*HEADER    CELL CYCLE                              12-DEC-05   2FCD              
*TITLE     SOLUTION STRUCTURE OF N-LOBE MYOSIN LIGHT CHAIN FROM                  
*TITLE    2 SACCHAROMICES CEREVISIAE                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MYOSIN LIGHT CHAIN 1;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN;                                         
*COMPND   5 SYNONYM: MYOSIN-2 LIGHT CHAIN, CALMODULIN-LIKE MYOSIN                
*COMPND   6 LIGHT CHAIN MLC1;                                                    
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   3 ORGANISM_COMMON: YEAST;                                              
*SOURCE   4 GENE: MLC1;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    EF-HAND PROTEIN                                                       
*EXPDTA    NMR                                                                   
*AUTHOR    D.O.CICERO, M.PENNESTRI, G.M.CONTESSA, M.PACI, A.RAGNINI-             
*AUTHOR   2 WILSON, S.MELINO                                                     
*REVDAT   1   07-NOV-06 2FCD    0                                                


#c13ar

assign (resid 11 and name HD1) (resid 11 and name HB1) 3.400 1.6 0.0 !   mp31e10.29
assign (resid 11 and name HD2) (resid 11 and name HA) 3.400 1.6 0.0 !   mp31e10.27
assign (resid 11 and name HD2) (resid 11 and name HB2) 3.400 1.6 0.0 !   mp31e10.28
assign (resid 11 and name HD1) (resid 12 and name HN) 5.000 3.2 0.0 !   mp31e10.77
assign (resid 14 and name HD1) (resid 10 and name HG2#) 5.000 3.2 0.0 !   mp31e10.22
assign (resid 14 and name HE1) (resid 10 and name HG2#) 5.000 3.2 0.0 !   mp31e10.30
assign (resid 14 and name HD1) (resid 14 and name HB2) 3.400 1.6 0.0 !   mp31e10.32
assign (resid 14 and name HD2) (resid 14 and name HA) 3.400 1.6 0.0 !   mp31e10.31
assign (resid 14 and name HD1) (resid 14 and name HE1) 2.800 1.0 0.0 !   mp31e10.26
assign (resid 14 and name HD2) (resid 14 and name HZ) 3.400 1.6 0.0 !   mp31e10.37
assign (resid 14 and name HD2) (resid 22 and name HD1#) 5.000 3.2 0.0 !   mp31e10.35
assign (resid 14 and name HE2) (resid 26 and name HB1) 5.000 3.2 0.0 !   mp31e10.39
assign (resid 14 and name HE2) (resid 29 and name HB2) 3.400 1.6 0.0 !   mp31e10.40
assign (resid 30 and name HE2) (resid 7 and name HB1) 5.000 3.2 0.0 !   mp31e10.64
assign (resid 30 and name HE1) (resid 10 and name HB) 3.400 1.6 0.0 !   mp31e10.66
assign (resid 30 and name HD1) (resid 11 and name HA) 5.000 3.2 0.0 !   mp31e10.20
assign (resid 30 and name HE1) (resid 11 and name HA) 3.400 1.6 0.0 !   mp31e10.61
assign (resid 30 and name HE1) (resid 11 and name HB1) 5.000 3.2 0.0 !   mp31e10.63
assign (resid 30 and name HE1) (resid 11 and name HB2) 3.400 1.6 0.0 !   mp31e10.62
assign (resid 30 and name HE1) (resid 11 and name HN) 3.400 1.6 0.0 !   mp31e10.60
assign (resid 30 and name HD1) (resid 14 and name HD1) 5.000 3.2 0.0 !   mp31e10.64
assign (resid 14 and name HD1) (resid 30 and name HD1) 5.000 3.2 0.0 !   mp31e10.78
assign (resid 30 and name HD2) (resid 22 and name HD1#) 5.000 3.2 0.0 !   mp31e10.74
assign (resid 30 and name HD1) (resid 30 and name HA) 3.400 1.6 0.0 !   mp31e10.14
assign (resid 30 and name HD1) (resid 30 and name HB2) 3.400 1.6 0.0 !   mp31e10.10
assign (resid 30 and name HD2) (resid 30 and name HB1) 3.400 1.6 0.0 !   mp31e10.11
assign (resid 30 and name HE2) (resid 30 and name HB1) 5.000 3.2 0.0 !   mp31e10.65
assign (resid 30 and name HD2) (resid 30 and name HN) 5.000 3.2 0.0 !   mp31e10.75
assign (resid 30 and name HD2) (resid 31 and name HA) 5.000 3.2 0.0 !   mp31e10.21
assign (resid 14 and name HD1) (resid 33 and name HB#) 5.000 3.2 0.0 !   mp31e10.33
assign (resid 14 and name HE1) (resid 33 and name HB#) 5.000 3.2 0.0 !   mp31e10.29
assign (resid 30 and name HE2) (resid 34 and name HD1#) 3.400 1.6 0.0 !   mp31e10.69
assign (resid 30 and name HE2) (resid 34 and name HG2#) 3.400 1.6 0.0 !   mp31e10.68
assign (resid 36 and name HD1) (resid 31 and name HA) 5.000 3.2 0.0 !   mp31e10.1
assign (resid 36 and name HD1) (resid 31 and name HB2) 5.000 3.2 0.0 !   mp31e10.4
assign (resid 36 and name HD1) (resid 34 and name HD1#) 3.400 1.6 0.0 !   mp31e10.7
assign (resid 36 and name HD1) (resid 34 and name HG11) 3.400 1.6 0.0 !   mp31e10.6
assign (resid 36 and name HE1) (resid 34 and name HD1#) 3.400 1.6 0.0 !   mp31e10.72
assign (resid 36 and name HD1) (resid 36 and name HB2) 3.400 1.6 0.0 !   mp31e10.3
assign (resid 36 and name HD2) (resid 36 and name HA) 3.400 1.6 0.0 !   mp31e10.0
assign (resid 36 and name HD2) (resid 36 and name HB1) 3.400 1.6 0.0 !   mp31e10.2
assign (resid 11 and name HD2) (resid 64 and name HD1#) 5.000 3.2 0.0 !   mp31e10.30
assign (resid 30 and name HD2) (resid 64 and name HD1#) 5.000 3.2 0.0 !   mp31e10.25
assign (resid 30 and name HD2) (resid 64 and name HG2#) 3.400 1.6 0.0 !   mp31e10.12
assign (resid 30 and name HE2) (resid 64 and name HG2#) 3.400 1.6 0.0 !   mp31e10.67
assign (resid 36 and name HE2) (resid 75 and name HB2) 3.400 1.6 0.0 !   mp31e10.71
assign (resid 36 and name HE1) (resid 75 and name HD1#) 5.000 3.2 0.0 !   mp31e10.73
assign (resid 36 and name HD2) (resid 75 and name HD2#) 5.000 3.2 0.0 !   mp31e10.8
assign (resid 36 and name HE2) (resid 76 and name HA) 3.400 1.6 0.0 !   mp31e10.70
assign (resid 36 and name HD2) (resid 78 and name HG2#) 3.400 1.6 0.0 !   mp31e10.5
!assign (resid 120 and name HD1) (resid 120 and name HA) 3.400 1.6 0.0 !   mp31e10.14
!assign (resid 120 and name HD1) (resid 120 and name HB1) 3.400 1.6 0.0 !   mp31e10.15
!assign (resid 154 and name HD1) (resid 154 and name HA) 5.000 3.2 0.0 !   mp31e10.18
!assign (resid 154 and name HD1) (resid 154 and name HB1) 3.400 1.6 0.0 !   mp31e10.7

#hnnoe

assign (resid 4 and name HN) (resid 3 and name HA) 3.165 1.365 0.0 !   mp9e20.4
assign (resid 4 and name HN) (resid 3 and name HB#) 4.217 2.417 0.0 !   mp9e20.6
assign (resid 4 and name HN) (resid 3 and name HN) 4.757 2.957 0.0 !   mp9e20.0
assign (resid 4 and name HN) (resid 4 and name HA) 3.337 1.537 0.0 !   mp9e20.3
assign (resid 4 and name HN) (resid 4 and name HG2#) 4.090 2.29 0.0 !   mp9e20.7
assign (resid 4 and name HN) (resid 5 and name HN) 4.019 2.219 0.0 !   mp9e20.1
assign (resid 6 and name HN) (resid 5 and name HB1) 4.216 2.416 0.0 !   mp9e20.13
assign (resid 6 and name HN) (resid 5 and name HB2) 3.935 2.135 0.0 !   mp9e20.14
assign (resid 6 and name HN) (resid 6 and name HA) 2.984 1.184 0.0 !   mp9e20.16
assign (resid 6 and name HN) (resid 6 and name HB#) 3.406 1.606 0.0 !   mp9e20.12
assign (resid 7 and name HN) (resid 6 and name HB#) 4.742 2.942 0.0 !   mp9e20.31
assign (resid 6 and name HN) (resid 7 and name HN) 4.507 2.707 0.0 !   mp9e20.23
assign (resid 7 and name HN) (resid 6 and name HN) 4.596 2.796 0.0 !   mp9e20.25
assign (resid 7 and name HN) (resid 7 and name HA) 4.638 2.838 0.0 !   mp9e20.29
assign (resid 7 and name HN) (resid 7 and name HB2) 3.792 1.992 0.0 !   mp9e20.30
assign (resid 9 and name HN) (resid 8 and name HA) 4.333 2.533 0.0 !   mp9e20.38
assign (resid 9 and name HN) (resid 8 and name HB1) 3.540 1.74 0.0 !   mp9e20.33
assign (resid 9 and name HN) (resid 8 and name HG1) 3.400 1.6 0.0 !   mp9e20.37
assign (resid 9 and name HN) (resid 9 and name HA) 3.560 1.76 0.0 !   mp9e20.39
assign (resid 9 and name HN) (resid 9 and name HB1) 3.504 1.704 0.0 !   mp9e20.36
assign (resid 9 and name HN) (resid 9 and name HB2) 3.684 1.884 0.0 !   mp9e20.35
assign (resid 10 and name HN) (resid 9 and name HA) 4.073 2.273 0.0 !   mp9e20.47
assign (resid 10 and name HN) (resid 9 and name HB1) 3.974 2.174 0.0 !   mp9e20.51
assign (resid 10 and name HN) (resid 9 and name HB2) 4.464 2.664 0.0 !   mp9e20.50
assign (resid 10 and name HN) (resid 10 and name HA) 3.977 2.177 0.0 !   mp9e20.49
assign (resid 10 and name HN) (resid 10 and name HB) 3.589 1.789 0.0 !   mp9e20.52
assign (resid 10 and name HN) (resid 10 and name HD1#) 4.734 2.934 0.0 !   mp9e20.62
assign (resid 10 and name HN) (resid 10 and name HG11) 3.936 2.136 0.0 !   mp9e20.54
assign (resid 10 and name HN) (resid 10 and name HG12) 3.841 2.041 0.0 !   mp9e20.53
assign (resid 10 and name HN) (resid 10 and name HG2#) 5.106 3.306 0.0 !   mp9e20.58
assign (resid 12 and name HN) (resid 9 and name HA) 4.612 2.812 0.0 !   mp9e20.69
assign (resid 12 and name HN) (resid 11 and name HB1) 4.198 2.398 0.0 !   mp9e20.73
assign (resid 12 and name HN) (resid 11 and name HB2) 3.967 2.167 0.0 !   mp9e20.72
assign (resid 12 and name HN) (resid 11 and name HD1) 3.400 1.6 0.0 !   mp9e20.66
assign (resid 12 and name HN) (resid 12 and name HA) 3.395 1.595 0.0 !   mp9e20.71
assign (resid 12 and name HN) (resid 12 and name HB) 3.405 1.605 0.0 !   mp9e20.70
assign (resid 12 and name HN) (resid 12 and name HG2#) 4.002 2.202 0.0 !   mp9e20.77
assign (resid 12 and name HN) (resid 13 and name HD1#) 5.500 3.7 0.0 !   mp9e20.78
assign (resid 13 and name HN) (resid 12 and name HB) 3.802 2.002 0.0 !   mp9e20.85
assign (resid 12 and name HN) (resid 13 and name HN) 4.016 2.216 0.0 !   mp9e20.65
assign (resid 13 and name HN) (resid 12 and name HN) 3.593 1.793 0.0 !   mp9e20.80
assign (resid 13 and name HN) (resid 13 and name HA) 3.125 1.325 0.0 !   mp9e20.86
assign (resid 13 and name HN) (resid 13 and name HB1) 3.412 1.612 0.0 !   mp9e20.92
