29   8.611  -5.613   3.474
  232   HG21  ILE  29          HG21      ILE  29   5.822  -2.455   4.165
  233   HG22  ILE  29          HG22      ILE  29   6.281  -2.877   2.514
  234   HG23  ILE  29          HG23      ILE  29   7.436  -2.066   3.573
  235   HD11  ILE  29          HD11      ILE  29   7.513  -3.915   1.250
  236   HD12  ILE  29          HD12      ILE  29   7.094  -5.601   1.592
  237   HD13  ILE  29          HD13      ILE  29   8.729  -5.182   1.090
  238    H    ALA  30           HN       ALA  30   7.820  -1.772   6.570
  239    HA   ALA  30           HA       ALA  30   5.673  -2.208   8.457
  240    HB1  ALA  30           HB1      ALA  30   7.786  -1.256   9.250
  241    HB2  ALA  30           HB2      ALA  30   6.459  -0.119   9.484
  242    HB3  ALA  30           HB3      ALA  30   7.587   0.111   8.157
  243    H    TYR  31           HN       TYR  31   3.656  -1.588   8.011
  244    HA   TYR  31           HA       TYR  31   3.169   0.669   6.195
  245    HB2  TYR  31           HB2      TYR  31   1.579  -0.627   4.873
  246    HB3  TYR  31           HB1      TYR  31   3.167  -1.380   4.784
  247    HD1  TYR  31           HD1      TYR  31  -0.268  -1.705   6.058
  248    HD2  TYR  31           HD2      TYR  31   3.546  -3.585   5.807
  249    HE1  TYR  31           HE1      TYR  31  -1.257  -3.804   6.829
  250    HE2  TYR  31           HE2      TYR  31   2.542  -5.705   6.576
  251    HH   TYR  31           HH       TYR  31   0.655  -6.394   7.854
  252    H    ASP  32           HN       ASP  32   0.935   1.331   6.177
  253    HA   ASP  32           HA       ASP  32  -0.522   0.605   8.610
  254    HB2  ASP  32           HB2      ASP  32   0.522   2.818   8.918
  255    HB3  ASP  32           HB1      ASP  32  -0.214   3.369   7.418
  256    H    GLU  33           HN       GLU  33  -2.510  -0.051   8.172
  257    HA   GLU  33           HA       GLU  33  -3.486   0.558   5.541
  258    HB2  GLU  33           HB2      GLU  33  -5.118  -1.436   6.025
  259    HB3  GLU  33           HB1      GLU  33  -3.475  -1.742   5.516
  260    HG2  GLU  33           HG2      GLU  33  -3.970  -3.287   7.217
  261    HG3  GLU  33           HG1      GLU  33  -2.904  -2.091   7.940
  262    H    VAL  34           HN       VAL  34  -5.353   1.422   5.130
  263    HA   VAL  34           HA       VAL  34  -6.053   3.218   7.251
  264    HB   VAL  34           HB       VAL  34  -7.052   3.369   4.409
  265   HG11  VAL  34          HG11      VAL  34  -6.780   5.489   6.545
  266   HG12  VAL  34          HG12      VAL  34  -8.272   4.716   6.023
  267   HG13  VAL  34          HG13      VAL  34  -7.384   5.745   4.900
  268   HG21  VAL  34          HG21      VAL  34  -4.581   4.598   5.629
  269   HG22  VAL  34          HG22      VAL  34  -5.200   4.934   4.013
  270   HG23  VAL  34          HG23      VAL  34  -4.621   3.316   4.420
  271    H    ASP  35           HN       ASP  35  -7.728   3.505   8.271
  272    HA   ASP  35           HA       ASP  35  -9.725   1.757   8.972
  273    HB2  ASP  35           HB2      ASP  35  -9.623   4.751   9.272
  274    HB3  ASP  35           HB1      ASP  35 -10.663   3.681  10.187
  275    H    ILE  36           HN       ILE  36  -9.769   3.065   6.033
  276    HA   ILE  36           HA       ILE  36 -11.661   4.990   5.567
  277    HB   ILE  36           HB       ILE  36 -11.980   4.090   3.291
  278   HG12  ILE  36          HG12      ILE  36 -10.061   1.958   4.202
  279   HG13  ILE  36          HG11      ILE  36 -11.771   1.706   3.882
  280   HG21  ILE  36          HG21      ILE  36 -10.211   5.642   3.800
  281   HG22  ILE  36          HG22      ILE  36  -9.732   4.480   2.566
  282   HG23  ILE  36          HG23      ILE  36  -9.139   4.298   4.222
  283   HD11  ILE  36          HD11      ILE  36 -11.439   2.262   1.561
  284   HD12  ILE  36          HD12      ILE  36 -10.297   0.993   2.039
  285   HD13  ILE  36          HD13      ILE  36  -9.765   2.684   1.907
  286    H    GLU  37           HN       GLU  37 -12.597   1.647   6.148
  287    HA   GLU  37           HA       GLU  37 -14.985   1.915   4.652
  288    HB2  GLU  37           HB2      GLU  37 -15.671  -0.217   5.544
  289    HB3  GLU  37           HB1      GLU  37 -13.995  -0.232   5.025
  290    HG2  GLU  37           HG2      GLU  37 -13.227  -0.169   7.280
  291    HG3  GLU  37           HG1      GLU  37 -14.878   0.029   7.880
  292    H    HIS  38           HN       HIS  38 -14.203   3.099   7.697
  293    HA   HIS  38           HA       HIS  38 -17.080   3.481   8.189
  294    HB2  HIS  38           HB2      HIS  38 -15.812   2.193   9.963
  295    HB3  HIS  38           HB1      HIS  38 -14.885   3.662  10.259
  296    HD1  HIS  38           HD1      HIS  38 -15.845   5.192  12.047
  297    HD2  HIS  38           HD2      HIS  38 -18.667   2.584  10.464
  298    HE1  HIS  38           HE1      HIS  38 -17.930   5.525  13.393
  299    H    ASN  39           HN       ASN  39 -14.436   5.049   6.988
  300    HA   ASN  39           HA       ASN  39 -15.526   7.586   7.840
  301    HB2  ASN  39           HB2      ASN  39 -13.229   8.609   7.990
  302    HB3  ASN  39           HB1      ASN  39 -13.665   7.513   9.295
  303   HD21  ASN  39          HD21      ASN  39 -11.399   8.241   6.773
  304   HD22  ASN  39          HD22      ASN  39 -10.408   6.900   7.104
  305    H    ARG  40           HN       ARG  40 -16.291   8.562   6.356
  306    HA   ARG  40           HA       ARG  40 -16.133   8.067   3.667
  307    HB2  ARG  40           HB2      ARG  40 -17.315  10.200   3.350
  308    HB3  ARG  40           HB1      ARG  40 -17.992   9.234   4.648
  309    HG2  ARG  40           HG2      ARG  40 -16.848  10.649   6.305
  310    HG3  ARG  40           HG1      ARG  40 -16.156  11.594   4.998
  311    HD2  ARG  40           HD2      ARG  40 -19.114  11.293   5.476
  312    HD3  ARG  40           HD1      ARG  40 -18.140  12.628   6.085
  313    HE   ARG  40           HE       ARG  40 -18.030  12.152   3.234
  314   HH11  ARG  40          HH11      ARG  40 -19.391  14.099   5.868
  315   HH12  ARG  40          HH12      ARG  40 -20.009  15.313   4.853
  316   HH21  ARG  40          HH21      ARG  40 -18.835  13.869   1.830
  317   HH22  ARG  40          HH22      ARG  40 -19.684  15.178   2.500
  318    H    ALA  41           HN       ALA  41 -14.198  10.384   5.492
  319    HA   ALA  41           HA       ALA  41 -13.307  12.039   3.453
  320    HB1  ALA  41           HB1      ALA  41 -11.497  12.659   4.914
  321    HB2  ALA  41           HB2      ALA  41 -11.754  11.212   5.890
  322    HB3  ALA  41           HB3      ALA  41 -12.990  12.474   5.829
  323    H    ALA  42           HN       ALA  42 -11.714   9.157   4.673
  324    HA   ALA  42           HA       ALA  42  -9.750   9.377   2.564
  325    HB1  ALA  42           HB1      ALA  42  -8.948   8.796   4.753
  326    HB2  ALA  42           HB2      ALA  42  -8.679   7.434   3.659
  327    HB3  ALA  42           HB3      ALA  42 -10.012   7.401   4.821
  328    H    ALA  43           HN       ALA  43 -12.637   7.574   3.280
  329    HA   ALA  43           HA       ALA  43 -12.208   5.406   1.512
  330    HB1  ALA  43           HB1      ALA  43 -13.931   5.376   3.264
  331    HB2  ALA  43           HB2      ALA  43 -14.607   5.024   1.673
  332    HB3  ALA  43           HB3      ALA  43 -14.822   6.621   2.395
  333    H    GLU  44           HN       GLU  44 -13.598   8.588   1.119
  334    HA   GLU  44           HA       GLU  44 -14.506   8.173  -1.537
  335    HB2  GLU  44           HB2      GLU  44 -15.208   9.945   0.213
  336    HB3  GLU  44           HB1      GLU  44 -13.788  10.824  -0.328
  337    HG2  GLU  44           HG2      GLU  44 -15.728  11.659  -1.471
  338    HG3  GLU  44           HG1      GLU  44 -14.698  10.804  -2.621
  339    H    PHE  45           HN       PHE  45 -11.528   9.121  -0.043
  340    HA   PHE  45           HA       PHE  45 -10.248  10.241  -2.307
  341    HB2  PHE  45           HB2      PHE  45  -9.499  10.735  -0.025
  342    HB3  PHE  45           HB1      PHE  45  -9.088   9.048   0.224
  343    HD1  PHE  45           HD2      PHE  45  -8.323  11.770  -2.212
  344    HD2  PHE  45           HD1      PHE  45  -6.854   8.523   0.110
  345    HE1  PHE  45           HE2      PHE  45  -6.048  12.228  -3.016
  346    HE2  PHE  45           HE1      PHE  45  -4.576   8.978  -0.691
  347    HZ   PHE  45           HZ       PHE  45  -4.170  10.830  -2.254
  348    H    VAL  46           HN       VAL  46 -10.646   7.000  -1.121
  349    HA   VAL  46           HA       VAL  46  -8.686   5.688  -2.674
  350    HB   VAL  46           HB       VAL  46 -11.370   4.556  -1.807
  351   HG11  VAL  46          HG11      VAL  46  -8.780   3.183  -2.494
  352   HG12  VAL  46          HG12      VAL  46 -10.248   3.156  -3.465
  353   HG13  VAL  46          HG13      VAL  46 -10.218   2.376  -1.874
  354   HG21  VAL  46          HG21      VAL  46 -10.203   3.709   0.155
  355   HG22  VAL  46          HG22      VAL  46 -10.159   5.471   0.094
  356   HG23  VAL  46          HG23      VAL  46  -8.731   4.532  -0.355
  357    H    GLY  47           HN       GLY  47 -11.892   6.830  -3.386
  358    HA2  GLY  47           HA2      GLY  47 -12.122   5.517  -5.925
  359    HA3  GLY  47           HA1      GLY  47 -13.125   6.844  -5.341
  360    H    SER  48           HN       SER  48 -11.097   8.673  -4.777
  361    HA   SER  48           HA       SER  48 -10.807   9.974  -7.232
  362    HB2  SER  48           HB2      SER  48  -9.293  10.466  -4.668
  363    HB3  SER  48           HB1      SER  48  -9.599  11.625  -5.964
  364    HG   SER  48           HG       SER  48 -11.907  10.905  -5.492
  365    H    VAL  49           HN       VAL  49  -8.641   7.780  -5.527
  366    HA   VAL  49           HA       VAL  49  -6.486   8.483  -7.344
  367    HB   VAL  49           HB       VAL  49  -5.049   6.922  -6.074
  368   HG11  VAL  49          HG11      VAL  49  -6.529   8.933  -4.397