assign (resid 13 and name HN) (resid 13 and name HB2) 3.407 1.607 0.0 !   mp9e20.88
assign (resid 13 and name HN) (resid 13 and name HD2#) 4.203 2.403 0.0 !   mp9e20.98
assign (resid 13 and name HN) (resid 13 and name HG) 3.250 1.45 0.0 !   mp9e20.89
assign (resid 12 and name HN) (resid 14 and name HB2) 5.148 3.348 0.0 !   mp9e20.74
assign (resid 12 and name HN) (resid 14 and name HN) 5.044 3.244 0.0 !   mp9e20.63
assign (resid 14 and name HN) (resid 12 and name HN) 5.093 3.293 0.0 !   mp9e20.111
assign (resid 14 and name HN) (resid 13 and name HA) 3.763 1.963 0.0 !   mp9e20.105
assign (resid 14 and name HN) (resid 13 and name HB1) 4.497 2.697 0.0 !   mp9e20.101
assign (resid 14 and name HN) (resid 13 and name HB2) 4.187 2.387 0.0 !   mp9e20.102
assign (resid 14 and name HN) (resid 13 and name HD1#) 5.500 3.7 0.0 !   mp9e20.100
assign (resid 14 and name HN) (resid 13 and name HG) 5.500 3.7 0.0 !   mp9e20.116
assign (resid 13 and name HN) (resid 14 and name HN) 3.573 1.773 0.0 !   mp9e20.81
assign (resid 14 and name HN) (resid 13 and name HN) 3.433 1.633 0.0 !   mp9e20.115
assign (resid 14 and name HN) (resid 14 and name HA) 3.628 1.828 0.0 !   mp9e20.106
assign (resid 14 and name HN) (resid 14 and name HB1) 3.908 2.108 0.0 !   mp9e20.103
assign (resid 14 and name HN) (resid 14 and name HB2) 3.864 2.064 0.0 !   mp9e20.104
assign (resid 14 and name HN) (resid 14 and name HE1) 5.026 3.226 0.0 !   mp9e20.114
assign (resid 15 and name HN) (resid 11 and name HD1) 5.500 3.7 0.0 !   mp9e20.125
assign (resid 12 and name HN) (resid 15 and name HB1) 4.250 2.45 0.0 !   mp9e20.76
assign (resid 12 and name HN) (resid 15 and name HB2) 5.000 3.2 0.0 !   mp9e20.75
assign (resid 15 and name HN) (resid 12 and name HA) 3.475 1.675 0.0 !   mp9e20.122
assign (resid 15 and name HN) (resid 12 and name HN) 4.786 2.986 0.0 !   mp9e20.127
assign (resid 15 and name HN) (resid 13 and name HB1) 4.510 2.71 0.0 !   mp9e20.118
assign (resid 15 and name HN) (resid 13 and name HN) 4.135 2.335 0.0 !   mp9e20.126
assign (resid 15 and name HN) (resid 14 and name HA) 3.888 2.088 0.0 !   mp9e20.123
assign (resid 15 and name HN) (resid 14 and name HB2) 4.178 2.378 0.0 !   mp9e20.121
assign (resid 15 and name HN) (resid 15 and name HA) 3.936 2.136 0.0 !   mp9e20.124
assign (resid 15 and name HN) (resid 15 and name HB1) 3.195 1.395 0.0 !   mp9e20.119
assign (resid 15 and name HN) (resid 15 and name HB2) 3.216 1.416 0.0 !   mp9e20.120
assign (resid 16 and name HN) (resid 14 and name HA) 4.784 2.984 0.0 !   mp9e20.135
assign (resid 16 and name HN) (resid 14 and name HB1) 5.104 3.304 0.0 !   mp9e20.132
assign (resid 16 and name HN) (resid 15 and name HA) 3.414 1.614 0.0 !   mp9e20.136
assign (resid 16 and name HN) (resid 15 and name HB2) 4.813 3.013 0.0 !   mp9e20.131
assign (resid 16 and name HN) (resid 16 and name HA) 3.388 1.588 0.0 !   mp9e20.133
assign (resid 16 and name HN) (resid 16 and name HB2) 3.027 1.227 0.0 !   mp9e20.130
assign (resid 16 and name HN) (resid 16 and name HG1) 3.174 1.374 0.0 !   mp9e20.129
assign (resid 17 and name HN) (resid 15 and name HA) 3.921 2.121 0.0 !   mp9e20.148
assign (resid 17 and name HN) (resid 16 and name HA) 4.301 2.501 0.0 !   mp9e20.146
assign (resid 17 and name HN) (resid 16 and name HB2) 3.433 1.633 0.0 !   mp9e20.143
assign (resid 16 and name HN) (resid 17 and name HN) 3.656 1.856 0.0 !   mp9e20.141
assign (resid 17 and name HN) (resid 16 and name HN) 3.340 1.54 0.0 !   mp9e20.150
assign (resid 17 and name HN) (resid 17 and name HA) 3.662 1.862 0.0 !   mp9e20.147
assign (resid 17 and name HN) (resid 17 and name HB2) 3.830 2.03 0.0 !   mp9e20.144
assign (resid 17 and name HN) (resid 17 and name HG1) 3.659 1.859 0.0 !   mp9e20.142
assign (resid 18 and name HN) (resid 15 and name HA) 4.620 2.82 0.0 !   mp9e20.159
assign (resid 18 and name HN) (resid 16 and name HA) 4.402 2.602 0.0 !   mp9e20.157
assign (resid 17 and name HN) (resid 18 and name HA2) 4.380 2.58 0.0 !   mp9e20.145
assign (resid 18 and name HN) (resid 17 and name HA) 3.670 1.87 0.0 !   mp9e20.158
assign (resid 18 and name HN) (resid 17 and name HB1) 3.874 2.074 0.0 !   mp9e20.153
assign (resid 18 and name HN) (resid 17 and name HB2) 4.218 2.418 0.0 !   mp9e20.154
assign (resid 18 and name HN) (resid 17 and name HG1) 3.400 1.6 0.0 !   mp9e20.152
assign (resid 18 and name HN) (resid 17 and name HN) 3.521 1.721 0.0 !   mp9e20.160
assign (resid 18 and name HN) (resid 18 and name HA2) 2.712 0.912 0.0 !   mp9e20.155
assign (resid 17 and name HN) (resid 19 and name HN) 5.251 3.451 0.0 !   mp9e20.151
assign (resid 19 and name HN) (resid 17 and name HN) 5.455 3.655 0.0 !   mp9e20.164
assign (resid 19 and name HN) (resid 18 and name HA2) 3.588 1.788 0.0 !   mp9e20.169
assign (resid 18 and name HN) (resid 19 and name HN) 3.585 1.785 0.0 !   mp9e20.161
assign (resid 19 and name HN) (resid 18 and name HN) 3.672 1.872 0.0 !   mp9e20.165
assign (resid 19 and name HN) (resid 19 and name HA) 3.625 1.825 0.0 !   mp9e20.167
assign (resid 19 and name HN) (resid 19 and name HB2) 3.531 1.731 0.0 !   mp9e20.171
assign (resid 19 and name HN) (resid 19 and name HG2) 4.690 2.89 0.0 !   mp9e20.170
assign (resid 19 and name HN) (resid 20 and name HA2) 4.947 3.147 0.0 !   mp9e20.168
assign (resid 20 and name HN) (resid 19 and name HA) 4.541 2.741 0.0 !   mp9e20.175
assign (resid 20 and name HN) (resid 19 and name HB2) 4.838 3.038 0.0 !   mp9e20.172
assign (resid 19 and name HN) (resid 20 and name HN) 6.000 4.2 0.0 !   mp9e20.163
assign (resid 20 and name HN) (resid 19 and name HN) 3.789 1.989 0.0 !   mp9e20.177
assign (resid 20 and name HN) (resid 20 and name HA1) 3.697 1.897 0.0 !   mp9e20.173
assign (resid 20 and name HN) (resid 20 and name HA2) 3.805 2.005 0.0 !   mp9e20.174
assign (resid 21 and name HN) (resid 11 and name HZ) 5.500 3.7 0.0 !   mp9e20.183
assign (resid 17 and name HN) (resid 21 and name HN) 5.489 3.689 0.0 !   mp9e20.149
assign (resid 19 and name HN) (resid 21 and name HN) 4.323 2.523 0.0 !   mp9e20.166
assign (resid 21 and name HN) (resid 19 and name HN) 3.961 2.161 0.0 !   mp9e20.178
assign (resid 21 and name HN) (resid 20 and name HA1) 3.722 1.922 0.0 !   mp9e20.191
assign (resid 20 and name HN) (resid 21 and name HN) 3.775 1.975 0.0 !   mp9e20.176
assign (resid 21 and name HN) (resid 21 and name HA) 3.924 2.124 0.0 !   mp9e20.186
assign (resid 21 and name HN) (resid 21 and name HB#) 5.056 3.256 0.0 !   mp9e20.199
assign (resid 22 and name HN) (resid 11 and name HE2) 5.500 3.7 0.0 !   mp9e20.203
assign (resid 22 and name HN) (resid 11 and name HZ) 5.500 3.7 0.0 !   mp9e20.202
assign (resid 14 and name HN) (resid 22 and name HG2#) 5.500 3.7 0.0 !   mp9e20.99
assign (resid 15 and name HN) (resid 22 and name HG2#) 5.500 3.7 0.0 !   mp9e20.117
assign (resid 16 and name HN) (resid 22 and name HG2#) 5.500 3.7 0.0 !   mp9e20.128
assign (resid 22 and name HN) (resid 21 and name HA) 3.470 1.67 0.0 !   mp9e20.204
assign (resid 22 and name HN) (resid 21 and name HB#) 4.182 2.382 0.0 !   mp9e20.209
assign (resid 22 and name HN) (resid 22 and name HA) 4.091 2.291 0.0 !   mp9e20.206
assign (resid 22 and name HN) (resid 22 and name HG11) 3.970 2.17 0.0 !   mp9e20.210
assign (resid 22 and name HN) (resid 22 and name HG2#) 4.638 2.838 0.0 !   mp9e20.211
assign (resid 23 and name HN) (resid 22 and name HA) 3.052 1.252 0.0 !   mp9e20.215
assign (resid 23 and name HN) (resid 22 and name HB) 3.478 1.678 0.0 !   mp9e20.219
assign (resid 23 and name HN) (resid 22 and name HG11) 5.500 3.7 0.0 !   mp9e20.222
assign (resid 23 and name HN) (resid 22 and name HG12) 5.500 3.7 0.0 !   mp9e20.221
assign (resid 23 and name HN) (resid 22 and name HG2#) 5.500 3.7 0.0 !   mp9e20.223
assign (resid 23 and name HN) (resid 23 and name HA) 3.612 1.812 0.0 !   mp9e20.216
assign (resid 23 and name HN) (resid 23 and name HB#) 3.378 1.578 0.0 !   mp9e20.220
assign (resid 24 and name HN) (resid 22 and name HG11) 5.500 3.7 0.0 !   mp9e20.244
assign (resid 24 and name HN) (resid 23 and name HA) 3.206 1.406 0.0 !   mp9e20.237
assign (resid 23 and name HN) (resid 24 and name HN) 4.679 2.879 0.0 !   mp9e20.213
assign (resid 24 and name HN) (resid 23 and name HN) 5.085 3.285 0.0 !   mp9e20.226
assign (resid 24 and name HN) (resid 24 and name HB1) 3.478 1.678 0.0 !   mp9e20.243
assign (resid 24 and name HN) (resid 24 and name HG1) 3.474 1.674 0.0 !   mp9e20.245
assign (resid 25 and name HN) (resid 22 and name HG11) 5.500 3.7 0.0 !   mp9e20.246
assign (resid 25 and name HN) (resid 23 and name HA) 4.092 2.292 0.0 !   mp9e20.252
assign (resid 25 and name HN) (resid 23 and name HB#) 3.915 2.115 0.0 !   mp9e20.248
assign (resid 25 and name HN) (resid 24 and name HA) 4.360 2.56 0.0 !   mp9e20.251
assign (resid 25 and name HN) (resid 24 and name HB1) 3.697 1.897 0.0 !   mp9e20.247
assign (resid 25 and name HN) (resid 24 and name HB2) 3.832 2.032 0.0 !   mp9e20.249
assign (resid 24 and name HN) (resid 25 and name HN) 4.152 2.352 0.0 !   mp9e20.224
assign (resid 25 and name HN) (resid 24 and name HN) 3.639 1.839 0.0 !   mp9e20.257
assign (resid 25 and name HN) (resid 25 and name HA) 3.189 1.389 0.0 !   mp9e20.253
assign (resid 25 and name HN) (resid 25 and name HB2) 3.142 1.342 0.0 !   mp9e20.250
assign (resid 26 and name HN) (resid 22 and name HD1#) 5.500 3.7 0.0 !   mp9e20.276