  369   HG12  VAL  49          HG12      VAL  49  -5.141   9.247  -5.438
  370   HG13  VAL  49          HG13      VAL  49  -4.956   8.236  -4.006
  371   HG21  VAL  49          HG21      VAL  49  -5.860   5.959  -3.955
  372   HG22  VAL  49          HG22      VAL  49  -6.739   5.312  -5.343
  373   HG23  VAL  49          HG23      VAL  49  -7.484   6.542  -4.322
  374    H    ASN  50           HN       ASN  50  -9.034   6.447  -7.527
  375    HA   ASN  50           HA       ASN  50  -7.499   4.659  -9.275
  376    HB2  ASN  50           HB2      ASN  50  -9.909   3.960  -7.620
  377    HB3  ASN  50           HB1      ASN  50  -9.402   2.978  -8.988
  378   HD21  ASN  50          HD21      ASN  50  -8.760   3.861  -5.721
  379   HD22  ASN  50          HD22      ASN  50  -7.468   2.727  -5.479
  380    H    GLY  51           HN       GLY  51 -10.368   6.613  -9.041
  381    HA2  GLY  51           HA2      GLY  51 -11.037   7.705 -11.086
  382    HA3  GLY  51           HA1      GLY  51 -10.666   6.210 -11.935
  383    H    GLY  52           HN       GLY  52 -12.672   7.280  -9.199
  384    HA2  GLY  52           HA2      GLY  52 -15.034   7.248  -9.192
  385    HA3  GLY  52           HA1      GLY  52 -14.987   6.184 -10.574
  386    H    ASN  53           HN       ASN  53 -13.350   4.244  -9.692
  387    HA   ASN  53           HA       ASN  53 -15.183   2.826  -7.918
  388    HB2  ASN  53           HB2      ASN  53 -12.854   1.776  -9.543
  389    HB3  ASN  53           HB1      ASN  53 -13.950   0.790  -8.586
  390   HD21  ASN  53          HD21      ASN  53 -13.512   2.584 -11.518
  391   HD22  ASN  53          HD22      ASN  53 -14.975   2.067 -12.267
  392    H    ARG  54           HN       ARG  54 -14.422   1.598  -6.147
  393    HA   ARG  54           HA       ARG  54 -12.022   2.755  -4.982
  394    HB2  ARG  54           HB2      ARG  54 -14.422   1.480  -3.656
  395    HB3  ARG  54           HB1      ARG  54 -12.996   1.978  -2.776
  396    HG2  ARG  54           HG2      ARG  54 -13.369   4.296  -3.512
  397    HG3  ARG  54           HG1      ARG  54 -14.816   3.773  -4.366
  398    HD2  ARG  54           HD2      ARG  54 -15.760   2.997  -2.216
  399    HD3  ARG  54           HD1      ARG  54 -14.324   3.621  -1.398
  400    HE   ARG  54           HE       ARG  54 -15.042   5.804  -2.549
  401   HH11  ARG  54          HH11      ARG  54 -17.278   3.426  -1.114
  402   HH12  ARG  54          HH12      ARG  54 -18.461   4.584  -0.758
  403   HH21  ARG  54          HH21      ARG  54 -16.738   7.378  -2.066
  404   HH22  ARG  54          HH22      ARG  54 -18.140   6.846  -1.284
  405    H    THR  55           HN       THR  55 -10.704   1.391  -6.169
  406    HA   THR  55           HA       THR  55 -10.846  -1.428  -5.957
  407    HB   THR  55           HB       THR  55  -8.420   0.226  -6.672
  408    HG1  THR  55           HG1      THR  55  -9.358   0.000  -8.855
  409   HG21  THR  55          HG21      THR  55  -7.962  -1.700  -8.131
  410   HG22  THR  55          HG22      THR  55  -9.457  -2.465  -7.594
  411   HG23  THR  55          HG23      THR  55  -8.140  -2.213  -6.452
  412    H    VAL  56           HN       VAL  56 -10.056  -2.663  -4.365
  413    HA   VAL  56           HA       VAL  56  -8.845  -1.165  -2.693
  414    HB   VAL  56           HB       VAL  56  -9.025  -2.706  -0.625
  415   HG11  VAL  56          HG11      VAL  56  -9.372  -0.446  -0.771
  416   HG12  VAL  56          HG12      VAL  56 -10.830  -1.163  -0.054
  417   HG13  VAL  56          HG13      VAL  56 -10.840  -0.598  -1.741
  418   HG21  VAL  56          HG21      VAL  56 -11.369  -3.249  -2.414
  419   HG22  VAL  56          HG22      VAL  56 -11.394  -3.361  -0.635
  420   HG23  VAL  56          HG23      VAL  56 -10.268  -4.359  -1.553
  421    HA   PRO  57           HA       PRO  57  -5.600  -2.685  -1.155
  422    HB2  PRO  57           HB2      PRO  57  -3.650  -4.286  -2.297
  423    HB3  PRO  57           HB1      PRO  57  -4.987  -4.862  -1.293
  424    HG2  PRO  57           HG2      PRO  57  -4.809  -4.711  -4.278
  425    HG3  PRO  57           HG1      PRO  57  -5.468  -6.010  -3.268
  426    HD2  PRO  57           HD2      PRO  57  -7.009  -4.144  -4.508
  427    HD3  PRO  57           HD1      PRO  57  -7.422  -5.015  -3.007
  428    H    THR  58           HN       THR  58  -5.386  -0.510  -2.047
  429    HA   THR  58           HA       THR  58  -3.448   0.017  -4.150
  430    HB   THR  58           HB       THR  58  -5.430   1.863  -2.788
  431    HG1  THR  58           HG1      THR  58  -6.741   0.519  -3.930
  432   HG21  THR  58          HG21      THR  58  -3.578   3.047  -3.915
  433   HG22  THR  58          HG22      THR  58  -5.104   3.269  -4.789
  434   HG23  THR  58          HG23      THR  58  -3.912   2.129  -5.390
  435    H    VAL  59           HN       VAL  59  -1.533   0.857  -3.567
  436    HA   VAL  59           HA       VAL  59  -1.244   1.641  -0.768
  437    HB   VAL  59           HB       VAL  59   0.045  -0.429  -1.266
  438   HG11  VAL  59          HG11      VAL  59   1.346   1.213  -3.340
  439   HG12  VAL  59          HG12      VAL  59   0.342  -0.216  -3.584
  440   HG13  VAL  59          HG13      VAL  59   1.926  -0.363  -2.782
  441   HG21  VAL  59          HG21      VAL  59   2.256   0.304  -0.513
  442   HG22  VAL  59          HG22      VAL  59   0.978   1.129   0.383
  443   HG23  VAL  59          HG23      VAL  59   1.834   1.974  -0.901
  444    H    LYS  60           HN       LYS  60  -0.565   3.569  -0.377
  445    HA   LYS  60           HA       LYS  60   0.440   5.197  -2.591
  446    HB2  LYS  60           HB2      LYS  60  -1.535   6.125  -1.479
  447    HB3  LYS  60           HB1      LYS  60  -0.742   5.986   0.076
  448    HG2  LYS  60           HG2      LYS  60   0.886   7.661  -0.555
  449    HG3  LYS  60           HG1      LYS  60   0.179   7.771  -2.165
  450    HD2  LYS  60           HD2      LYS  60  -0.569   9.618  -0.732
  451    HD3  LYS  60           HD1      LYS  60  -1.913   8.584  -1.214
  452    HE2  LYS  60           HE2      LYS  60  -2.089   9.231   1.130
  453    HE3  LYS  60           HE1      LYS  60  -1.870   7.496   0.981
  454    HZ1  LYS  60           HZ1      LYS  60   0.442   7.744   1.637
  455    HZ2  LYS  60           HZ2      LYS  60  -0.492   8.532   2.777
  456    HZ3  LYS  60           HZ3      LYS  60   0.323   9.406   1.608
  457    H    PHE  61           HN       PHE  61   2.511   5.501  -2.641
  458    HA   PHE  61           HA       PHE  61   4.162   4.791  -0.351
  459    HB2  PHE  61           HB2      PHE  61   4.794   5.433  -3.228
  460    HB3  PHE  61           HB1      PHE  61   6.041   5.278  -2.004
  461    HD1  PHE  61           HD2      PHE  61   3.416   3.451  -3.861
  462    HD2  PHE  61           HD1      PHE  61   6.777   3.165  -1.267
  463    HE1  PHE  61           HE2      PHE  61   3.540   1.009  -4.261
  464    HE2  PHE  61           HE1      PHE  61   6.898   0.780  -1.664
  465    HZ   PHE  61           HZ       PHE  61   5.260  -0.317  -3.168
  466    H    ALA  62           HN       ALA  62   5.997   6.199   0.141
  467    HA   ALA  62           HA       ALA  62   5.268   8.891   0.638
  468    HB1  ALA  62           HB1      ALA  62   7.997   7.603   0.748
  469    HB2  ALA  62           HB2      ALA  62   6.830   7.641   2.071
  470    HB3  ALA  62           HB3      ALA  62   7.549   9.141   1.480
  471    H    ASP  63           HN       ASP  63   6.361   7.369  -2.074
  472    HA   ASP  63           HA       ASP  63   7.953   9.356  -3.372
  473    HB2  ASP  63           HB2      ASP  63   7.953   6.974  -4.031
  474    HB3  ASP  63           HB1      ASP  63   6.271   7.104  -4.511
  475    H    GLY  64           HN       GLY  64   4.588   8.987  -2.770
  476    HA2  GLY  64           HA2      GLY  64   3.022  10.727  -3.098
  477    HA3  GLY  64           HA1      GLY  64   3.980  11.303  -4.458
  478    H    SER  65           HN       SER  65   4.262   8.448  -5.330
  479    HA   SER  65           HA       SER  65   1.963   8.397  -7.048
  480    HB2  SER  65           HB2      SER  65   4.237   6.415  -6.781
  481    HB3  SER  65           HB1      SER  65   3.119   6.555  -8.135
  482    HG   SER  65           HG       SER  65   5.325   8.114  -7.459
  483    H    THR  66           HN       THR  66   0.417   6.690  -7.134
  484    HA   THR  66           HA       THR  66   0.343   4.987  -4.758
  485    HB   THR  66           HB       THR  66  -2.109   4.847  -5.098
  486    HG1  THR  66           HG1      THR  66  -1.787   6.905  -7.024
  487   HG21  THR  66          HG21      THR  66  -2.713   7.136  -4.420
  488   HG22  THR  66          HG22      THR  66  -1.126   7.701  -4.941
  489   HG23  THR  66          HG23      THR  66  -1.259   6.580  -3.586
  490    H    LEU  67           HN       LEU  67   0.130   2.850  -5.108
  491    HA   LEU  67           HA       LEU  67  -0.041   2.005  -7.895
  492    HB2  LEU  67           HB2      LEU  67   1.678   0.915  -5.693
  493    HB3  LEU  67           HB1      LEU  67   1.181  -0.117  -7.012
  494    HG   LEU  67           HG       LEU  67   2.248   1.520  -8.572
  495   HD11  LEU  67          HD11      LEU  67   3.492   2.709  -6.097
  496   HD12  LEU  67          HD12      LEU  67   2.363   3.485  -7.200
  497   HD13  LEU  67          HD13      LEU  67   3.961   3.027  -7.765
  498   HD21  LEU  67          HD21      LEU  67   3.981   0.084  -6.589
  499   HD22  LEU  67          HD22      LEU  67   4.521   0.705  -8.159
  500   HD23  LEU  67          HD23      LEU  67   3.295  -0.554  -8.084
  501    H    THR  68           HN       THR  68  -1.828   1.082  -8.331
  502    HA   THR  68           HA       THR  68  -3.430  -0.012  -6.222
  503    HB   THR  68           HB       THR  68  -3.935   0.217  -9.190
  504    HG1  THR  68           HG1      THR  68  -5.409   1.886  -7.741