assign (resid 26 and name HN) (resid 22 and name HG11) 5.500 3.7 0.0 !   mp9e20.275
assign (resid 23 and name HN) (resid 26 and name HB2) 5.008 3.208 0.0 !   mp9e20.218
assign (resid 26 and name HN) (resid 23 and name HB#) 4.272 2.472 0.0 !   mp9e20.274
assign (resid 24 and name HN) (resid 26 and name HB2) 5.391 3.591 0.0 !   mp9e20.241
assign (resid 26 and name HN) (resid 24 and name HA) 4.976 3.176 0.0 !   mp9e20.270
assign (resid 26 and name HN) (resid 25 and name HA) 4.148 2.348 0.0 !   mp9e20.265
assign (resid 26 and name HN) (resid 25 and name HB2) 4.599 2.799 0.0 !   mp9e20.271
assign (resid 25 and name HN) (resid 26 and name HN) 3.528 1.728 0.0 !   mp9e20.256
assign (resid 26 and name HN) (resid 25 and name HN) 3.843 2.043 0.0 !   mp9e20.258
assign (resid 26 and name HN) (resid 26 and name HA) 3.625 1.825 0.0 !   mp9e20.264
assign (resid 26 and name HN) (resid 26 and name HB2) 3.631 1.831 0.0 !   mp9e20.266
assign (resid 27 and name HN) (resid 24 and name HA) 4.757 2.957 0.0 !   mp9e20.284
assign (resid 27 and name HN) (resid 25 and name HA) 4.692 2.892 0.0 !   mp9e20.286
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assign (resid 26 and name HN) (resid 27 and name HA) 4.966 3.166 0.0 !   mp9e20.267
assign (resid 26 and name HN) (resid 27 and name HB2) 4.768 2.968 0.0 !   mp9e20.273
assign (resid 27 and name HN) (resid 26 and name HA) 4.365 2.565 0.0 !   mp9e20.287
assign (resid 26 and name HN) (resid 27 and name HN) 3.493 1.693 0.0 !   mp9e20.259
assign (resid 27 and name HN) (resid 26 and name HN) 3.486 1.686 0.0 !   mp9e20.289
assign (resid 27 and name HN) (resid 27 and name HA) 3.638 1.838 0.0 !   mp9e20.285
assign (resid 27 and name HN) (resid 27 and name HB1) 3.363 1.563 0.0 !   mp9e20.278
assign (resid 27 and name HN) (resid 27 and name HB2) 3.623 1.823 0.0 !   mp9e20.283
assign (resid 27 and name HN) (resid 27 and name HD1#) 4.091 2.291 0.0 !   mp9e20.277
assign (resid 28 and name HN) (resid 26 and name HA) 5.272 3.472 0.0 !   mp9e20.303
assign (resid 28 and name HN) (resid 27 and name HB1) 4.132 2.332 0.0 !   mp9e20.294
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assign (resid 28 and name HN) (resid 27 and name HN) 4.037 2.237 0.0 !   mp9e20.304
assign (resid 28 and name HN) (resid 28 and name HA1) 3.183 1.383 0.0 !   mp9e20.302
assign (resid 28 and name HN) (resid 28 and name HA2) 3.423 1.623 0.0 !   mp9e20.300
assign (resid 28 and name HN) (resid 29 and name HB2) 5.353 3.553 0.0 !   mp9e20.299
assign (resid 28 and name HN) (resid 29 and name HN) 3.818 2.018 0.0 !   mp9e20.305
assign (resid 10 and name HN) (resid 30 and name HE1) 5.500 3.7 0.0 !   mp9e20.46
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assign (resid 30 and name HN) (resid 14 and name HZ) 5.500 3.7 0.0 !   mp9e20.323
assign (resid 30 and name HN) (resid 22 and name HD1#) 5.500 3.7 0.0 !   mp9e20.307
assign (resid 30 and name HN) (resid 27 and name HA) 4.095 2.295 0.0 !   mp9e20.320
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assign (resid 30 and name HN) (resid 27 and name HD1#) 5.500 3.7 0.0 !   mp9e20.313
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assign (resid 30 and name HN) (resid 29 and name HN) 3.636 1.836 0.0 !   mp9e20.325
assign (resid 30 and name HN) (resid 30 and name HA) 3.595 1.795 0.0 !   mp9e20.319
assign (resid 30 and name HN) (resid 30 and name HB1) 3.409 1.609 0.0 !   mp9e20.317
assign (resid 30 and name HN) (resid 30 and name HB2) 3.166 1.366 0.0 !   mp9e20.318
assign (resid 30 and name HN) (resid 30 and name HD2) 3.765 1.965 0.0 !   mp9e20.322
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assign (resid 31 and name HN) (resid 30 and name HB2) 4.508 2.708 0.0 !   mp9e20.334
assign (resid 31 and name HN) (resid 30 and name HD2) 5.500 3.7 0.0 !   mp9e20.331
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assign (resid 31 and name HN) (resid 31 and name HA) 4.246 2.446 0.0 !   mp9e20.332
assign (resid 31 and name HN) (resid 31 and name HB1) 4.805 3.005 0.0 !   mp9e20.339
assign (resid 31 and name HN) (resid 31 and name HB2) 3.554 1.754 0.0 !   mp9e20.335
assign (resid 31 and name HN) (resid 31 and name HD1#) 4.999 3.199 0.0 !   mp9e20.344
assign (resid 31 and name HN) (resid 31 and name HD2#) 4.692 2.892 0.0 !   mp9e20.341
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assign (resid 32 and name HN) (resid 31 and name HB2) 4.774 2.974 0.0 !   mp9e20.348
assign (resid 31 and name HN) (resid 32 and name HN) 3.909 2.109 0.0 !   mp9e20.329
assign (resid 32 and name HN) (resid 31 and name HN) 4.528 2.728 0.0 !   mp9e20.356
assign (resid 32 and name HN) (resid 32 and name HA) 4.043 2.243 0.0 !   mp9e20.354
assign (resid 32 and name HN) (resid 32 and name HB2) 3.335 1.535 0.0 !   mp9e20.350
assign (resid 32 and name HN) (resid 32 and name HE) 5.285 3.485 0.0 !   mp9e20.355
assign (resid 33 and name HN) (resid 10 and name HG2#) 5.500 3.7 0.0 !   mp9e20.366
assign (resid 33 and name HN) (resid 14 and name HZ) 5.500 3.7 0.0 !   mp9e20.358
assign (resid 33 and name HN) (resid 30 and name HA) 4.273 2.473 0.0 !   mp9e20.362
assign (resid 33 and name HN) (resid 31 and name HA) 5.443 3.643 0.0 !   mp9e20.361
assign (resid 32 and name HN) (resid 33 and name HB#) 6.000 4.2 0.0 !   mp9e20.347
assign (resid 33 and name HN) (resid 32 and name HA) 4.436 2.636 0.0 !   mp9e20.359
assign (resid 33 and name HN) (resid 32 and name HB2) 3.661 1.861 0.0 !   mp9e20.363
assign (resid 33 and name HN) (resid 33 and name HA) 3.461 1.661 0.0 !   mp9e20.360
assign (resid 33 and name HN) (resid 33 and name HB#) 3.545 1.745 0.0 !   mp9e20.364
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assign (resid 34 and name HN) (resid 30 and name HA) 4.778 2.978 0.0 !   mp9e20.375
assign (resid 34 and name HN) (resid 30 and name HD2) 5.500 3.7 0.0 !   mp9e20.378
assign (resid 34 and name HN) (resid 31 and name HA) 4.822 3.022 0.0 !   mp9e20.376
assign (resid 32 and name HN) (resid 34 and name HD1#) 5.500 3.7 0.0 !   mp9e20.346
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assign (resid 33 and name HN) (resid 34 and name HG2#) 5.500 3.7 0.0 !   mp9e20.368
assign (resid 34 and name HN) (resid 33 and name HB#) 4.845 3.045 0.0 !   mp9e20.373
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assign (resid 34 and name HN) (resid 34 and name HA) 3.827 2.027 0.0 !   mp9e20.377
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assign (resid 34 and name HN) (resid 34 and name HD1#) 4.511 2.711 0.0 !   mp9e20.370
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assign (resid 34 and name HN) (resid 34 and name HG12) 4.227 2.427 0.0 !   mp9e20.372
assign (resid 34 and name HN) (resid 34 and name HG2#) 4.308 2.508 0.0 !   mp9e20.369
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assign (resid 35 and name HN) (resid 34 and name HB) 5.476 3.676 0.0 !   mp9e20.393
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assign (resid 35 and name HN) (resid 34 and name HG2#) 5.500 3.7 0.0 !   mp9e20.391
assign (resid 35 and name HN) (resid 35 and name HA1) 3.215 1.415 0.0 !   mp9e20.390
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assign (resid 36 and name HN) (resid 32 and name HA) 4.422 2.622 0.0 !   mp9e20.410
assign (resid 36 and name HN) (resid 32 and name HG2) 5.500 3.7 0.0 !   mp9e20.400
assign (resid 34 and name HN) (resid 36 and name HD1) 5.500 3.7 0.0 !   mp9e20.379
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assign (resid 36 and name HN) (resid 34 and name HD1#) 5.500 3.7 0.0 !   mp9e20.395
assign (resid 36 and name HN) (resid 34 and name HG11) 5.500 3.7 0.0 !   mp9e20.397
assign (resid 36 and name HN) (resid 34 and name HG12) 5.500 3.7 0.0 !   mp9e20.398
assign (resid 36 and name HN) (resid 34 and name HG2#) 5.500 3.7 0.0 !   mp9e20.394
assign (resid 34 and name HN) (resid 36 and name HN) 4.933 3.133 0.0 !   mp9e20.380
assign (resid 35 and name HN) (resid 36 and name HD1) 5.500 3.7 0.0 !   mp9e20.382
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assign (resid 36 and name HN) (resid 35 and name HN) 3.416 1.616 0.0 !   mp9e20.413
assign (resid 36 and name HN) (resid 36 and name HA) 3.956 2.156 0.0 !   mp9e20.409
assign (resid 36 and name HN) (resid 36 and name HB1) 3.866 2.066 0.0 !   mp9e20.403
assign (resid 36 and name HN) (resid 36 and name HB2) 4.398 2.598 0.0 !   mp9e20.402
assign (resid 36 and name HN) (resid 36 and name HD1) 3.920 2.12 0.0 !   mp9e20.412
assign (resid 36 and name HN) (resid 36 and name HE1) 5.023 3.223 0.0 !   mp9e20.411
assign (resid 35 and name HN) (resid 37 and name HN) 5.631 3.831 0.0 !   mp9e20.387
assign (resid 37 and name HN) (resid 36 and name HA) 3.484 1.684 0.0 !   mp9e20.433
assign (resid 37 and name HN) (resid 36 and name HB1) 3.525 1.725 0.0 !   mp9e20.425
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assign (resid 37 and name HN) (resid 36 and name HD2) 3.400 1.6 0.0 !   mp9e20.435
assign (resid 36 and name HN) (resid 37 and name HN) 4.649 2.849 0.0 !   mp9e20.414
assign (resid 37 and name HN) (resid 36 and name HN) 5.272 3.472 0.0 !   mp9e20.436
assign (resid 37 and name HN) (resid 37 and name HA) 4.337 2.537 0.0 !   mp9e20.434
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assign (resid 37 and name HN) (resid 38 and name HD1) 5.500 3.7 0.0 !   mp9e20.426