  505   HG21  THR  68          HG21      THR  68  -5.330  -1.457  -8.069
  506   HG22  THR  68          HG22      THR  68  -6.287  -0.054  -8.546
  507   HG23  THR  68          HG23      THR  68  -5.806  -0.262  -6.864
  508    H    ASN  69           HN       ASN  69  -2.992  -1.991  -5.615
  509    HA   ASN  69           HA       ASN  69  -2.466  -4.147  -5.532
  510    HB2  ASN  69           HB2      ASN  69  -4.626  -4.221  -6.841
  511    HB3  ASN  69           HB1      ASN  69  -3.672  -4.321  -8.310
  512   HD21  ASN  69          HD21      ASN  69  -5.603  -6.210  -7.353
  513   HD22  ASN  69          HD22      ASN  69  -4.760  -7.705  -7.118
  514    HA   PRO  70           HA       PRO  70   1.367  -4.272  -8.118
  515    HB2  PRO  70           HB2      PRO  70   3.189  -3.428  -6.422
  516    HB3  PRO  70           HB1      PRO  70   2.087  -2.237  -7.132
  517    HG2  PRO  70           HG2      PRO  70   1.964  -3.562  -4.451
  518    HG3  PRO  70           HG1      PRO  70   1.777  -1.829  -4.829
  519    HD2  PRO  70           HD2      PRO  70  -0.337  -3.602  -4.481
  520    HD3  PRO  70           HD1      PRO  70  -0.435  -2.104  -5.423
  521    H    SER  71           HN       SER  71   3.508  -5.537  -7.329
  522    HA   SER  71           HA       SER  71   2.578  -7.752  -5.680
  523    HB2  SER  71           HB2      SER  71   3.564  -8.145  -7.989
  524    HB3  SER  71           HB1      SER  71   5.101  -7.592  -7.311
  525    HG   SER  71           HG       SER  71   4.063  -9.979  -7.254
  526    H    ALA  72           HN       ALA  72   4.274  -8.697  -4.241
  527    HA   ALA  72           HA       ALA  72   4.904  -6.798  -2.249
  528    HB1  ALA  72           HB1      ALA  72   4.327  -9.103  -1.768
  529    HB2  ALA  72           HB2      ALA  72   5.895  -8.681  -1.056
  530    HB3  ALA  72           HB3      ALA  72   5.817  -9.629  -2.547
  531    H    ASP  73           HN       ASP  73   6.913  -8.557  -4.549
  532    HA   ASP  73           HA       ASP  73   9.439  -7.711  -3.653
  533    HB2  ASP  73           HB2      ASP  73   9.288  -9.525  -5.223
  534    HB3  ASP  73           HB1      ASP  73   8.497  -8.492  -6.408
  535    H    GLU  74           HN       GLU  74   7.130  -6.255  -5.791
  536    HA   GLU  74           HA       GLU  74   8.809  -4.181  -6.749
  537    HB2  GLU  74           HB2      GLU  74   5.805  -4.278  -6.619
  538    HB3  GLU  74           HB1      GLU  74   6.773  -3.203  -7.622
  539    HG2  GLU  74           HG2      GLU  74   7.649  -5.124  -8.834
  540    HG3  GLU  74           HG1      GLU  74   6.665  -6.196  -7.838
  541    H    VAL  75           HN       VAL  75   6.431  -4.458  -4.155
  542    HA   VAL  75           HA       VAL  75   6.521  -1.792  -3.318
  543    HB   VAL  75           HB       VAL  75   6.052  -4.258  -1.591
  544   HG11  VAL  75          HG11      VAL  75   5.368  -1.367  -1.027
  545   HG12  VAL  75          HG12      VAL  75   6.620  -2.308  -0.221
  546   HG13  VAL  75          HG13      VAL  75   4.924  -2.746  -0.020
  547   HG21  VAL  75          HG21      VAL  75   4.465  -4.082  -3.427
  548   HG22  VAL  75          HG22      VAL  75   4.094  -2.420  -2.964
  549   HG23  VAL  75          HG23      VAL  75   3.668  -3.750  -1.887
  550    H    LYS  76           HN       LYS  76   8.487  -4.551  -2.439
  551    HA   LYS  76           HA       LYS  76  10.151  -3.330  -0.544
  552    HB2  LYS  76           HB2      LYS  76  10.040  -5.721  -0.811
  553    HB3  LYS  76           HB1      LYS  76  10.654  -5.620  -2.457
  554    HG2  LYS  76           HG2      LYS  76  12.813  -4.825  -1.531
  555    HG3  LYS  76           HG1      LYS  76  12.163  -5.047   0.094
  556    HD2  LYS  76           HD2      LYS  76  11.801  -7.433  -0.370
  557    HD3  LYS  76           HD1      LYS  76  12.430  -7.212  -2.000
  558    HE2  LYS  76           HE2      LYS  76  14.133  -8.181  -0.608
  559    HE3  LYS  76           HE1      LYS  76  14.596  -6.537  -1.026
  560    HZ1  LYS  76           HZ1      LYS  76  13.373  -7.371   1.544
  561    HZ2  LYS  76           HZ2      LYS  76  13.866  -5.811   1.168
  562    HZ3  LYS  76           HZ3      LYS  76  15.007  -7.043   1.306
  563    H    ALA  77           HN       ALA  77  10.481  -3.563  -4.085
  564    HA   ALA  77           HA       ALA  77  13.038  -2.247  -4.152
  565    HB1  ALA  77           HB1      ALA  77  12.830  -2.351  -6.564
  566    HB2  ALA  77           HB2      ALA  77  11.118  -2.760  -6.423
  567    HB3  ALA  77           HB3      ALA  77  12.345  -3.895  -5.862
  568    H    LYS  78           HN       LYS  78   9.763  -1.141  -4.301
  569    HA   LYS  78           HA       LYS  78  10.551   1.561  -5.101
  570    HB2  LYS  78           HB2      LYS  78   7.942   0.469  -4.052
  571    HB3  LYS  78           HB1      LYS  78   8.182   2.106  -4.654
  572    HG2  LYS  78           HG2      LYS  78   8.571  -0.384  -6.291
  573    HG3  LYS  78           HG1      LYS  78   7.058   0.510  -6.204
  574    HD2  LYS  78           HD2      LYS  78   8.161   2.477  -7.134
  575    HD3  LYS  78           HD1      LYS  78   9.703   1.619  -7.172
  576    HE2  LYS  78           HE2      LYS  78   8.790   0.002  -8.743
  577    HE3  LYS  78           HE1      LYS  78   7.212   0.777  -8.653
  578    HZ1  LYS  78           HZ1      LYS  78   9.687   2.047  -9.716
  579    HZ2  LYS  78           HZ2      LYS  78   8.146   2.741  -9.671
  580    HZ3  LYS  78           HZ3      LYS  78   8.433   1.407 -10.633
  581    H    LEU  79           HN       LEU  79  10.122  -0.278  -2.224
  582    HA   LEU  79           HA       LEU  79   9.833   1.869  -0.470
  583    HB2  LEU  79           HB2      LEU  79   9.380  -0.598   0.078
  584    HB3  LEU  79           HB1      LEU  79  11.105  -0.791   0.126
  585    HG   LEU  79           HG       LEU  79  11.164   0.885   1.981
  586   HD11  LEU  79          HD11      LEU  79   9.127   2.060   1.845
  587   HD12  LEU  79          HD12      LEU  79   9.009   1.053   3.279
  588   HD13  LEU  79          HD13      LEU  79   8.225   0.557   1.782
  589   HD21  LEU  79          HD21      LEU  79  10.468  -0.730   3.682
  590   HD22  LEU  79          HD22      LEU  79  11.389  -1.498   2.389
  591   HD23  LEU  79          HD23      LEU  79   9.632  -1.664   2.442
  592    H    VAL  80           HN       VAL  80  12.575   0.083  -1.704
  593    HA   VAL  80           HA       VAL  80  14.514   1.247  -0.082
  594    HB   VAL  80           HB       VAL  80  16.214   0.444  -1.627
  595   HG11  VAL  80          HG11      VAL  80  15.297  -1.132  -0.069
  596   HG12  VAL  80          HG12      VAL  80  15.662  -1.945  -1.593
  597   HG13  VAL  80          HG13      VAL  80  13.997  -1.531  -1.191
  598   HG21  VAL  80          HG21      VAL  80  13.941  -0.264  -3.472
  599   HG22  VAL  80          HG22      VAL  80  15.616  -0.772  -3.678
  600   HG23  VAL  80          HG23      VAL  80  15.193   0.943  -3.761
  601    H    LYS  81           HN       LYS  81  13.104   2.444  -3.048
  602    HA   LYS  81           HA       LYS  81  15.107   4.496  -3.243
  603    HB2  LYS  81           HB2      LYS  81  13.889   5.396  -5.118
  604    HB3  LYS  81           HB1      LYS  81  13.962   3.651  -5.279
  605    HG2  LYS  81           HG2      LYS  81  11.664   3.458  -4.503
  606    HG3  LYS  81           HG1      LYS  81  11.591   5.201  -4.278
  607    HD2  LYS  81           HD2      LYS  81  12.010   3.789  -6.916
  608    HD3  LYS  81           HD1      LYS  81  10.491   4.485  -6.362
  609    HE2  LYS  81           HE2      LYS  81  13.054   6.006  -6.900
  610    HE3  LYS  81           HE1      LYS  81  11.647   5.954  -7.941
  611    HZ1  LYS  81           HZ1      LYS  81  10.355   7.148  -6.201
  612    HZ2  LYS  81           HZ2      LYS  81  11.742   7.968  -6.638
  613    HZ3  LYS  81           HZ3      LYS  81  11.725   7.139  -5.203
  614    H    ILE  82           HN       ILE  82  11.972   4.167  -1.756
  615    HA   ILE  82           HA       ILE  82  11.773   7.016  -1.516
  616    HB   ILE  82           HB       ILE  82   9.546   6.768  -0.592
  617   HG12  ILE  82          HG12      ILE  82   8.578   4.290  -0.623
  618   HG13  ILE  82          HG11      ILE  82  10.258   3.870  -0.322
  619   HG21  ILE  82          HG21      ILE  82   8.426   5.654  -2.445
  620   HG22  ILE  82          HG22      ILE  82   9.941   4.893  -2.907
  621   HG23  ILE  82          HG23      ILE  82   9.777   6.651  -2.993
  622   HD11  ILE  82          HD11      ILE  82   8.966   3.981   1.753
  623   HD12  ILE  82          HD12      ILE  82   8.560   5.656   1.404
  624   HD13  ILE  82          HD13      ILE  82  10.235   5.206   1.716
  625    H    ALA  83           HN       ALA  83  12.623   4.373   0.500
  626    HA   ALA  83           HA       ALA  83  12.857   6.180   2.786
  627    HB1  ALA  83           HB1      ALA  83  11.698   4.059   3.185
  628    HB2  ALA  83           HB2      ALA  83  13.193   4.157   4.121
  629    HB3  ALA  83           HB3      ALA  83  13.130   3.189   2.647
  630    H    GLY  84           HN       GLY  84  14.749   3.592   1.228
  631    HA2  GLY  84           HA2      GLY  84  16.996   3.529   0.737
  632    HA3  GLY  84           HA1      GLY  84  17.159   5.162   1.374
  633    H    LEU  85           HN       LEU  85  15.578   2.808   3.318
  634    HA   LEU  85           HA       LEU  85  17.854   2.953   5.136
  635    HB2  LEU  85           HB2      LEU  85  15.614   3.713   5.916
  636    HB3  LEU  85           HB1      LEU  85  15.028   2.077   5.723
  637    HG   LEU  85           HG       LEU  85  16.599   1.312   7.464
  638   HD11  LEU  85          HD11      LEU  85  17.253   4.245   7.724
  639   HD12  LEU  85          HD12      LEU  85  18.358   2.970   7.198
  640   HD13  LEU  85          HD13      LEU  85  17.748   2.987   8.851
  641   HD21  LEU  85          HD21      LEU  85  14.323   1.961   8.041
  642   HD22  LEU  85          HD22      LEU  85  14.857   3.624   8.299
  643   HD23  LEU  85          HD23      LEU  85  15.447   2.332   9.346
  644    H    GLU  86           HN       GLU  86  15.563   0.583   3.795
  645    HA   GLU  86           HA       GLU  86  16.940  -1.671   4.834
  646    HB2  GLU  86           HB2      GLU  86  14.536  -1.661   4.125
  647    HB3  GLU  86           HB1      GLU  86  15.065  -1.533   2.456
  648    HG2  GLU  86           HG2      GLU  86  16.157  -3.694   2.617
  649    HG3  GLU  86           HG1      GLU  86  15.688  -3.812   4.309
  650    H    HIS  87           HN       HIS  87  16.920  -0.019   1.741
  651    HA   HIS  87           HA       HIS  87  19.621  -0.483   1.137
  652    HB2  HIS  87           HB2      HIS  87  17.521  -2.103  -0.305
  653    HB3  HIS  87           HB1      HIS  87  18.859  -1.455  -1.226
  654    HD1  HIS  87           HD1      HIS  87  17.933  -4.518  -0.100
  655    HD2  HIS  87           HD2      HIS  87  21.369  -2.286   0.561
  656    HE1  HIS  87           HE1      HIS  87  19.756  -6.177   0.445
  657    H    HIS  88           HN       HIS  88  19.822   0.397  -1.285
  658    HA   HIS  88           HA       HIS  88  17.674   2.142  -1.941
  659    HB2  HIS  88           HB2      HIS  88  19.126   4.157  -2.238
  660    HB3  HIS  88           HB1      HIS  88  19.000   3.677  -0.561
  661    HD1  HIS  88           HD1      HIS  88  21.449   4.309  -3.282
  662    HD2  HIS  88           HD2      HIS  88  21.439   2.615   0.520
  663    HE1  HIS  88           HE1      HIS  88  23.843   4.279  -2.530
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1   5.838   5.365  13.824
    2    H2   MET   1           HT2      MET   1   7.159   6.125  14.516
    3    H3   MET   1           HT3      MET   1   5.669   6.116  15.311
    4    HA   MET   1           HA       MET   1   7.216   4.555  16.308
    5    HB2  MET   1           HB2      MET   1   4.790   4.125  16.386
    6    HB3  MET   1           HB1      MET   1   4.888   3.270  14.856
    7    HG2  MET   1           HG2      MET   1   6.403   1.625  15.973
    8    HG3  MET   1           HG1      MET   1   6.078   2.465  17.485
    9    HE1  MET   1           HE1      MET   1   2.253   1.879  18.009
   10    HE2  MET   1           HE2      MET   1   2.991   3.263  17.204
   11    HE3  MET   1           HE3      MET   1   3.724   2.597  18.663
   12    H    VAL   2           HN       VAL   2   6.167   3.356  13.093
   13    HA   VAL   2           HA       VAL   2   8.797   2.121  12.806
   14    HB   VAL   2           HB       VAL   2   7.684   0.387  11.381
   15   HG11  VAL   2          HG11      VAL   2   6.738  -0.928  13.214
   16   HG12  VAL   2          HG12      VAL   2   6.668   0.519  14.214
   17   HG13  VAL   2          HG13      VAL   2   8.230  -0.121  13.700
   18   HG21  VAL   2          HG21      VAL   2   5.660   1.635  10.801
   19   HG22  VAL   2          HG22      VAL   2   5.124   1.555  12.481
   20   HG23  VAL   2          HG23      VAL   2   5.262   0.078  11.526
   21    H    THR   3           HN       THR   3   9.177   1.668  10.376
   22    HA   THR   3           HA       THR   3   8.892   4.179   9.058
   23    HB   THR   3           HB       THR   3  10.205   1.630   8.089
   24    HG1  THR   3           HG1      THR   3  12.036   3.292   8.847
   25   HG21  THR   3          HG21      THR   3  11.507   3.158   6.654
   26   HG22  THR   3          HG22      THR   3  10.601   4.531   7.291
   27   HG23  THR   3          HG23      THR   3   9.781   3.308   6.322
   28    H    ALA   4           HN       ALA   4   6.564   4.008   8.925
   29    HA   ALA   4           HA       ALA   4   5.598   2.195   6.867
   30    HB1  ALA   4           HB1      ALA   4   4.039   4.157   8.555
   31    HB2  ALA   4           HB2      ALA   4   4.215   2.436   8.899
   32    HB3  ALA   4           HB3      ALA   4   3.348   2.964   7.457
   33    H    ALA   5           HN       ALA   5   6.629   3.033   5.160
   34    HA   ALA   5           HA       ALA   5   6.235   5.832   4.443
   35    HB1  ALA   5           HB1      ALA   5   7.825   3.679   3.074
   36    HB2  ALA   5           HB2      ALA   5   8.470   4.858   4.219
   37    HB3  ALA   5           HB3      ALA   5   7.847   5.392   2.653
   38    H    LEU   6           HN       LEU   6   4.478   3.171   4.146
   39    HA   LEU   6           HA       LEU   6   3.229   4.115   1.712
   40    HB2  LEU   6           HB2      LEU   6   2.624   1.755   1.148
   41    HB3  LEU   6           HB1      LEU   6   4.285   2.177   0.859
   42    HG   LEU   6           HG       LEU   6   3.469   0.745   3.355
   43   HD11  LEU   6          HD11      LEU   6   2.590  -0.541   1.447
   44   HD12  LEU   6          HD12      LEU   6   3.970  -1.364   2.178
   45   HD13  LEU   6          HD13      LEU   6   4.174  -0.466   0.675
   46   HD21  LEU   6          HD21      LEU   6   5.760  -0.106   3.237
   47   HD22  LEU   6          HD22      LEU   6   5.728   1.661   3.249
   48   HD23  LEU   6          HD23      LEU   6   6.007   0.791   1.737
   49    H    THR   7           HN       THR   7   1.168   4.269   1.752
   50    HA   THR   7           HA       THR   7  -0.280   3.431   4.149
   51    HB   THR   7           HB       THR   7  -1.020   5.482   2.047
   52    HG1  THR   7           HG1      THR   7   0.705   5.568   4.197
   53   HG21  THR   7          HG21      THR   7  -2.882   4.610   3.398
   54   HG22  THR   7          HG22      THR   7  -2.554   6.299   3.771
   55   HG23  THR   7          HG23      THR   7  -2.010   5.030   4.872
   56    H    ILE   8           HN       ILE   8  -1.751   1.832   3.823
   57    HA   ILE   8           HA       ILE   8  -2.378   1.125   1.040
   58    HB   ILE   8           HB       ILE   8  -2.129  -0.713   3.432
   59   HG12  ILE   8          HG12      ILE   8  -0.506  -0.493   0.891
   60   HG13  ILE   8          HG11      ILE   8   0.018  -0.024   2.501
   61   HG21  ILE   8          HG21      ILE   8  -3.959  -1.412   2.022
   62   HG22  ILE   8          HG22      ILE   8  -2.631  -2.569   1.915
   63   HG23  ILE   8          HG23      ILE   8  -2.926  -1.441   0.590
   64   HD11  ILE   8          HD11      ILE   8   0.974  -2.146   1.848
   65   HD12  ILE   8          HD12      ILE   8  -0.640  -2.805   1.589
   66   HD13  ILE   8          HD13      ILE   8  -0.122  -2.353   3.216
   67    H    TYR   9           HN       TYR   9  -4.394   0.943   0.480
   68    HA   TYR   9           HA       TYR   9  -6.422   1.704   2.373
   69    HB2  TYR   9           HB2      TYR   9  -6.472   1.220  -0.608
   70    HB3  TYR   9           HB1      TYR   9  -7.860   1.804   0.291
   71    HD1  TYR   9           HD2      TYR   9  -7.770   4.070   1.345
   72    HD2  TYR   9           HD1      TYR   9  -4.664   2.654  -1.171
   73    HE1  TYR   9           HE2      TYR   9  -6.891   6.354   1.147
   74    HE2  TYR   9           HE1      TYR   9  -3.769   4.917  -1.368
   75    HH   TYR   9           HH       TYR   9  -4.816   7.407   0.659
   76    H    THR  10           HN       THR  10  -7.819   0.270   3.355
   77    HA   THR  10           HA       THR  10  -7.967  -2.427   2.276
   78    HB   THR  10           HB       THR  10  -7.827  -3.193   4.710
   79    HG1  THR  10           HG1      THR  10  -6.936  -1.828   6.156
   80   HG21  THR  10          HG21      THR  10  -6.091  -3.667   3.019
   81   HG22  THR  10          HG22      THR  10  -5.384  -3.392   4.615
   82   HG23  THR  10          HG23      THR  10  -5.325  -2.120   3.387
   83    H    THR  11           HN       THR  11  -9.812  -3.522   2.722
   84    HA   THR  11           HA       THR  11 -11.677  -2.645   4.717
   85    HB   THR  11           HB       THR  11 -12.664  -3.034   1.799
   86    HG1  THR  11           HG1      THR  11 -11.639  -0.893   2.998
   87   HG21  THR  11          HG21      THR  11 -14.034  -2.241   4.341
   88   HG22  THR  11          HG22      THR  11 -14.276  -3.738   3.454
   89   HG23  THR  11          HG23      THR  11 -14.763  -2.186   2.744
   90    H    SER  12           HN       SER  12 -12.896  -4.491   5.453
   91    HA   SER  12           HA       SER  12 -11.365  -6.863   5.134
   92    HB2  SER  12           HB2      SER  12 -12.999  -7.818   6.787
   93    HB3  SER  12           HB1      SER  12 -12.185  -6.347   7.309
   94    HG   SER  12           HG       SER  12 -14.075  -5.169   6.752
   95    H    TRP  13           HN       TRP  13 -13.724  -5.697   3.262
   96    HA   TRP  13           HA       TRP  13 -15.438  -7.698   2.507
   97    HB2  TRP  13           HB2      TRP  13 -14.162  -5.520   0.997
   98    HB3  TRP  13           HB1      TRP  13 -15.374  -6.582   0.311
   99    HD1  TRP  13           HD1      TRP  13 -16.486  -4.128   0.105
  100    HE1  TRP  13           HE1      TRP  13 -18.110  -3.060   1.592
  101    HE3  TRP  13           HE3      TRP  13 -15.750  -6.867   4.404
  102    HZ2  TRP  13           HZ2      TRP  13 -19.106  -3.217   4.229
  103    HZ3  TRP  13           HZ3      TRP  13 -17.124  -6.318   6.357
  104    HH2  TRP  13           HH2      TRP  13 -18.767  -4.528   6.273
  105    H    CYS  14           HN       CYS  14 -12.204  -6.844   1.588
  106    HA   CYS  14           HA       CYS  14 -12.121  -8.560  -0.728
  107    HB2  CYS  14           HB2      CYS  14 -11.547  -6.329  -1.111
  108    HB3  CYS  14           HB1      CYS  14 -10.484  -6.282   0.285
  109    H    GLY  15           HN       GLY  15 -10.959 -10.347  -0.847
  110    HA2  GLY  15           HA2      GLY  15  -9.385 -11.190   1.456
  111    HA3  GLY  15           HA1      GLY  15  -9.882 -12.202   0.107
  112    H    TYR  16           HN       TYR  16  -8.943 -10.418  -1.971
  113    HA   TYR  16           HA       TYR  16  -6.283 -11.326  -2.214
  114    HB2  TYR  16           HB2      TYR  16  -7.614 -10.833  -4.190
  115    HB3  TYR  16           HB1      TYR  16  -7.737  -9.141  -3.729