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assign (resid 39 and name HN) (resid 38 and name HA) 3.017 1.217 0.0 !   mp9e20.449
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assign (resid 39 and name HN) (resid 39 and name HA) 3.741 1.941 0.0 !   mp9e20.448
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assign (resid 49 and name HN) (resid 47 and name HG2#) 5.500 3.7 0.0 !   mp9e20.559
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assign (resid 50 and name HN) (resid 47 and name HG2#) 5.500 3.7 0.0 !   mp9e20.575
assign (resid 50 and name HN) (resid 48 and name HA) 4.306 2.506 0.0 !   mp9e20.584
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assign (resid 51 and name HN) (resid 50 and name HN) 5.646 3.846 0.0 !   mp9e20.602
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assign (resid 51 and name HN) (resid 52 and name HN) 4.956 3.156 0.0 !   mp9e20.603
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assign (resid 50 and name HN) (resid 53 and name HN) 4.657 2.857 0.0 !   mp9e20.592
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assign (resid 52 and name HN) (resid 53 and name HG) 5.500 3.7 0.0 !   mp9e20.609
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assign (resid 53 and name HN) (resid 53 and name HA) 3.382 1.582 0.0 !   mp9e20.629
assign (resid 53 and name HN) (resid 53 and name HB1) 3.838 2.038 0.0 !   mp9e20.623
assign (resid 53 and name HN) (resid 53 and name HB2) 3.727 1.927 0.0 !   mp9e20.625
assign (resid 53 and name HN) (resid 53 and name HD1#) 4.475 2.675 0.0 !   mp9e20.622
assign (resid 53 and name HN) (resid 53 and name HD2#) 4.351 2.551 0.0 !   mp9e20.621
assign (resid 53 and name HN) (resid 53 and name HG) 3.328 1.528 0.0 !   mp9e20.624
assign (resid 48 and name HN) (resid 54 and name HG1) 5.500 3.7 0.0 !   mp9e20.550
assign (resid 50 and name HN) (resid 54 and name HG1) 5.500 3.7 0.0 !   mp9e20.595
assign (resid 50 and name HN) (resid 54 and name HN) 4.609 2.809 0.0 !   mp9e20.587
assign (resid 54 and name HN) (resid 52 and name HN) 4.782 2.982 0.0 !   mp9e20.642
assign (resid 54 and name HN) (resid 53 and name HA) 3.899 2.099 0.0 !   mp9e20.639
assign (resid 54 and name HN) (resid 53 and name HB2) 4.183 2.383 0.0 !   mp9e20.636
assign (resid 54 and name HN) (resid 54 and name HA) 3.611 1.811 0.0 !   mp9e20.638
assign (resid 54 and name HN) (resid 54 and name HB2) 3.427 1.627 0.0 !   mp9e20.637
assign (resid 54 and name HN) (resid 54 and name HG1) 3.858 2.058 0.0 !   mp9e20.635
assign (resid 55 and name HN) (resid 47 and name HG2#) 5.500 3.7 0.0 !   mp9e20.643
assign (resid 55 and name HN) (resid 53 and name HA) 3.982 2.182 0.0 !   mp9e20.652
assign (resid 55 and name HN) (resid 53 and name HB1) 5.350 3.55 0.0 !   mp9e20.644
assign (resid 54 and name HN) (resid 55 and name HA) 5.232 3.432 0.0 !   mp9e20.641
assign (resid 55 and name HN) (resid 54 and name HA) 3.969 2.169 0.0 !   mp9e20.651
assign (resid 55 and name HN) (resid 54 and name HB1) 3.745 1.945 0.0 !   mp9e20.648
assign (resid 55 and name HN) (resid 54 and name HG1) 3.400 1.6 0.0 !   mp9e20.647
assign (resid 55 and name HN) (resid 55 and name HA) 3.442 1.642 0.0 !   mp9e20.653
assign (resid 55 and name HN) (resid 55 and name HB1) 3.347 1.547 0.0 !   mp9e20.650
assign (resid 55 and name HN) (resid 55 and name HB2) 3.172 1.372 0.0 !   mp9e20.649
assign (resid 56 and name HN) (resid 53 and name HB1) 4.581 2.781 0.0 !   mp9e20.656
assign (resid 56 and name HN) (resid 54 and name HA) 4.770 2.97 0.0 !   mp9e20.667
assign (resid 56 and name HN) (resid 55 and name HA) 3.829 2.029 0.0 !   mp9e20.670
assign (resid 56 and name HN) (resid 55 and name HB1) 4.515 2.715 0.0 !   mp9e20.662
assign (resid 56 and name HN) (resid 55 and name HB2) 4.267 2.467 0.0 !   mp9e20.661
assign (resid 55 and name HN) (resid 56 and name HN) 3.139 1.339 0.0 !   mp9e20.654
assign (resid 56 and name HN) (resid 55 and name HN) 3.082 1.282 0.0 !   mp9e20.671
assign (resid 56 and name HN) (resid 56 and name HA) 3.302 1.502 0.0 !   mp9e20.669
assign (resid 56 and name HN) (resid 56 and name HB#) 3.253 1.453 0.0 !   mp9e20.657
assign (resid 24 and name HN) (resid 57 and name HA) 4.976 3.176 0.0 !   mp9e20.235
assign (resid 22 and name HN) (resid 58 and name HB1) 5.047 3.247 0.0 !   mp9e20.208
assign (resid 22 and name HN) (resid 58 and name HB2) 5.497 3.697 0.0 !   mp9e20.207
assign (resid 23 and name HN) (resid 58 and name HA) 4.910 3.11 0.0 !   mp9e20.214
assign (resid 24 and name HN) (resid 58 and name HA) 3.658 1.858 0.0 !   mp9e20.234
assign (resid 24 and name HN) (resid 58 and name HB1) 5.399 3.599 0.0 !   mp9e20.239
assign (resid 58 and name HN) (resid 24 and name HN) 5.093 3.293 0.0 !   mp9e20.681
assign (resid 58 and name HN) (resid 56 and name HA) 4.496 2.696 0.0 !   mp9e20.678
assign (resid 58 and name HN) (resid 56 and name HB#) 4.200 2.4 0.0 !   mp9e20.674
assign (resid 58 and name HN) (resid 57 and name HA) 4.688 2.888 0.0 !   mp9e20.679
assign (resid 58 and name HN) (resid 57 and name HB1) 4.291 2.491 0.0 !   mp9e20.677
assign (resid 58 and name HN) (resid 58 and name HA) 4.189 2.389 0.0 !   mp9e20.680
assign (resid 58 and name HN) (resid 58 and name HB1) 4.524 2.724 0.0 !   mp9e20.675
assign (resid 58 and name HN) (resid 58 and name HB2) 4.477 2.677 0.0 !   mp9e20.676
assign (resid 59 and name HN) (resid 21 and name HB#) 4.926 3.126 0.0 !   mp9e20.696
assign (resid 59 and name HN) (resid 22 and name HG11) 3.400 1.6 0.0 !   mp9e20.697
assign (resid 22 and name HN) (resid 59 and name HN) 4.388 2.588 0.0 !   mp9e20.201
assign (resid 59 and name HN) (resid 22 and name HN) 4.341 2.541 0.0 !   mp9e20.684
assign (resid 59 and name HN) (resid 23 and name HA) 4.713 2.913 0.0 !   mp9e20.688
assign (resid 24 and name HN) (resid 59 and name HN) 4.704 2.904 0.0 !   mp9e20.233
assign (resid 59 and name HN) (resid 24 and name HN) 5.285 3.485 0.0 !   mp9e20.685
assign (resid 56 and name HN) (resid 59 and name HD2#) 5.500 3.7 0.0 !   mp9e20.655
assign (resid 58 and name HN) (resid 59 and name HD2#) 5.500 3.7 0.0 !   mp9e20.672
assign (resid 59 and name HN) (resid 58 and name HA) 3.394 1.594 0.0 !   mp9e20.686
assign (resid 59 and name HN) (resid 58 and name HB1) 3.885 2.085 0.0 !   mp9e20.690
assign (resid 59 and name HN) (resid 58 and name HB2) 3.842 2.042 0.0 !   mp9e20.689
assign (resid 58 and name HN) (resid 59 and name HN) 5.016 3.216 0.0 !   mp9e20.683
assign (resid 59 and name HN) (resid 59 and name HB1) 3.801 2.001 0.0 !   mp9e20.692
assign (resid 59 and name HN) (resid 59 and name HB2) 4.451 2.651 0.0 !   mp9e20.691
assign (resid 21 and name HN) (resid 60 and name HA) 5.110 3.31 0.0 !   mp9e20.200
assign (resid 22 and name HN) (resid 60 and name HA) 4.673 2.873 0.0 !   mp9e20.205
assign (resid 58 and name HN) (resid 60 and name HN) 5.50 3.70 0.0 !   mp9e20.682
assign (resid 60 and name HN) (resid 59 and name HA) 3.311 1.511 0.0 !   mp9e20.715
assign (resid 60 and name HN) (resid 59 and name HB2) 4.146 2.346 0.0 !   mp9e20.700
assign (resid 60 and name HN) (resid 60 and name HA) 4.299 2.499 0.0 !   mp9e20.714
assign (resid 60 and name HN) (resid 60 and name HG2#) 3.390 1.59 0.0 !   mp9e20.699
assign (resid 61 and name HN) (resid 11 and name HE1) 5.500 3.7 0.0 !   mp9e20.19
assign (resid 61 and name HN) (resid 11 and name HZ) 5.500 3.7 0.0 !   mp9e20.18
assign (resid 12 and name HN) (resid 61 and name HD2#) 5.500 3.7 0.0 !   mp9e20.79
assign (resid 61 and name HN) (resid 60 and name HB) 3.303 1.503 0.0 !   mp9e20.17
assign (resid 61 and name HN) (resid 61 and name HA) 4.236 2.436 0.0 !   mp9e20.15
assign (resid 61 and name HN) (resid 61 and name HB1) 4.047 2.247 0.0 !   mp9e20.8
assign (resid 61 and name HN) (resid 61 and name HD2#) 4.513 2.713 0.0 !   mp9e20.9
assign (resid 61 and name HN) (resid 61 and name HG) 3.583 1.783 0.0 !   mp9e20.11
assign (resid 61 and name HN) (resid 62 and name HN) 4.458 2.658 0.0 !   mp9e20.21
assign (resid 60 and name HN) (resid 63 and name HG1) 2.800 1.0 0.0 !   mp9e20.704
assign (resid 63 and name HN) (resid 60 and name HB) 4.455 2.655 0.0 !   mp9e20.537
assign (resid 63 and name HN) (resid 60 and name HN) 4.544 2.744 0.0 !   mp9e20.531
assign (resid 60 and name HN) (resid 63 and name HN) 4.263 2.463 0.0 !   mp9e20.716
assign (resid 63 and name HN) (resid 61 and name HD1#) 5.500 3.7 0.0 !   mp9e20.546
assign (resid 63 and name HN) (resid 62 and name HA) 4.497 2.697 0.0 !   mp9e20.538
assign (resid 63 and name HN) (resid 63 and name HA) 3.871 2.071 0.0 !   mp9e20.547
assign (resid 63 and name HN) (resid 63 and name HG1) 3.185 1.385 0.0 !   mp9e20.541
assign (resid 64 and name HN) (resid 63 and name HG1) 5.500 3.7 0.0 !   mp9e20.722
assign (resid 64 and name HN) (resid 63 and name HN) 3.964 2.164 0.0 !   mp9e20.726
assign (resid 64 and name HN) (resid 64 and name HA) 3.758 1.958 0.0 !   mp9e20.723
assign (resid 64 and name HN) (resid 64 and name HB) 3.397 1.597 0.0 !   mp9e20.720
assign (resid 64 and name HN) (resid 64 and name HD1#) 4.593 2.793 0.0 !   mp9e20.721
assign (resid 65 and name HN) (resid 61 and name HD1#) 5.500 3.7 0.0 !   mp9e20.728
assign (resid 65 and name HN) (resid 61 and name HG) 5.500 3.7 0.0 !   mp9e20.730
assign (resid 65 and name HN) (resid 64 and name HA) 4.716 2.916 0.0 !   mp9e20.732
assign (resid 65 and name HN) (resid 64 and name HB) 4.060 2.26 0.0 !   mp9e20.731