  116    HD1  TYR  16           HD1      TYR  16  -5.193 -11.730  -4.549
  117    HD2  TYR  16           HD2      TYR  16  -6.227  -7.609  -4.667
  118    HE1  TYR  16           HE1      TYR  16  -3.174 -11.265  -5.865
  119    HE2  TYR  16           HE2      TYR  16  -4.200  -7.134  -5.976
  120    HH   TYR  16           HH       TYR  16  -2.426  -9.639  -7.400
  121    H    CYS  17           HN       CYS  17  -7.625  -8.303  -1.173
  122    HA   CYS  17           HA       CYS  17  -5.454  -6.692  -1.044
  123    HB2  CYS  17           HB2      CYS  17  -7.746  -6.904   0.884
  124    HB3  CYS  17           HB1      CYS  17  -6.707  -5.495   0.689
  125    H    LEU  18           HN       LEU  18  -6.678  -9.103   1.246
  126    HA   LEU  18           HA       LEU  18  -4.848  -8.608   3.361
  127    HB2  LEU  18           HB2      LEU  18  -7.134  -9.522   3.633
  128    HB3  LEU  18           HB1      LEU  18  -6.641 -10.972   2.802
  129    HG   LEU  18           HG       LEU  18  -5.291 -10.178   5.385
  130   HD11  LEU  18          HD11      LEU  18  -6.968 -11.519   6.569
  131   HD12  LEU  18          HD12      LEU  18  -7.879 -11.682   5.059
  132   HD13  LEU  18          HD13      LEU  18  -7.667 -10.093   5.797
  133   HD21  LEU  18          HD21      LEU  18  -5.017 -12.607   5.610
  134   HD22  LEU  18          HD22      LEU  18  -4.329 -12.042   4.088
  135   HD23  LEU  18          HD23      LEU  18  -5.890 -12.858   4.099
  136    H    ARG  19           HN       ARG  19  -4.917 -10.630   0.558
  137    HA   ARG  19           HA       ARG  19  -2.962 -12.533   1.233
  138    HB2  ARG  19           HB2      ARG  19  -4.552 -12.672  -0.689
  139    HB3  ARG  19           HB1      ARG  19  -3.621 -11.428  -1.498
  140    HG2  ARG  19           HG2      ARG  19  -3.075 -13.623  -2.363
  141    HG3  ARG  19           HG1      ARG  19  -1.680 -12.915  -1.543
  142    HD2  ARG  19           HD2      ARG  19  -2.043 -15.321  -1.017
  143    HD3  ARG  19           HD1      ARG  19  -2.062 -14.277   0.399
  144    HE   ARG  19           HE       ARG  19  -4.535 -14.372   0.223
  145   HH11  ARG  19          HH11      ARG  19  -2.607 -17.027  -1.078
  146   HH12  ARG  19          HH12      ARG  19  -3.834 -18.180  -0.890
  147   HH21  ARG  19          HH21      ARG  19  -6.184 -15.873   0.454
  148   HH22  ARG  19          HH22      ARG  19  -5.986 -17.502  -0.007
  149    H    LEU  20           HN       LEU  20  -2.747  -9.468  -0.503
  150    HA   LEU  20           HA       LEU  20   0.060  -9.581  -0.756
  151    HB2  LEU  20           HB2      LEU  20  -1.154  -8.268  -2.341
  152    HB3  LEU  20           HB1      LEU  20  -1.927  -7.338  -1.085
  153    HG   LEU  20           HG       LEU  20   0.373  -6.371  -0.571
  154   HD11  LEU  20          HD11      LEU  20   1.073  -7.655  -3.201
  155   HD12  LEU  20          HD12      LEU  20   1.963  -7.770  -1.657
  156   HD13  LEU  20          HD13      LEU  20   1.895  -6.272  -2.534
  157   HD21  LEU  20          HD21      LEU  20  -1.354  -5.099  -1.656
  158   HD22  LEU  20          HD22      LEU  20  -0.917  -5.803  -3.214
  159   HD23  LEU  20          HD23      LEU  20   0.217  -4.731  -2.376
  160    H    LYS  21           HN       LYS  21  -2.178  -8.079   1.440
  161    HA   LYS  21           HA       LYS  21  -0.605  -6.383   2.956
  162    HB2  LYS  21           HB2      LYS  21  -3.106  -6.705   2.979
  163    HB3  LYS  21           HB1      LYS  21  -2.839  -8.134   3.958
  164    HG2  LYS  21           HG2      LYS  21  -1.866  -6.748   5.703
  165    HG3  LYS  21           HG1      LYS  21  -2.138  -5.318   4.708
  166    HD2  LYS  21           HD2      LYS  21  -4.545  -5.798   4.698
  167    HD3  LYS  21           HD1      LYS  21  -4.259  -7.188   5.751
  168    HE2  LYS  21           HE2      LYS  21  -3.307  -5.679   7.443
  169    HE3  LYS  21           HE1      LYS  21  -3.654  -4.304   6.394
  170    HZ1  LYS  21           HZ1      LYS  21  -5.352  -4.450   7.964
  171    HZ2  LYS  21           HZ2      LYS  21  -5.549  -6.092   7.770
  172    HZ3  LYS  21           HZ3      LYS  21  -6.073  -5.045   6.548
  173    H    THR  22           HN       THR  22  -1.284  -9.838   3.486
  174    HA   THR  22           HA       THR  22   0.372 -10.048   5.767
  175    HB   THR  22           HB       THR  22   0.143 -12.564   5.298
  176    HG1  THR  22           HG1      THR  22  -1.906 -11.715   3.546
  177   HG21  THR  22          HG21      THR  22  -2.197 -12.586   6.054
  178   HG22  THR  22          HG22      THR  22  -2.345 -10.882   5.625
  179   HG23  THR  22          HG23      THR  22  -1.253 -11.376   6.919
  180    H    ALA  23           HN       ALA  23   0.901 -10.581   2.343
  181    HA   ALA  23           HA       ALA  23   3.487 -11.769   2.459
  182    HB1  ALA  23           HB1      ALA  23   2.357  -9.916   0.360
  183    HB2  ALA  23           HB2      ALA  23   2.101 -11.660   0.395
  184    HB3  ALA  23           HB3      ALA  23   3.727 -11.011   0.161
  185    H    LEU  24           HN       LEU  24   2.490  -8.418   2.303
  186    HA   LEU  24           HA       LEU  24   5.090  -7.352   2.360
  187    HB2  LEU  24           HB2      LEU  24   2.526  -6.152   3.379
  188    HB3  LEU  24           HB1      LEU  24   4.002  -5.253   3.079
  189    HG   LEU  24           HG       LEU  24   2.316  -6.659   1.019
  190   HD11  LEU  24          HD11      LEU  24   1.817  -4.420   0.221
  191   HD12  LEU  24          HD12      LEU  24   2.770  -3.740   1.543
  192   HD13  LEU  24          HD13      LEU  24   1.295  -4.642   1.889
  193   HD21  LEU  24          HD21      LEU  24   4.659  -6.727   0.382
  194   HD22  LEU  24          HD22      LEU  24   4.799  -4.991   0.676
  195   HD23  LEU  24          HD23      LEU  24   3.776  -5.586  -0.629
  196    H    THR  25           HN       THR  25   2.878  -8.257   4.912
  197    HA   THR  25           HA       THR  25   4.392  -7.260   7.083
  198    HB   THR  25           HB       THR  25   2.481  -9.621   7.100
  199    HG1  THR  25           HG1      THR  25   1.568  -7.633   6.213
  200   HG21  THR  25          HG21      THR  25   3.280  -7.682   9.284
  201   HG22  THR  25          HG22      THR  25   3.832  -9.349   9.147
  202   HG23  THR  25          HG23      THR  25   2.125  -9.008   9.444
  203    H    ALA  26           HN       ALA  26   4.287 -10.455   5.506
  204    HA   ALA  26           HA       ALA  26   6.196 -11.718   7.157
  205    HB1  ALA  26           HB1      ALA  26   5.477 -12.326   4.288
  206    HB2  ALA  26           HB2      ALA  26   4.625 -12.939   5.705
  207    HB3  ALA  26           HB3      ALA  26   6.299 -13.416   5.405
  208    H    ASN  27           HN       ASN  27   6.473  -9.504   4.601
  209    HA   ASN  27           HA       ASN  27   9.305 -10.038   4.182
  210    HB2  ASN  27           HB2      ASN  27   7.179  -8.605   2.717
  211    HB3  ASN  27           HB1      ASN  27   8.849  -8.039   2.452
  212   HD21  ASN  27          HD21      ASN  27   6.479 -10.470   1.948
  213   HD22  ASN  27          HD22      ASN  27   7.373 -11.478   0.883
  214    H    ARG  28           HN       ARG  28   7.768  -8.598   6.483
  215    HA   ARG  28           HA       ARG  28   8.320  -7.159   8.140
  216    HB2  ARG  28           HB2      ARG  28  10.647  -8.106   7.671
  217    HB3  ARG  28           HB1      ARG  28  10.941  -6.673   6.706
  218    HG2  ARG  28           HG2      ARG  28  10.282  -5.402   8.888
  219    HG3  ARG  28           HG1      ARG  28  10.668  -6.936   9.671
  220    HD2  ARG  28           HD2      ARG  28  12.630  -5.568   9.669
  221    HD3  ARG  28           HD1      ARG  28  12.871  -6.882   8.507
  222    HE   ARG  28           HE       ARG  28  11.728  -4.566   7.344
  223   HH11  ARG  28          HH11      ARG  28  14.852  -5.901   8.285
  224   HH12  ARG  28          HH12      ARG  28  15.736  -5.005   7.142
  225   HH21  ARG  28          HH21      ARG  28  12.888  -3.369   5.822
  226   HH22  ARG  28          HH22      ARG  28  14.567  -3.510   5.638
  227    H    ILE  29           HN       ILE  29   7.280  -6.246   5.387
  228    HA   ILE  29           HA       ILE  29   8.216  -3.539   5.222
  229    HB   ILE  29           HB       ILE  29   5.983  -4.963   3.722
  230   HG12  ILE  29          HG12      ILE  29   8.769  -4.135   2.825
  231   HG13  ILE  29          HG11      ILE  29   8.281  -5.773   3.227
  232   HG21  ILE  29          HG21      ILE  29   5.504  -2.578   3.852
  233   HG22  ILE  29          HG22      ILE  29   5.981  -3.009   2.207
  234   HG23  ILE  29          HG23      ILE  29   7.127  -2.202   3.277
  235   HD11  ILE  29          HD11      ILE  29   7.214  -4.113   0.958
  236   HD12  ILE  29          HD12      ILE  29   6.746  -5.771   1.341
  237   HD13  ILE  29          HD13      ILE  29   8.397  -5.415   0.839
  238    H    ALA  30           HN       ALA  30   7.452  -1.901   6.323
  239    HA   ALA  30           HA       ALA  30   5.132  -2.321   7.995
  240    HB1  ALA  30           HB1      ALA  30   7.188  -1.521   9.049
  241    HB2  ALA  30           HB2      ALA  30   5.897  -0.320   9.178
  242    HB3  ALA  30           HB3      ALA  30   7.183  -0.116   7.986
  243    H    TYR  31           HN       TYR  31   3.279  -1.310   7.680
  244    HA   TYR  31           HA       TYR  31   3.081   0.876   5.770
  245    HB2  TYR  31           HB2      TYR  31   1.207  -0.292   4.604
  246    HB3  TYR  31           HB1      TYR  31   2.757  -1.086   4.372
  247    HD1  TYR  31           HD1      TYR  31   3.195  -3.269   5.339
  248    HD2  TYR  31           HD2      TYR  31  -0.567  -1.369   5.934
  249    HE1  TYR  31           HE1      TYR  31   2.259  -5.384   6.149
  250    HE2  TYR  31           HE2      TYR  31  -1.510  -3.497   6.746
  251    HH   TYR  31           HH       TYR  31   0.512  -6.145   7.498
  252    H    ASP  32           HN       ASP  32   0.970   1.892   5.895