assign (resid 65 and name HN) (resid 64 and name HG2#) 5.500 3.7 0.0 !   mp9e20.729
assign (resid 64 and name HN) (resid 65 and name HN) 4.160 2.36 0.0 !   mp9e20.727
assign (resid 65 and name HN) (resid 64 and name HN) 4.159 2.359 0.0 !   mp9e20.737
assign (resid 65 and name HN) (resid 65 and name HA) 4.215 2.415 0.0 !   mp9e20.733
assign (resid 65 and name HN) (resid 65 and name HB) 3.580 1.78 0.0 !   mp9e20.734
assign (resid 66 and name HN) (resid 64 and name HN) 4.503 2.703 0.0 !   mp9e20.742
assign (resid 66 and name HN) (resid 65 and name HB) 3.497 1.697 0.0 !   mp9e20.741
assign (resid 66 and name HN) (resid 65 and name HG2#) 5.500 3.7 0.0 !   mp9e20.738
assign (resid 65 and name HN) (resid 66 and name HN) 3.926 2.126 0.0 !   mp9e20.736
assign (resid 66 and name HN) (resid 65 and name HN) 3.926 2.126 0.0 !   mp9e20.743
assign (resid 66 and name HN) (resid 66 and name HA1) 2.905 1.105 0.0 !   mp9e20.739
assign (resid 67 and name HN) (resid 64 and name HA) 4.493 2.693 0.0 !   mp9e20.752
assign (resid 67 and name HN) (resid 65 and name HN) 5.021 3.221 0.0 !   mp9e20.754
assign (resid 67 and name HN) (resid 66 and name HA1) 3.466 1.666 0.0 !   mp9e20.751
assign (resid 67 and name HN) (resid 67 and name HA) 3.772 1.972 0.0 !   mp9e20.750
assign (resid 67 and name HN) (resid 67 and name HB1) 3.644 1.844 0.0 !   mp9e20.745
assign (resid 67 and name HN) (resid 67 and name HB2) 3.492 1.692 0.0 !   mp9e20.749
assign (resid 67 and name HN) (resid 67 and name HD2#) 4.044 2.244 0.0 !   mp9e20.744
assign (resid 68 and name HN) (resid 65 and name HA) 5.063 3.263 0.0 !   mp9e20.765
assign (resid 68 and name HN) (resid 66 and name HA2) 4.738 2.938 0.0 !   mp9e20.764
assign (resid 68 and name HN) (resid 67 and name HA) 4.937 3.137 0.0 !   mp9e20.763
assign (resid 68 and name HN) (resid 67 and name HB1) 5.169 3.369 0.0 !   mp9e20.769
assign (resid 67 and name HN) (resid 68 and name HN) 3.784 1.984 0.0 !   mp9e20.760
assign (resid 68 and name HN) (resid 68 and name HA) 4.415 2.615 0.0 !   mp9e20.767
assign (resid 68 and name HN) (resid 68 and name HB) 3.363 1.563 0.0 !   mp9e20.768
assign (resid 68 and name HN) (resid 68 and name HD1#) 3.979 2.179 0.0 !   mp9e20.770
assign (resid 68 and name HN) (resid 68 and name HG11) 4.328 2.528 0.0 !   mp9e20.771
assign (resid 69 and name HN) (resid 65 and name HA) 4.621 2.821 0.0 !   mp9e20.776
assign (resid 69 and name HN) (resid 68 and name HB) 3.692 1.892 0.0 !   mp9e20.780
assign (resid 69 and name HN) (resid 68 and name HG11) 5.500 3.7 0.0 !   mp9e20.782
assign (resid 69 and name HN) (resid 68 and name HG2#) 5.500 3.7 0.0 !   mp9e20.781
assign (resid 69 and name HN) (resid 68 and name HN) 3.950 2.15 0.0 !   mp9e20.590
assign (resid 68 and name HN) (resid 69 and name HN) 3.708 1.908 0.0 !   mp9e20.762
assign (resid 69 and name HN) (resid 69 and name HA) 3.352 1.552 0.0 !   mp9e20.777
assign (resid 69 and name HN) (resid 69 and name HB2) 3.252 1.452 0.0 !   mp9e20.779
assign (resid 69 and name HN) (resid 69 and name HG1) 4.066 2.266 0.0 !   mp9e20.778
assign (resid 71 and name HN) (resid 67 and name HA) 4.842 3.042 0.0 !   mp9e20.799
assign (resid 71 and name HN) (resid 67 and name HD2#) 5.500 3.7 0.0 !   mp9e20.788
assign (resid 71 and name HN) (resid 67 and name HN) 5.0 3.20 0.0 !   mp9e20.807
assign (resid 71 and name HN) (resid 68 and name HN) 3.878 2.078 0.0 !   mp9e20.810
assign (resid 69 and name HN) (resid 71 and name HN) 5.419 3.619 0.0 !   mp9e20.775
assign (resid 71 and name HN) (resid 70 and name HA) 4.053 2.253 0.0 !   mp9e20.798
assign (resid 71 and name HN) (resid 70 and name HB) 3.588 1.788 0.0 !   mp9e20.794
assign (resid 71 and name HN) (resid 70 and name HG1#) 5.500 3.7 0.0 !   mp9e20.792
assign (resid 71 and name HN) (resid 70 and name HG2#) 5.500 3.7 0.0 !   mp9e20.789
assign (resid 71 and name HN) (resid 70 and name HN) 3.559 1.759 0.0 !   mp9e20.808
assign (resid 71 and name HN) (resid 71 and name HA) 3.601 1.801 0.0 !   mp9e20.801
assign (resid 71 and name HN) (resid 71 and name HB1) 4.018 2.218 0.0 !   mp9e20.797
assign (resid 71 and name HN) (resid 71 and name HB2) 3.565 1.765 0.0 !   mp9e20.796
assign (resid 72 and name HN) (resid 68 and name HG2#) 5.500 3.7 0.0 !   mp9e20.814
assign (resid 72 and name HN) (resid 70 and name HA) 4.442 2.642 0.0 !   mp9e20.819
assign (resid 72 and name HN) (resid 70 and name HN) 5.142 3.342 0.0 !   mp9e20.823
assign (resid 72 and name HN) (resid 71 and name HA) 3.925 2.125 0.0 !   mp9e20.820
assign (resid 71 and name HN) (resid 72 and name HN) 3.498 1.698 0.0 !   mp9e20.806
assign (resid 72 and name HN) (resid 71 and name HN) 3.604 1.804 0.0 !   mp9e20.821
assign (resid 72 and name HN) (resid 72 and name HA) 3.564 1.764 0.0 !   mp9e20.818
assign (resid 72 and name HN) (resid 72 and name HB1) 3.345 1.545 0.0 !   mp9e20.815
assign (resid 72 and name HN) (resid 72 and name HB2) 3.122 1.322 0.0 !   mp9e20.817
assign (resid 72 and name HN) (resid 72 and name HG1) 4.152 2.352 0.0 !   mp9e20.816
assign (resid 73 and name HN) (resid 71 and name HA) 5.515 3.715 0.0 !   mp9e20.836
assign (resid 73 and name HN) (resid 72 and name HA) 3.702 1.902 0.0 !   mp9e20.833
assign (resid 73 and name HN) (resid 72 and name HG2) 3.400 1.6 0.0 !   mp9e20.832
assign (resid 72 and name HN) (resid 73 and name HN) 3.875 2.075 0.0 !   mp9e20.824
assign (resid 73 and name HN) (resid 72 and name HN) 3.985 2.185 0.0 !   mp9e20.837
assign (resid 73 and name HN) (resid 73 and name HA) 3.329 1.529 0.0 !   mp9e20.835
assign (resid 73 and name HN) (resid 73 and name HB2) 2.869 1.069 0.0 !   mp9e20.831
assign (resid 73 and name HN) (resid 73 and name HG1) 3.590 1.79 0.0 !   mp9e20.827
assign (resid 73 and name HN) (resid 73 and name HG2) 4.181 2.381 0.0 !   mp9e20.830
assign (resid 74 and name HN) (resid 71 and name HA) 4.524 2.724 0.0 !   mp9e20.851
assign (resid 74 and name HN) (resid 73 and name HB2) 3.236 1.436 0.0 !   mp9e20.846
assign (resid 74 and name HN) (resid 73 and name HG1) 5.500 3.7 0.0 !   mp9e20.845
assign (resid 74 and name HN) (resid 74 and name HA) 3.189 1.389 0.0 !   mp9e20.850
assign (resid 74 and name HN) (resid 74 and name HB2) 3.401 1.601 0.0 !   mp9e20.847
assign (resid 74 and name HN) (resid 74 and name HG2) 4.051 2.251 0.0 !   mp9e20.849
assign (resid 37 and name HN) (resid 75 and name HD2#) 5.500 3.7 0.0 !   mp9e20.418
assign (resid 39 and name HN) (resid 75 and name HD2#) 5.500 3.7 0.0 !   mp9e20.437
assign (resid 71 and name HN) (resid 75 and name HD1#) 5.500 3.7 0.0 !   mp9e20.783
assign (resid 72 and name HN) (resid 75 and name HD1#) 5.500 3.7 0.0 !   mp9e20.813
assign (resid 75 and name HN) (resid 72 and name HA) 4.615 2.815 0.0 !   mp9e20.862
assign (resid 75 and name HN) (resid 74 and name HA) 3.779 1.979 0.0 !   mp9e20.864
assign (resid 75 and name HN) (resid 74 and name HB1) 4.425 2.625 0.0 !   mp9e20.860
assign (resid 75 and name HN) (resid 74 and name HB2) 4.327 2.527 0.0 !   mp9e20.861
assign (resid 74 and name HN) (resid 75 and name HN) 3.556 1.756 0.0 !   mp9e20.852
assign (resid 75 and name HN) (resid 74 and name HN) 3.752 1.952 0.0 !   mp9e20.867
assign (resid 75 and name HN) (resid 75 and name HA) 4.107 2.307 0.0 !   mp9e20.863
assign (resid 75 and name HN) (resid 75 and name HB1) 4.034 2.234 0.0 !   mp9e20.857
assign (resid 75 and name HN) (resid 75 and name HB2) 3.268 1.468 0.0 !   mp9e20.859
assign (resid 75 and name HN) (resid 75 and name HD1#) 4.123 2.323 0.0 !   mp9e20.858
assign (resid 76 and name HN) (resid 36 and name HE2) 5.500 3.7 0.0 !   mp9e20.879
assign (resid 76 and name HN) (resid 72 and name HA) 5.468 3.668 0.0 !   mp9e20.875
assign (resid 76 and name HN) (resid 73 and name HA) 4.336 2.536 0.0 !   mp9e20.877
assign (resid 74 and name HN) (resid 76 and name HN) 5.384 3.584 0.0 !   mp9e20.855
assign (resid 76 and name HN) (resid 75 and name HA) 5.163 3.363 0.0 !   mp9e20.876
assign (resid 76 and name HN) (resid 75 and name HB1) 4.527 2.727 0.0 !   mp9e20.868
assign (resid 76 and name HN) (resid 75 and name HB2) 3.914 2.114 0.0 !   mp9e20.870
assign (resid 76 and name HN) (resid 75 and name HD1#) 5.500 3.7 0.0 !   mp9e20.869
assign (resid 76 and name HN) (resid 75 and name HN) 3.917 2.117 0.0 !   mp9e20.881
assign (resid 76 and name HN) (resid 76 and name HA) 3.641 1.841 0.0 !   mp9e20.878
assign (resid 76 and name HN) (resid 76 and name HB1) 3.681 1.881 0.0 !   mp9e20.872
assign (resid 76 and name HN) (resid 76 and name HB2) 3.513 1.713 0.0 !   mp9e20.873
assign (resid 77 and name HN) (resid 74 and name HN) 4.033 2.233 0.0 !   mp9e20.483
assign (resid 77 and name HN) (resid 76 and name HA) 3.655 1.855 0.0 !   mp9e20.480
assign (resid 76 and name HN) (resid 77 and name HN) 3.959 2.159 0.0 !   mp9e20.880
assign (resid 37 and name HN) (resid 78 and name HB) 3.842 2.042 0.0 !   mp9e20.432
assign (resid 78 and name HN) (resid 76 and name HA) 4.235 2.435 0.0 !   mp9e20.885
assign (resid 78 and name HN) (resid 77 and name HB#) 4.729 2.929 0.0 !   mp9e20.890
assign (resid 78 and name HN) (resid 77 and name HN) 4.284 2.484 0.0 !   mp9e20.884
assign (resid 78 and name HN) (resid 78 and name HA) 4.094 2.294 0.0 !   mp9e20.887
assign (resid 78 and name HN) (resid 78 and name HG2#) 3.839 2.039 0.0 !   mp9e20.891
assign (resid 37 and name HN) (resid 79 and name HG2#) 5.500 3.7 0.0 !   mp9e20.421