  253    HA   ASP  32           HA       ASP  32  -0.399   1.294   8.420
  254    HB2  ASP  32           HB2      ASP  32   0.816   3.485   8.455
  255    HB3  ASP  32           HB1      ASP  32  -0.165   4.008   7.087
  256    H    GLU  33           HN       GLU  33  -2.472   0.692   8.155
  257    HA   GLU  33           HA       GLU  33  -3.544   0.905   5.468
  258    HB2  GLU  33           HB2      GLU  33  -5.199  -0.732   6.139
  259    HB3  GLU  33           HB1      GLU  33  -3.593  -1.310   6.524
  260    HG2  GLU  33           HG2      GLU  33  -3.935  -0.855   8.856
  261    HG3  GLU  33           HG1      GLU  33  -5.486  -0.082   8.511
  262    H    VAL  34           HN       VAL  34  -5.528   1.774   5.058
  263    HA   VAL  34           HA       VAL  34  -6.100   4.049   6.754
  264    HB   VAL  34           HB       VAL  34  -7.477   3.407   4.133
  265   HG11  VAL  34          HG11      VAL  34  -7.739   5.806   3.945
  266   HG12  VAL  34          HG12      VAL  34  -6.944   6.022   5.503
  267   HG13  VAL  34          HG13      VAL  34  -8.492   5.175   5.410
  268   HG21  VAL  34          HG21      VAL  34  -5.769   4.752   3.009
  269   HG22  VAL  34          HG22      VAL  34  -5.079   3.307   3.753
  270   HG23  VAL  34          HG23      VAL  34  -4.881   4.877   4.527
  271    H    ASP  35           HN       ASP  35  -8.213   4.647   7.327
  272    HA   ASP  35           HA       ASP  35  -9.721   2.559   8.596
  273    HB2  ASP  35           HB2      ASP  35 -10.017   5.555   8.737
  274    HB3  ASP  35           HB1      ASP  35 -10.931   4.406   9.696
  275    H    ILE  36           HN       ILE  36  -9.975   3.561   5.595
  276    HA   ILE  36           HA       ILE  36 -12.280   4.923   4.991
  277    HB   ILE  36           HB       ILE  36 -12.390   3.805   2.812
  278   HG12  ILE  36          HG12      ILE  36 -10.122   2.084   3.779
  279   HG13  ILE  36          HG11      ILE  36 -11.792   1.523   3.713
  280   HG21  ILE  36          HG21      ILE  36 -10.818   5.610   3.171
  281   HG22  ILE  36          HG22      ILE  36 -10.181   4.415   2.045
  282   HG23  ILE  36          HG23      ILE  36  -9.595   4.455   3.713
  283   HD11  ILE  36          HD11      ILE  36 -10.181   2.505   1.389
  284   HD12  ILE  36          HD12      ILE  36 -11.816   1.843   1.319
  285   HD13  ILE  36          HD13      ILE  36 -10.466   0.803   1.782
  286    H    GLU  37           HN       GLU  37 -12.255   1.510   5.909
  287    HA   GLU  37           HA       GLU  37 -14.755   0.755   4.880
  288    HB2  GLU  37           HB2      GLU  37 -13.023  -0.782   5.795
  289    HB3  GLU  37           HB1      GLU  37 -13.395  -0.181   7.388
  290    HG2  GLU  37           HG2      GLU  37 -15.648  -1.018   7.247
  291    HG3  GLU  37           HG1      GLU  37 -15.366  -1.629   5.628
  292    H    HIS  38           HN       HIS  38 -13.783   2.434   7.732
  293    HA   HIS  38           HA       HIS  38 -16.571   2.867   8.485
  294    HB2  HIS  38           HB2      HIS  38 -15.673   3.017  10.897
  295    HB3  HIS  38           HB1      HIS  38 -15.800   1.418  10.187
  296    HD1  HIS  38           HD1      HIS  38 -13.341   3.732  11.756
  297    HD2  HIS  38           HD2      HIS  38 -13.299   0.242   9.488
  298    HE1  HIS  38           HE1      HIS  38 -11.035   2.777  11.977
  299    H    ASN  39           HN       ASN  39 -14.652   4.326   6.815
  300    HA   ASN  39           HA       ASN  39 -15.106   6.951   8.001
  301    HB2  ASN  39           HB2      ASN  39 -12.809   6.416   8.699
  302    HB3  ASN  39           HB1      ASN  39 -12.378   6.098   7.023
  303   HD21  ASN  39          HD21      ASN  39 -11.069   7.683   6.478
  304   HD22  ASN  39          HD22      ASN  39 -11.261   9.346   6.796
  305    H    ARG  40           HN       ARG  40 -16.469   7.524   6.402
  306    HA   ARG  40           HA       ARG  40 -16.064   6.943   3.687
  307    HB2  ARG  40           HB2      ARG  40 -17.833   8.606   3.242
  308    HB3  ARG  40           HB1      ARG  40 -18.277   7.418   4.453
  309    HG2  ARG  40           HG2      ARG  40 -17.898   9.007   6.214
  310    HG3  ARG  40           HG1      ARG  40 -17.296  10.194   5.054
  311    HD2  ARG  40           HD2      ARG  40 -20.073   9.037   5.131
  312    HD3  ARG  40           HD1      ARG  40 -19.592  10.643   5.705
  313    HE   ARG  40           HE       ARG  40 -18.809  10.948   3.312
  314   HH11  ARG  40          HH11      ARG  40 -21.663   9.055   4.184
  315   HH12  ARG  40          HH12      ARG  40 -22.456   9.302   2.703
  316   HH21  ARG  40          HH21      ARG  40 -19.943  11.322   1.252
  317   HH22  ARG  40          HH22      ARG  40 -21.445  10.603   1.011
  318    H    ALA  41           HN       ALA  41 -14.680   9.420   5.666
  319    HA   ALA  41           HA       ALA  41 -14.385  11.281   3.587
  320    HB1  ALA  41           HB1      ALA  41 -12.778  11.229   6.150
  321    HB2  ALA  41           HB2      ALA  41 -14.352  11.979   5.930
  322    HB3  ALA  41           HB3      ALA  41 -12.963  12.582   5.033
  323    H    ALA  42           HN       ALA  42 -12.199   8.852   4.769
  324    HA   ALA  42           HA       ALA  42 -10.286   9.564   2.714
  325    HB1  ALA  42           HB1      ALA  42  -9.456   8.731   4.865
  326    HB2  ALA  42           HB2      ALA  42  -8.961   7.677   3.532
  327    HB3  ALA  42           HB3      ALA  42 -10.288   7.201   4.591
  328    H    ALA  43           HN       ALA  43 -12.994   7.513   3.068
  329    HA   ALA  43           HA       ALA  43 -12.402   5.581   1.114
  330    HB1  ALA  43           HB1      ALA  43 -14.790   5.102   1.110
  331    HB2  ALA  43           HB2      ALA  43 -15.103   6.650   1.896
  332    HB3  ALA  43           HB3      ALA  43 -14.229   5.392   2.765
  333    H    GLU  44           HN       GLU  44 -13.895   8.738   0.970
  334    HA   GLU  44           HA       GLU  44 -14.590   8.962  -1.724
  335    HB2  GLU  44           HB2      GLU  44 -15.086  10.629   0.047
  336    HB3  GLU  44           HB1      GLU  44 -13.388  11.045   0.118
  337    HG2  GLU  44           HG2      GLU  44 -14.512  12.742  -1.117
  338    HG3  GLU  44           HG1      GLU  44 -13.544  11.802  -2.249
  339    H    PHE  45           HN       PHE  45 -11.524   9.335  -0.073
  340    HA   PHE  45           HA       PHE  45 -10.085  10.459  -2.228
  341    HB2  PHE  45           HB2      PHE  45  -9.519  10.752   0.177
  342    HB3  PHE  45           HB1      PHE  45  -9.033   9.067   0.238
  343    HD1  PHE  45           HD1      PHE  45  -8.246  12.344  -1.265
  344    HD2  PHE  45           HD2      PHE  45  -6.895   8.412  -0.445
  345    HE1  PHE  45           HE1      PHE  45  -5.962  12.992  -1.922
  346    HE2  PHE  45           HE2      PHE  45  -4.636   9.049  -1.089
  347    HZ   PHE  45           HZ       PHE  45  -4.152  11.338  -1.829
  348    H    VAL  46           HN       VAL  46 -10.731   7.189  -1.202
  349    HA   VAL  46           HA       VAL  46  -8.758   5.830  -2.715
  350    HB   VAL  46           HB       VAL  46 -11.560   4.849  -2.063
  351   HG11  VAL  46          HG11      VAL  46  -9.056   3.295  -2.733
  352   HG12  VAL  46          HG12      VAL  46 -10.455   3.501  -3.783
  353   HG13  VAL  46          HG13      VAL  46 -10.610   2.595  -2.279
  354   HG21  VAL  46          HG21      VAL  46 -10.598   3.813  -0.116
  355   HG22  VAL  46          HG22      VAL  46 -10.290   5.563  -0.078
  356   HG23  VAL  46          HG23      VAL  46  -9.008   4.444  -0.532
  357    H    GLY  47           HN       GLY  47 -12.042   6.850  -3.442
  358    HA2  GLY  47           HA2      GLY  47 -12.049   5.861  -6.118
  359    HA3  GLY  47           HA1      GLY  47 -13.195   7.008  -5.431
  360    H    SER  48           HN       SER  48 -10.741   8.627  -4.617
  361    HA   SER  48           HA       SER  48 -10.698  10.196  -7.013
  362    HB2  SER  48           HB2      SER  48 -10.905  11.214  -4.720
  363    HB3  SER  48           HB1      SER  48  -9.249  10.712  -4.403
  364    HG   SER  48           HG       SER  48  -8.677  12.483  -5.328
  365    H    VAL  49           HN       VAL  49  -8.533   8.002  -5.314
  366    HA   VAL  49           HA       VAL  49  -6.356   8.735  -7.045
  367    HB   VAL  49           HB       VAL  49  -5.000   6.950  -5.989
  368   HG11  VAL  49          HG11      VAL  49  -4.886   7.922  -3.738
  369   HG12  VAL  49          HG12      VAL  49  -6.418   8.745  -4.038
  370   HG13  VAL  49          HG13      VAL  49  -4.999   9.144  -5.004
  371   HG21  VAL  49          HG21      VAL  49  -5.862   5.719  -4.035
  372   HG22  VAL  49          HG22      VAL  49  -6.744   5.310  -5.510
  373   HG23  VAL  49          HG23      VAL  49  -7.463   6.401  -4.328
  374    H    ASN  50           HN       ASN  50  -8.661   6.094  -6.868
  375    HA   ASN  50           HA       ASN  50  -7.836   5.627  -9.580
  376    HB2  ASN  50           HB2      ASN  50  -8.570   3.218  -9.474
  377    HB3  ASN  50           HB1      ASN  50  -7.198   3.575  -8.450
  378   HD21  ASN  50          HD21      ASN  50  -7.462   3.417  -6.217
  379   HD22  ASN  50          HD22      ASN  50  -8.813   2.633  -5.496
  380    H    GLY  51           HN       GLY  51  -9.031   6.920 -10.505
  381    HA2  GLY  51           HA2      GLY  51 -11.452   7.950  -9.759
  382    HA3  GLY  51           HA1      GLY  51 -10.824   7.986 -11.390
  383    H    GLY  52           HN       GLY  52 -13.341   7.126  -9.524
  384    HA2  GLY  52           HA2      GLY  52 -15.375   6.474 -10.533
  385    HA3  GLY  52           HA1      GLY  52 -14.461   5.592 -11.742
  386    H    ASN  53           HN       ASN  53 -12.834   4.465  -9.324
  387    HA   ASN  53           HA       ASN  53 -14.890   2.492  -8.577
  388    HB2  ASN  53           HB2      ASN  53 -13.287   1.697 -10.418
  389    HB3  ASN  53           HB1      ASN  53 -12.013   1.775  -9.208
  390   HD21  ASN  53          HD21      ASN  53 -11.591  -0.431  -9.162
  391   HD22  ASN  53          HD22      ASN  53 -12.701  -1.607  -8.617
  392    H    ARG  54           HN       ARG  54 -14.112   1.204  -6.651
  393    HA   ARG  54           HA       ARG  54 -12.166   2.708  -5.067
  394    HB2  ARG  54           HB2      ARG  54 -14.556   1.165  -4.021
  395    HB3  ARG  54           HB1      ARG  54 -13.278   1.815  -3.015
  396    HG2  ARG  54           HG2      ARG  54 -13.912   4.076  -3.633
  397    HG3  ARG  54           HG1      ARG  54 -15.166   3.452  -4.709
  398    HD2  ARG  54           HD2      ARG  54 -15.006   3.097  -1.716
  399    HD3  ARG  54           HD1      ARG  54 -16.156   4.110  -2.588
  400    HE   ARG  54           HE       ARG  54 -16.412   1.555  -3.613
  401   HH11  ARG  54          HH11      ARG  54 -17.018   3.099  -0.479
  402   HH12  ARG  54          HH12      ARG  54 -18.203   1.979   0.001
  403   HH21  ARG  54          HH21      ARG  54 -18.027   0.039  -2.967
  404   HH22  ARG  54          HH22      ARG  54 -18.823   0.210  -1.474
  405    H    THR  55           HN       THR  55 -10.787   1.298  -6.386
  406    HA   THR  55           HA       THR  55 -10.780  -1.504  -5.885
  407    HB   THR  55           HB       THR  55  -8.335   0.074  -6.735
  408    HG1  THR  55           HG1      THR  55  -9.804   0.861  -8.175
  409   HG21  THR  55          HG21      THR  55  -8.144  -2.356  -6.375
  410   HG22  THR  55          HG22      THR  55  -7.946  -1.954  -8.079
  411   HG23  THR  55          HG23      THR  55  -9.469  -2.631  -7.506
  412    H    VAL  56           HN       VAL  56  -9.975  -2.498  -4.072
  413    HA   VAL  56           HA       VAL  56  -9.329  -0.741  -1.983
  414    HB   VAL  56           HB       VAL  56  -9.045  -3.705  -1.688
  415   HG11  VAL  56          HG11      VAL  56  -9.360  -3.195   0.662
  416   HG12  VAL  56          HG12      VAL  56  -9.617  -1.499   0.247
  417   HG13  VAL  56          HG13      VAL  56  -8.039  -2.195   0.008
  418   HG21  VAL  56          HG21      VAL  56 -11.217  -3.671  -0.844
  419   HG22  VAL  56          HG22      VAL  56 -11.201  -3.055  -2.543
  420   HG23  VAL  56          HG23      VAL  56 -11.312  -1.924  -1.157
  421    HA   PRO  57           HA       PRO  57  -5.613  -2.560  -1.309
  422    HB2  PRO  57           HB2      PRO  57  -3.903  -4.240  -2.588
  423    HB3  PRO  57           HB1      PRO  57  -5.273  -4.746  -1.598
  424    HG2  PRO  57           HG2      PRO  57  -5.232  -4.359  -4.583
  425    HG3  PRO  57           HG1      PRO  57  -5.892  -5.720  -3.654
  426    HD2  PRO  57           HD2      PRO  57  -7.472  -3.712  -4.551
  427    HD3  PRO  57           HD1      PRO  57  -7.680  -4.660  -3.027
  428    H    THR  58           HN       THR  58  -5.390  -0.432  -2.203
  429    HA   THR  58           HA       THR  58  -3.546   0.123  -4.351
  430    HB   THR  58           HB       THR  58  -5.758   1.693  -2.999
  431    HG1  THR  58           HG1      THR  58  -6.831   0.575  -4.403
  432   HG21  THR  58          HG21      THR  58  -3.954   3.242  -3.714
  433   HG22  THR  58          HG22      THR  58  -5.388   3.385  -4.758
  434   HG23  THR  58          HG23      THR  58  -3.984   2.490  -5.316
  435    H    VAL  59           HN       VAL  59  -1.691   1.026  -3.779
  436    HA   VAL  59           HA       VAL  59  -1.349   1.726  -0.966
  437    HB   VAL  59           HB       VAL  59  -0.081  -0.310  -1.552
  438   HG11  VAL  59          HG11      VAL  59   1.207   1.369  -3.633
  439   HG12  VAL  59          HG12      VAL  59   0.160  -0.024  -3.885
  440   HG13  VAL  59          HG13      VAL  59   1.754  -0.238  -3.137
  441   HG21  VAL  59          HG21      VAL  59   2.146   0.400  -0.855
  442   HG22  VAL  59          HG22      VAL  59   0.884   1.200   0.089
  443   HG23  VAL  59          HG23      VAL  59   1.714   2.075  -1.198
  444    H    LYS  60           HN       LYS  60  -0.599   3.635  -0.523
  445    HA   LYS  60           HA       LYS  60   0.327   5.348  -2.718
  446    HB2  LYS  60           HB2      LYS  60  -1.727   6.174  -1.643
  447    HB3  LYS  60           HB1      LYS  60  -0.943   6.075  -0.073
  448    HG2  LYS  60           HG2      LYS  60   0.676   7.785  -0.778
  449    HG3  LYS  60           HG1      LYS  60  -0.138   7.899  -2.334
  450    HD2  LYS  60           HD2      LYS  60  -0.835   9.711  -0.861
  451    HD3  LYS  60           HD1      LYS  60  -2.176   8.619  -1.218
  452    HE2  LYS  60           HE2      LYS  60  -1.952   7.568   0.948
  453    HE3  LYS  60           HE1      LYS  60  -0.504   8.519   1.301
  454    HZ1  LYS  60           HZ1      LYS  60  -3.270   9.565   0.969
  455    HZ2  LYS  60           HZ2      LYS  60  -1.892  10.504   1.252
  456    HZ3  LYS  60           HZ3      LYS  60  -2.418   9.405   2.410
  457    H    PHE  61           HN       PHE  61   2.427   5.661  -2.642
  458    HA   PHE  61           HA       PHE  61   3.866   5.113  -0.177
  459    HB2  PHE  61           HB2      PHE  61   4.821   5.733  -2.985
  460    HB3  PHE  61           HB1      PHE  61   5.905   5.539  -1.616
  461    HD1  PHE  61           HD2      PHE  61   3.525   3.806  -3.838
  462    HD2  PHE  61           HD1      PHE  61   6.449   3.367  -0.753
  463    HE1  PHE  61           HE2      PHE  61   3.576   1.362  -4.215
  464    HE2  PHE  61           HE1      PHE  61   6.489   0.974  -1.124
  465    HZ   PHE  61           HZ       PHE  61   5.040  -0.045  -2.880
  466    H    ALA  62           HN       ALA  62   5.389   6.644   0.641
  467    HA   ALA  62           HA       ALA  62   4.422   9.216   1.078
  468    HB1  ALA  62           HB1      ALA  62   6.582   9.693   2.077
  469    HB2  ALA  62           HB2      ALA  62   7.289   8.291   1.273
  470    HB3  ALA  62           HB3      ALA  62   6.057   8.069   2.516
  471    H    ASP  63           HN       ASP  63   6.173   7.985  -1.525
  472    HA   ASP  63           HA       ASP  63   7.365  10.303  -2.635
  473    HB2  ASP  63           HB2      ASP  63   8.115   8.107  -3.266
  474    HB3  ASP  63           HB1      ASP  63   6.506   7.654  -3.804
  475    H    GLY  64           HN       GLY  64   4.073   9.226  -2.502
  476    HA2  GLY  64           HA2      GLY  64   2.269  10.673  -3.057
  477    HA3  GLY  64           HA1      GLY  64   3.284  11.428  -4.277
  478    H    SER  65           HN       SER  65   4.012   8.405  -4.728
  479    HA   SER  65           HA       SER  65   2.299   8.141  -6.965
  480    HB2  SER  65           HB2      SER  65   3.786   6.008  -7.135
  481    HB3  SER  65           HB1      SER  65   4.486   7.607  -7.420
  482    HG   SER  65           HG       SER  65   5.717   7.340  -5.814
  483    H    THR  66           HN       THR  66   0.658   6.739  -7.202
  484    HA   THR  66           HA       THR  66   0.040   5.020  -4.919
  485    HB   THR  66           HB       THR  66  -2.326   5.139  -5.791
  486    HG1  THR  66           HG1      THR  66  -1.262   6.203  -7.879
  487   HG21  THR  66          HG21      THR  66  -1.627   6.518  -3.888
  488   HG22  THR  66          HG22      THR  66  -2.795   7.381  -4.889
  489   HG23  THR  66          HG23      THR  66  -1.081   7.779  -4.995
  490    H    LEU  67           HN       LEU  67  -0.270   2.941  -5.336
  491    HA   LEU  67           HA       LEU  67  -0.210   2.023  -8.119
  492    HB2  LEU  67           HB2      LEU  67   1.395   0.997  -5.774
  493    HB3  LEU  67           HB1      LEU  67   0.992  -0.050  -7.109
  494    HG   LEU  67           HG       LEU  67   2.204   1.526  -8.607
  495   HD11  LEU  67          HD11      LEU  67   3.164   2.888  -6.106
  496   HD12  LEU  67          HD12      LEU  67   2.196   3.555  -7.404
  497   HD13  LEU  67          HD13      LEU  67   3.849   3.058  -7.721
  498   HD21  LEU  67          HD21      LEU  67   3.214  -0.509  -7.947
  499   HD22  LEU  67          HD22      LEU  67   3.754   0.176  -6.427
  500   HD23  LEU  67          HD23      LEU  67   4.433   0.762  -7.962
  501    H    THR  68           HN       THR  68  -1.802   0.693  -8.602
  502    HA   THR  68           HA       THR  68  -3.427  -0.315  -6.407
  503    HB   THR  68           HB       THR  68  -4.105   0.298  -9.293
  504    HG1  THR  68           HG1      THR  68  -5.091   1.359  -6.864
  505   HG21  THR  68          HG21      THR  68  -5.893  -0.792  -7.114
  506   HG22  THR  68          HG22      THR  68  -5.345  -1.686  -8.529
  507   HG23  THR  68          HG23      THR  68  -6.413  -0.295  -8.724
  508    H    ASN  69           HN       ASN  69  -3.431  -2.397  -6.010
  509    HA   ASN  69           HA       ASN  69  -2.926  -4.567  -6.031
  510    HB2  ASN  69           HB2      ASN  69  -3.736  -4.351  -8.939
  511    HB3  ASN  69           HB1      ASN  69  -3.401  -5.870  -8.130
  512   HD21  ASN  69          HD21      ASN  69  -5.411  -6.673  -8.409
  513   HD22  ASN  69          HD22      ASN  69  -6.813  -6.080  -7.612
  514    HA   PRO  70           HA       PRO  70   1.269  -4.163  -8.094
  515    HB2  PRO  70           HB2      PRO  70   2.818  -3.352  -6.116
  516    HB3  PRO  70           HB1      PRO  70   1.794  -2.172  -6.951
  517    HG2  PRO  70           HG2      PRO  70   1.280  -3.618  -4.374
  518    HG3  PRO  70           HG1      PRO  70   1.163  -1.868  -4.690
  519    HD2  PRO  70           HD2      PRO  70  -1.015  -3.501  -4.731
  520    HD3  PRO  70           HD1      PRO  70  -0.854  -2.090  -5.789
  521    H    SER  71           HN       SER  71   3.117  -5.552  -7.638
  522    HA   SER  71           HA       SER  71   2.417  -7.851  -6.056
  523    HB2  SER  71           HB2      SER  71   4.997  -7.356  -7.555
  524    HB3  SER  71           HB1      SER  71   4.255  -8.901  -7.148
  525    HG   SER  71           HG       SER  71   3.409  -6.968  -9.002
  526    H    ALA  72           HN       ALA  72   3.936  -8.634  -4.388