#m46Nhb

assign (resid 13  and name HN  ) (resid 9  and name O   )  2.80 0.50 0.50
assign (resid 13  and name N   ) (resid 9  and name O   )  3.40 0.50 0.60
assign (resid 14  and name HN  ) (resid 10  and name O   )  2.80 0.50 0.50
assign (resid 14  and name N   ) (resid 10  and name O   )  3.40 0.50 0.60
assign (resid 15  and name HN  ) (resid 11  and name O   )  2.80 0.50 0.50
assign (resid 15  and name N   ) (resid 11  and name O   )  3.40 0.50 0.60
assign (resid 30  and name HN  ) (resid 26  and name O   )  2.80 0.50 0.50
assign (resid 30  and name N   ) (resid 26  and name O   )  3.40 0.50 0.60
assign (resid 31  and name HN  ) (resid 27  and name O   )  2.80 0.50 0.50
assign (resid 31  and name N   ) (resid 27  and name O   )  3.40 0.50 0.60
assign (resid 32  and name HN  ) (resid 28  and name O   )  2.80 0.50 0.50
assign (resid 32  and name N   ) (resid 28  and name O   )  3.40 0.50 0.60
assign (resid 33  and name HN  ) (resid 29  and name O   )  2.80 0.50 0.50
assign (resid 33  and name N   ) (resid 29  and name O   )  3.40 0.50 0.60
assign (resid 34  and name HN  ) (resid 30  and name O   )  2.80 0.50 0.50
assign (resid 34  and name N   ) (resid 30  and name O   )  3.40 0.50 0.60
assign (resid 35  and name HN  ) (resid 31  and name O   )  2.80 0.50 0.50
assign (resid 35  and name N   ) (resid 31  and name O   )  3.40 0.50 0.60
assign (resid 45  and name HN  ) (resid 41  and name O   )  2.80 0.50 0.50
assign (resid 45  and name N   ) (resid 41  and name O   )  3.40 0.50 0.60
assign (resid 46  and name HN  ) (resid 42  and name O   )  2.80 0.50 0.50
assign (resid 46  and name N   ) (resid 42  and name O   )  3.40 0.50 0.60
assign (resid 47  and name HN  ) (resid 43  and name O   )  2.80 0.50 0.50
assign (resid 47  and name N   ) (resid 43  and name O   )  3.40 0.50 0.60
assign (resid 48  and name HN  ) (resid 44  and name O   )  2.80 0.50 0.50
assign (resid 48  and name N   ) (resid 44  and name O   )  3.40 0.50 0.60
assign (resid 49  and name HN  ) (resid 45  and name O   )  2.80 0.50 0.50
assign (resid 49  and name N   ) (resid 45  and name O   )  3.40 0.50 0.60
assign (resid 66  and name HN  ) (resid 62  and name O   )  2.80 0.50 0.50
assign (resid 66  and name N   ) (resid 62  and name O   )  3.40 0.50 0.60
assign (resid 67  and name HN  ) (resid 63  and name O   )  2.80 0.50 0.50
assign (resid 67  and name N   ) (resid 63  and name O   )  3.40 0.50 0.60
assign (resid 68  and name HN  ) (resid 64  and name O   )  2.80 0.50 0.50
assign (resid 68  and name N   ) (resid 64  and name O   )  3.40 0.50 0.60
assign (resid 69  and name HN  ) (resid 65  and name O   )  2.80 0.50 0.50
assign (resid 69  and name N   ) (resid 65  and name O   )  3.40 0.50 0.60
assign (resid 70  and name HN  ) (resid 66  and name O   )  2.80 0.50 0.50
assign (resid 70  and name N   ) (resid 66  and name O   )  3.40 0.50 0.60
assign (resid 71  and name HN  ) (resid 67  and name O   )  2.80 0.50 0.50
assign (resid 71  and name N   ) (resid 67  and name O   )  3.40 0.50 0.60
assign (resid 75  and name HN  ) (resid 71  and name O   )  2.80 0.50 0.50
assign (resid 75  and name N   ) (resid 71  and name O   )  3.40 0.50 0.60
assign (resid 76  and name HN  ) (resid 72  and name O   )  2.80 0.50 0.50
assign (resid 76  and name N   ) (resid 72  and name O   )  3.40 0.50 0.60
assign (resid 77  and name HN  ) (resid 73  and name O   )  2.80 0.50 0.50
assign (resid 77  and name N   ) (resid 73  and name O   )  3.40 0.50 0.60


#rdc_N1

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name N   )
       ( resid 9    and name HN  )  0.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )  -3.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 11   and name N   )
       ( resid 11   and name HN  )  -6.8  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name N   )
       ( resid 12   and name HN  )  -6.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name N   )
       ( resid 13   and name HN  )  -0.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )  -8.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )  -4.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name N   )
       ( resid 16   and name HN  )  -3.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name N   )
       ( resid 17   and name HN  )  -3.60  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   )
       ( resid 18   and name HN  )  6.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )  4.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name N   )
       ( resid 20   and name HN  )  1.60  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  -3.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   )
       ( resid 22   and name HN  )  -6.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23   and name N   )
       ( resid 23   and name HN  )  -0.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   )
       ( resid 24   and name HN  )   5.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26   and name N   )
       ( resid 26   and name HN  )  5.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )  3.60  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )  -2.60  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29   and name N   )
       ( resid 29   and name HN  )  3.60  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )  -3.2  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )  0.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )  5.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name N   )
       ( resid 35   and name HN  )  -10.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )  7.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )  -5.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )   -2.90  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )   2.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name N   )
       ( resid 43   and name HN  )   0.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name N   )
       ( resid 44   and name HN  )   5.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   )
       ( resid 45   and name HN  )   8.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )    3.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   )
       ( resid 47   and name HN  )   -0.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name N   )
       ( resid 48   and name HN  )   4.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49   and name N   )
       ( resid 49   and name HN  )   8.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   )
       ( resid 50   and name HN  )    -6.80  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name N   )
       ( resid 51   and name HN  )    -6.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name N   )
       ( resid 52   and name HN  )    1.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   )
       ( resid 53   and name HN  )    -1.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name N   )
       ( resid 54   and name HN  )    -5.90  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name N   )
       ( resid 55   and name HN  )    -7.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name N   )
       ( resid 56   and name HN  )    3.80  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name N   )
       ( resid 58   and name HN  )   3.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   )
       ( resid 59   and name HN  )   0.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 60   and name N   )
       ( resid 60   and name HN  )    -1.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   )
       ( resid 61   and name HN  )   3.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   )
       ( resid 62   and name HN  )   7.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63   and name N   )
       ( resid 63   and name HN  )   -2.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   )
       ( resid 64   and name HN  )   -0.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65   and name N   )
       ( resid 65   and name HN  )   5.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   )
       ( resid 66   and name HN  )   3.10  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   )
       ( resid 67   and name HN  )   1.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   )
       ( resid 68   and name HN  )   3.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   )
       ( resid 69   and name HN  )   6.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   )
       ( resid 70   and name HN  )   4.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71   and name N   )
       ( resid 71   and name HN  )   -0.20  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   )
       ( resid 72   and name HN  )    2.40  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   )
       ( resid 73   and name HN  )    4.50  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   )
       ( resid 74   and name HN  )   6.70  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   )
       ( resid 75   and name HN  )   1.00  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name N   )
       ( resid 76   and name HN  )   0.90  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name N   )
       ( resid 77   and name HN  )   7.30  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78   and name N   )