  527    HA   ALA  72           HA       ALA  72   4.585  -6.635  -2.516
  528    HB1  ALA  72           HB1      ALA  72   5.522  -8.435  -1.170
  529    HB2  ALA  72           HB2      ALA  72   5.514  -9.498  -2.573
  530    HB3  ALA  72           HB3      ALA  72   3.988  -8.935  -1.890
  531    H    ASP  73           HN       ASP  73   6.516  -8.413  -4.795
  532    HA   ASP  73           HA       ASP  73   9.064  -7.527  -3.952
  533    HB2  ASP  73           HB2      ASP  73   8.105  -8.539  -6.626
  534    HB3  ASP  73           HB1      ASP  73   9.769  -8.046  -6.359
  535    H    GLU  74           HN       GLU  74   6.683  -6.148  -6.078
  536    HA   GLU  74           HA       GLU  74   8.292  -4.063  -7.138
  537    HB2  GLU  74           HB2      GLU  74   5.299  -4.202  -6.757
  538    HB3  GLU  74           HB1      GLU  74   6.131  -2.941  -7.648
  539    HG2  GLU  74           HG2      GLU  74   6.913  -4.580  -9.254
  540    HG3  GLU  74           HG1      GLU  74   6.104  -5.866  -8.357
  541    H    VAL  75           HN       VAL  75   6.081  -4.325  -4.428
  542    HA   VAL  75           HA       VAL  75   6.267  -1.682  -3.502
  543    HB   VAL  75           HB       VAL  75   5.740  -4.215  -1.910
  544   HG11  VAL  75          HG11      VAL  75   4.668  -2.759  -0.258
  545   HG12  VAL  75          HG12      VAL  75   5.164  -1.343  -1.184
  546   HG13  VAL  75          HG13      VAL  75   6.381  -2.379  -0.440
  547   HG21  VAL  75          HG21      VAL  75   3.370  -3.623  -2.156
  548   HG22  VAL  75          HG22      VAL  75   4.141  -3.896  -3.717
  549   HG23  VAL  75          HG23      VAL  75   3.825  -2.252  -3.167
  550    H    LYS  76           HN       LYS  76   8.075  -4.575  -2.669
  551    HA   LYS  76           HA       LYS  76   9.800  -3.534  -0.750
  552    HB2  LYS  76           HB2      LYS  76   9.559  -5.888  -1.117
  553    HB3  LYS  76           HB1      LYS  76  10.166  -5.761  -2.760
  554    HG2  LYS  76           HG2      LYS  76  11.839  -6.747  -1.353
  555    HG3  LYS  76           HG1      LYS  76  12.376  -5.137  -1.824
  556    HD2  LYS  76           HD2      LYS  76  11.754  -4.256   0.340
  557    HD3  LYS  76           HD1      LYS  76  11.061  -5.812   0.809
  558    HE2  LYS  76           HE2      LYS  76  13.276  -6.848   0.563
  559    HE3  LYS  76           HE1      LYS  76  13.949  -5.279   0.149
  560    HZ1  LYS  76           HZ1      LYS  76  12.590  -5.826   2.726
  561    HZ2  LYS  76           HZ2      LYS  76  13.558  -4.475   2.320
  562    HZ3  LYS  76           HZ3      LYS  76  14.238  -5.990   2.483
  563    H    ALA  77           HN       ALA  77  10.278  -3.781  -4.289
  564    HA   ALA  77           HA       ALA  77  12.846  -2.559  -4.253
  565    HB1  ALA  77           HB1      ALA  77  10.936  -2.897  -6.560
  566    HB2  ALA  77           HB2      ALA  77  12.110  -4.094  -6.024
  567    HB3  ALA  77           HB3      ALA  77  12.661  -2.550  -6.682
  568    H    LYS  78           HN       LYS  78   9.645  -1.259  -4.344
  569    HA   LYS  78           HA       LYS  78  10.541   1.382  -5.118
  570    HB2  LYS  78           HB2      LYS  78   7.956   0.448  -3.857
  571    HB3  LYS  78           HB1      LYS  78   8.283   2.110  -4.297
  572    HG2  LYS  78           HG2      LYS  78   8.184  -0.197  -6.226
  573    HG3  LYS  78           HG1      LYS  78   6.861   0.917  -5.882
  574    HD2  LYS  78           HD2      LYS  78   8.331   2.785  -6.628
  575    HD3  LYS  78           HD1      LYS  78   9.534   1.585  -7.106
  576    HE2  LYS  78           HE2      LYS  78   6.717   1.772  -8.182
  577    HE3  LYS  78           HE1      LYS  78   8.164   2.320  -9.017
  578    HZ1  LYS  78           HZ1      LYS  78   8.957   0.070  -9.109
  579    HZ2  LYS  78           HZ2      LYS  78   7.412   0.108  -9.748
  580    HZ3  LYS  78           HZ3      LYS  78   7.664  -0.501  -8.209
  581    H    LEU  79           HN       LEU  79   9.693  -0.311  -2.160
  582    HA   LEU  79           HA       LEU  79   9.725   1.757  -0.390
  583    HB2  LEU  79           HB2      LEU  79   9.065  -0.662   0.138
  584    HB3  LEU  79           HB1      LEU  79  10.754  -1.021   0.141
  585    HG   LEU  79           HG       LEU  79  11.086   0.460   2.061
  586   HD11  LEU  79          HD11      LEU  79   9.329   2.034   2.002
  587   HD12  LEU  79          HD12      LEU  79   9.055   1.029   3.419
  588   HD13  LEU  79          HD13      LEU  79   8.111   0.759   1.962
  589   HD21  LEU  79          HD21      LEU  79  10.826  -1.918   2.404
  590   HD22  LEU  79          HD22      LEU  79   9.071  -1.732   2.433
  591   HD23  LEU  79          HD23      LEU  79  10.051  -1.021   3.713
  592    H    VAL  80           HN       VAL  80  12.379  -0.324  -1.384
  593    HA   VAL  80           HA       VAL  80  14.336   0.790   0.241
  594    HB   VAL  80           HB       VAL  80  16.016  -0.288  -1.249
  595   HG11  VAL  80          HG11      VAL  80  14.946  -1.620   0.448
  596   HG12  VAL  80          HG12      VAL  80  15.262  -2.581  -0.995
  597   HG13  VAL  80          HG13      VAL  80  13.632  -2.004  -0.660
  598   HG21  VAL  80          HG21      VAL  80  13.645  -0.870  -2.989
  599   HG22  VAL  80          HG22      VAL  80  15.240  -1.613  -3.176
  600   HG23  VAL  80          HG23      VAL  80  15.038   0.124  -3.413
  601    H    LYS  81           HN       LYS  81  13.296   1.769  -2.965
  602    HA   LYS  81           HA       LYS  81  15.456   3.654  -3.153
  603    HB2  LYS  81           HB2      LYS  81  14.642   4.198  -5.362
  604    HB3  LYS  81           HB1      LYS  81  14.632   2.454  -5.149
  605    HG2  LYS  81           HG2      LYS  81  12.236   2.534  -4.725
  606    HG3  LYS  81           HG1      LYS  81  12.255   4.268  -5.035
  607    HD2  LYS  81           HD2      LYS  81  13.080   2.131  -7.001
  608    HD3  LYS  81           HD1      LYS  81  11.538   2.980  -7.019
  609    HE2  LYS  81           HE2      LYS  81  14.261   4.259  -7.381
  610    HE3  LYS  81           HE1      LYS  81  13.130   3.880  -8.664
  611    HZ1  LYS  81           HZ1      LYS  81  12.672   5.838  -6.470
  612    HZ2  LYS  81           HZ2      LYS  81  11.543   5.416  -7.653
  613    HZ3  LYS  81           HZ3      LYS  81  12.972   6.171  -8.091
  614    H    ILE  82           HN       ILE  82  11.992   3.851  -2.427
  615    HA   ILE  82           HA       ILE  82  12.207   6.707  -2.495
  616    HB   ILE  82           HB       ILE  82   9.808   6.862  -1.892
  617   HG12  ILE  82          HG12      ILE  82   8.444   4.654  -2.186
  618   HG13  ILE  82          HG11      ILE  82   9.941   3.841  -1.767
  619   HG21  ILE  82          HG21      ILE  82  10.421   5.072  -4.214
  620   HG22  ILE  82          HG22      ILE  82  10.438   6.835  -4.188
  621   HG23  ILE  82          HG23      ILE  82   8.917   5.963  -3.988
  622   HD11  ILE  82          HD11      ILE  82   9.941   4.986   0.397
  623   HD12  ILE  82          HD12      ILE  82   8.479   4.034   0.152
  624   HD13  ILE  82          HD13      ILE  82   8.429   5.787  -0.035
  625    H    ALA  83           HN       ALA  83  12.084   4.316   0.037
  626    HA   ALA  83           HA       ALA  83  11.977   6.401   2.032
  627    HB1  ALA  83           HB1      ALA  83  12.176   4.577   3.672
  628    HB2  ALA  83           HB2      ALA  83  12.415   3.431   2.344
  629    HB3  ALA  83           HB3      ALA  83  10.880   4.277   2.512
  630    H    GLY  84           HN       GLY  84  14.369   4.382   0.467
  631    HA2  GLY  84           HA2      GLY  84  16.582   4.883   0.160
  632    HA3  GLY  84           HA1      GLY  84  16.391   6.253   1.247
  633    H    LEU  85           HN       LEU  85  15.626   5.119   3.534
  634    HA   LEU  85           HA       LEU  85  18.126   3.959   4.414
  635    HB2  LEU  85           HB2      LEU  85  17.032   5.842   5.597
  636    HB3  LEU  85           HB1      LEU  85  15.704   4.790   6.021
  637    HG   LEU  85           HG       LEU  85  17.242   3.412   7.381
  638   HD11  LEU  85          HD11      LEU  85  19.297   5.504   6.687
  639   HD12  LEU  85          HD12      LEU  85  19.319   3.806   6.204
  640   HD13  LEU  85          HD13      LEU  85  19.481   4.240   7.902
  641   HD21  LEU  85          HD21      LEU  85  17.249   6.353   8.053
  642   HD22  LEU  85          HD22      LEU  85  17.588   5.045   9.187
  643   HD23  LEU  85          HD23      LEU  85  15.988   5.191   8.466
  644    H    GLU  86           HN       GLU  86  16.223   2.275   2.861
  645    HA   GLU  86           HA       GLU  86  15.905   0.165   4.869
  646    HB2  GLU  86           HB2      GLU  86  13.862   0.972   3.423
  647    HB3  GLU  86           HB1      GLU  86  14.637   0.062   2.132
  648    HG2  GLU  86           HG2      GLU  86  13.633  -1.022   4.762
  649    HG3  GLU  86           HG1      GLU  86  12.889  -1.244   3.187
  650    H    HIS  87           HN       HIS  87  17.838  -0.761   4.835
  651    HA   HIS  87           HA       HIS  87  19.777  -1.703   4.184
  652    HB2  HIS  87           HB2      HIS  87  18.160  -3.441   3.349
  653    HB3  HIS  87           HB1      HIS  87  18.159  -2.638   1.789
  654    HD1  HIS  87           HD1      HIS  87  19.971  -3.349   0.153
  655    HD2  HIS  87           HD2      HIS  87  20.646  -4.700   4.024
  656    HE1  HIS  87           HE1      HIS  87  21.864  -5.003  -0.005
  657    H    HIS  88           HN       HIS  88  20.523   0.471   3.934
  658    HA   HIS  88           HA       HIS  88  20.495   1.621   1.300
  659    HB2  HIS  88           HB2      HIS  88  20.109   2.923   3.440
  660    HB3  HIS  88           HB1      HIS  88  21.830   2.725   3.755
  661    HD1  HIS  88           HD1      HIS  88  19.443   4.409   1.434
  662    HD2  HIS  88           HD2      HIS  88  23.500   4.375   2.275
  663    HE1  HIS  88           HE1      HIS  88  20.421   6.367   0.195