       ( resid 78   and name HN  )   7.00  1.0000






#rdc_N2

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name HA  )
       ( resid 10   and name CA  )  -5.000  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 11   and name HA  )
       ( resid 11   and name CA  )  -7.260  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name HA  )
       ( resid 12   and name CA  )  10.000  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name HA  )
       ( resid 13   and name CA  )  0.673  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14   and name HA  )
       ( resid 14   and name CA  )  -7.356  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name HA  )
       ( resid 15   and name CA  )  -2.260  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name HA  )
       ( resid 16   and name CA  )  -0.529  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name HA  )
       ( resid 21   and name CA  )  -1.106  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23   and name HA  )
       ( resid 23   and name CA  )  8.702  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name HA  )
       ( resid 24   and name CA  )   -8.365  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name HA  )
       ( resid 25   and name CA  )  0.192  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26   and name HA  )
       ( resid 26   and name CA  )  -0.337  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name HA  )
       ( resid 27   and name CA  )  -6.779  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29   and name HA  )
       ( resid 29   and name CA  )  7.115  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name HA  )
       ( resid 30   and name CA  )  -1.106  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name HA  )
       ( resid 31   and name CA  )  -8.221  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32   and name HA  )
       ( resid 32   and name CA  )  4.423  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name HA  )
       ( resid 33   and name CA  )  5.385  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34   and name HA  )
       ( resid 34   and name CA  )  -2.644  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36   and name HA  )
       ( resid 36   and name CA  )  3.510  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name HA  )
       ( resid 37   and name CA  )  -1.298  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name HA  )
       ( resid 41   and name CA  )   5.433  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name HA  )
       ( resid 42   and name CA  )   -3.029  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name HA  )
       ( resid 43   and name CA  )   -7.933  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name HA  )
       ( resid 45   and name CA  )   3.990  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46   and name HA  )
       ( resid 46   and name CA  )   -4.710  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name HA  )
       ( resid 47   and name CA  )   -4.135  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name HA  )
       ( resid 48   and name CA  )   7.596  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49   and name HA  )
       ( resid 49   and name CA  )   -1.010 1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name HA  )
       ( resid 50   and name CA  )    -6.731  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name HA  )
       ( resid 52   and name CA  )    8.365  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name HA  )
       ( resid 53   and name CA  )    1.635  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name HA  )
       ( resid 54   and name CA  )    7.885  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name HA  )
       ( resid 55   and name CA  )    -4.375  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name HA  )
       ( resid 56   and name CA  )    9.808  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name HA  )
       ( resid 58   and name CA  )   6.731  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name HA  )
       ( resid 59   and name CA  )   3.317  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 60   and name HA  )
       ( resid 60   and name CA  )    -3.221  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name HA  )
       ( resid 61   and name CA  )   2.837  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name HA  )
       ( resid 64   and name CA  )   -4.904  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65   and name HA  )
       ( resid 65   and name CA  )   10.385  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name HA  )
       ( resid 68   and name CA  )   -3.606  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name HA  )
       ( resid 69   and name CA  )   7.789  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name HA  )
       ( resid 70   and name CA  )   -9.471  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71   and name HA  )
       ( resid 71   and name CA  )   -1.298  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name HA  )
       ( resid 72   and name CA  )    -3.894  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name HA  )
       ( resid 73   and name CA  )    3.750  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name HA  )
       ( resid 75   and name CA  )   -8.221  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name HA  )
       ( resid 76   and name CA  )   -2.019  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name HA  )
       ( resid 77   and name CA  )   6.202  1.0000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78   and name HA  )
       ( resid 78   and name CA  )   -2.837  1.0000



  Entry H atom name         Submitted Coord H atom name
    1   1H    SER   2          HN        SER   2  13.247  70.910  -4.604
    2    HA   SER   2           HA       SER   2  11.112  71.950  -4.306
    3   1HB   SER   2          HB2       SER   2  13.358  73.711  -3.367
    4   2HB   SER   2          HB1       SER   2  11.697  74.270  -3.189
    5    HG   SER   2           HG       SER   2  13.059  72.255  -1.887
    6    H    ALA   3           HN       ALA   3  10.034  74.319  -4.615
    7    HA   ALA   3           HA       ALA   3  10.777  75.302  -7.353
    8   1HB   ALA   3          HB1       ALA   3   8.330  75.464  -7.750
    9   2HB   ALA   3          HB2       ALA   3   8.037  74.809  -6.139
   10   3HB   ALA   3          HB3       ALA   3   8.812  73.811  -7.369
   11    H    THR   4           HN       THR   4  10.868  77.524  -7.534
   12    HA   THR   4           HA       THR   4  10.790  79.189  -5.168
   13    HB   THR   4           HB       THR   4  10.781  79.915  -8.118
   14    HG1  THR   4           HG1      THR   4  12.900  79.387  -6.308
   15   1HG2  THR   4          HG21      THR   4  11.996  81.942  -7.275
   16   2HG2  THR   4          HG22      THR   4  11.642  81.413  -5.630
   17   3HG2  THR   4          HG23      THR   4  10.324  81.843  -6.721
   18    H    ARG   5           HN       ARG   5   8.477  78.423  -7.710
   19    HA   ARG   5           HA       ARG   5   6.630  80.570  -7.385
   20   1HB   ARG   5          HB2       ARG   5   6.664  78.857  -9.199
   21   2HB   ARG   5          HB1       ARG   5   6.115  77.649  -8.037
   22   1HG   ARG   5          HG2       ARG   5   4.075  78.984  -7.619
   23   2HG   ARG   5          HG1       ARG   5   4.619  80.174  -8.802
   24   1HD   ARG   5          HD2       ARG   5   3.067  78.691  -9.934
   25   2HD   ARG   5          HD1       ARG   5   4.694  78.268 -10.504
   26    HE   ARG   5           HE       ARG   5   3.727  76.814  -8.118
   27   1HH1  ARG   5          HH21      ARG   5   5.877  76.232 -10.370
   28   2HH1  ARG   5          HH22      ARG   5   5.158  74.823 -11.074
   29   1HH2  ARG   5          HH11      ARG   5   2.095  75.283  -9.515
   30   2HH2  ARG   5          HH12      ARG   5   3.016  74.286 -10.590
   31    H    ALA   6           HN       ALA   6   6.907  77.460  -5.662
   32    HA   ALA   6           HA       ALA   6   4.528  77.638  -4.094
   33   1HB   ALA   6          HB1       ALA   6   5.897  75.616  -4.355
   34   2HB   ALA   6          HB2       ALA   6   5.754  76.017  -2.643
   35   3HB   ALA   6          HB3       ALA   6   7.239  76.396  -3.517
   36    H    ASN   7           HN       ASN   7   7.828  78.834  -3.483
   37    HA   ASN   7           HA       ASN   7   7.411  79.792  -0.816
   38   1HB   ASN   7          HB2       ASN   7   9.257  80.584  -3.087
   39   2HB   ASN   7          HB1       ASN   7   9.411  81.245  -1.459
   40   1HD2  ASN   7          HD21      ASN   7  11.359  79.475  -2.849
   41   2HD2  ASN   7          HD22      ASN   7  11.499  78.084  -1.887
   42    H    LYS   8           HN       LYS   8   6.974  81.343  -3.988
   43    HA   LYS   8           HA       LYS   8   6.371  83.984  -3.051
   44   1HB   LYS   8          HB2       LYS   8   6.979  83.398  -5.362
   45   2HB   LYS   8          HB1       LYS   8   5.497  82.457  -5.528
   46   1HG   LYS   8          HG2       LYS   8   5.178  84.652  -6.551
   47   2HG   LYS   8          HG1       LYS   8   4.175  84.525  -5.105
   48   1HD   LYS   8          HD2       LYS   8   5.844  85.765  -3.806
   49   2HD   LYS   8          HD1       LYS   8   6.905  85.845  -5.213
   50   1HE   LYS   8          HE2       LYS   8   4.087  86.911  -5.389
   51   2HE   LYS   8          HE1       LYS   8   5.390  87.911  -4.715
   52   1HZ   LYS   8          HZ1       LYS   8   5.633  86.454  -7.287
   53   2HZ   LYS   8          HZ2       LYS   8   6.671  87.648  -6.668
   54   3HZ   LYS   8          HZ3       LYS   8   5.109  88.064  -7.192
   55    H    ASP   9           HN       ASP   9   4.228  81.228  -3.840
   56    HA   ASP   9           HA       ASP   9   1.742  82.555  -3.339
   57   1HB   ASP   9          HB2       ASP   9   2.212  80.354  -4.524
   58   2HB   ASP   9          HB1       ASP   9   2.404  79.626  -2.928
   59    H    ILE  10           HN       ILE  10   3.700  80.439  -1.208
   60    HA   ILE  10           HA       ILE  10   2.005  80.679   1.113
   61    HB   ILE  10           HB       ILE  10   4.971  80.093   0.823
   62   1HG1  ILE  10          HG12      ILE  10   3.558  78.586  -0.530
   63   2HG1  ILE  10          HG11      ILE  10   4.257  77.723   0.836
   64   1HG2  ILE  10          HG21      ILE  10   4.825  79.031   2.985
   65   2HG2  ILE  10          HG22      ILE  10   3.080  79.276   3.045
   66   3HG2  ILE  10          HG23      ILE  10   4.168  80.660   3.150
   67   1HD1  ILE  10          HD11      ILE  10   1.426  78.777   0.591
   68   2HD1  ILE  10          HD12      ILE  10   2.106  78.164   2.098
   69   3HD1  ILE  10          HD13      ILE  10   1.933  77.091   0.709
   70    H    PHE  11           HN       PHE  11   4.947  82.514   0.176
   71    HA   PHE  11           HA       PHE  11   5.105  84.069   2.564
   72   1HB   PHE  11          HB2       PHE  11   6.826  83.860   0.734
   73   2HB   PHE  11          HB1       PHE  11   5.817  84.900  -0.271
   74    HD1  PHE  11           HD1      PHE  11   5.487  87.269   0.287
   75    HD2  PHE  11           HD2      PHE  11   8.029  84.744   2.657
   76    HE1  PHE  11           HE1      PHE  11   6.465  89.273   1.374
   77    HE2  PHE  11           HE2      PHE  11   9.007  86.747   3.743
   78    HZ   PHE  11           HZ       PHE  11   8.225  89.011   3.101
   79    H    THR  12           HN       THR  12   3.569  85.023  -0.542
   80    HA   THR  12           HA       THR  12   2.478  87.480   0.366
   81    HB   THR  12           HB       THR  12   1.424  85.521  -1.703
   82    HG1  THR  12           HG1      THR  12   3.258  85.991  -2.594
   83   1HG2  THR  12          HG21      THR  12  -0.211  87.249  -1.235
   84   2HG2  THR  12          HG22      THR  12   0.563  87.620  -2.776
   85   3HG2  THR  12          HG23      THR  12   1.029  88.500  -1.320
   86    H    LEU  13           HN       LEU  13   1.124  84.172   0.476
   87    HA   LEU  13           HA       LEU  13  -1.507  84.814   1.378
   88   1HB   LEU  13          HB2       LEU  13   0.284  82.516   1.149
   89   2HB   LEU  13          HB1       LEU  13  -0.725  82.403   2.588
   90    HG   LEU  13           HG       LEU  13  -1.940  83.151  -0.063
   91   1HD1  LEU  13          HD11      LEU  13  -0.553  80.972  -0.168
   92   2HD1  LEU  13          HD12      LEU  13  -2.243  80.880  -0.665
   93   3HD1  LEU  13          HD13      LEU  13  -1.761  80.305   0.931
   94   1HD2  LEU  13          HD21      LEU  13  -2.938  81.788   2.459
   95   2HD2  LEU  13          HD22      LEU  13  -3.915  82.043   1.013
   96   3HD2  LEU  13          HD23      LEU  13  -3.319  83.427   1.930
   97    H    PHE  14           HN       PHE  14   1.478  84.142   3.168
   98    HA   PHE  14           HA       PHE  14   0.333  84.538   5.819
   99   1HB   PHE  14          HB2       PHE  14   3.014  84.167   4.542
  100   2HB   PHE  14          HB1       PHE  14   2.976  84.864   6.163
  101    HD1  PHE  14           HD1      PHE  14   1.700  81.975   4.154
  102    HD2  PHE  14           HD2      PHE  14   2.677  83.472   8.049
  103    HE1  PHE  14           HE1      PHE  14   1.337  79.724   5.135
  104    HE2  PHE  14           HE2      PHE  14   2.320  81.251   9.018
  105    HZ   PHE  14           HZ       PHE  14   1.654  79.390   7.571
  106    H    ASP  15           HN       ASP  15   1.483  86.612   3.278
  107    HA   ASP  15           HA       ASP  15   1.932  88.891   5.086
  108   1HB   ASP  15          HB2       ASP  15   3.419  88.529   3.169
  109   2HB   ASP  15          HB1       ASP  15   2.046  88.468   2.064
  110    H    LYS  16           HN       LYS  16  -0.287  88.865   5.900
  111    HA   LYS  16           HA       LYS  16  -2.531  89.445   4.084
  112   1HB   LYS  16          HB2       LYS  16  -2.202  89.292   7.084
  113   2HB   LYS  16          HB1       LYS  16  -3.754  89.434   6.257
  114   1HG   LYS  16          HG2       LYS  16  -3.306  87.323   5.053
  115   2HG   LYS  16          HG1       LYS  16  -1.761  87.175   5.892
  116   1HD   LYS  16          HD2       LYS  16  -2.939  87.105   8.059
  117   2HD   LYS  16          HD1       LYS  16  -4.485  87.248   7.222
  118   1HE   LYS  16          HE2       LYS  16  -4.359  85.086   6.335
  119   2HE   LYS  16          HE1       LYS  16  -2.589  85.032   6.466
  120   1HZ   LYS  16          HZ1       LYS  16  -2.804  85.095   8.877
  121   2HZ   LYS  16          HZ2       LYS  16  -3.617  83.746   8.239
  122   3HZ   LYS  16          HZ3       LYS  16  -4.495  85.109   8.746
  123    H    LYS  17           HN       LYS  17  -0.114  91.444   4.946
  124    HA   LYS  17           HA       LYS  17  -1.879  93.722   5.732
  125   1HB   LYS  17          HB2       LYS  17   0.196  94.739   6.532
  126   2HB   LYS  17          HB1       LYS  17   0.067  93.102   7.166
  127   1HG   LYS  17          HG2       LYS  17   1.418  92.631   4.842
  128   2HG   LYS  17          HG1       LYS  17   2.017  94.234   5.249
  129   1HD   LYS  17          HD2       LYS  17   1.956  92.630   7.642
  130   2HD   LYS  17          HD1       LYS  17   2.805  91.742   6.378
  131   1HE   LYS  17          HE2       LYS  17   4.488  93.353   6.188
  132   2HE   LYS  17          HE1       LYS  17   3.453  94.650   6.819
  133   1HZ   LYS  17          HZ1       LYS  17   4.556  92.347   8.335
  134   2HZ   LYS  17          HZ2       LYS  17   3.383  93.411   8.951
  135   3HZ   LYS  17          HZ3       LYS  17   4.933  93.986   8.556
  136    H    GLY  18           HN       GLY  18   0.281  92.545   3.232
  137   1HA   GLY  18          HA2       GLY  18   0.339  93.272   0.967
  138   2HA   GLY  18          HA1       GLY  18  -0.658  94.658   1.413
  139    H    GLN  19           HN       GLN  19   2.318  93.697   3.048
  140    HA   GLN  19           HA       GLN  19   3.548  96.286   2.169
  141   1HB   GLN  19          HB2       GLN  19   2.901  95.888   4.596
  142   2HB   GLN  19          HB1       GLN  19   4.144  94.637   4.638
  143   1HG   GLN  19          HG2       GLN  19   5.164  96.648   5.456
  144   2HG   GLN  19          HG1       GLN  19   5.784  96.397   3.824
  145   1HE2  GLN  19          HE21      GLN  19   5.882  98.382   2.767
  146   2HE2  GLN  19          HE22      GLN  19   4.698  99.594   2.858
  147    H    GLY  20           HN       GLY  20   3.800  92.907   1.783
  148   1HA   GLY  20          HA2       GLY  20   5.430  91.666   0.635
  149   2HA   GLY  20          HA1       GLY  20   6.358  93.153   0.432
  150    H    ALA  21           HN       ALA  21   5.250  91.776   3.514
  151    HA   ALA  21           HA       ALA  21   7.854  90.642   4.193
  152   1HB   ALA  21          HB1       ALA  21   7.000  93.239   5.507
  153   2HB   ALA  21          HB2       ALA  21   8.202  93.138   4.220
  154   3HB   ALA  21          HB3       ALA  21   8.508  92.366   5.776
  155    H    ILE  22           HN       ILE  22   7.224  88.952   5.423
  156    HA   ILE  22           HA       ILE  22   4.777  89.141   7.100
  157    HB   ILE  22           HB       ILE  22   5.025  86.704   7.242
  158   1HG1  ILE  22          HG12      ILE  22   7.610  87.034   5.682
  159   2HG1  ILE  22          HG11      ILE  22   7.540  86.727   7.421
  160   1HG2  ILE  22          HG21      ILE  22   4.088  87.770   5.154
  161   2HG2  ILE  22          HG22      ILE  22   4.755  86.155   4.913
  162   3HG2  ILE  22          HG23      ILE  22   5.678  87.573   4.416
  163   1HD1  ILE  22          HD11      ILE  22   6.167  84.669   6.911
  164   2HD1  ILE  22          HD12      ILE  22   7.829  84.598   6.324
  165   3HD1  ILE  22          HD13      ILE  22   6.511  84.938   5.202
  166    H    ALA  23           HN       ALA  23   4.858  88.679   9.389
  167    HA   ALA  23           HA       ALA  23   7.084  89.790  10.811
  168   1HB   ALA  23          HB1       ALA  23   4.775  87.992  11.617
  169   2HB   ALA  23          HB2       ALA  23   4.848  89.750  11.745
  170   3HB   ALA  23          HB3       ALA  23   5.862  88.747  12.782
  171    H    LYS  24           HN       LYS  24   8.428  88.570  12.413
  172    HA   LYS  24           HA       LYS  24   9.756  86.298  11.158
  173   1HB   LYS  24          HB2       LYS  24  10.159  88.218  13.315
  174   2HB   LYS  24          HB1       LYS  24  10.641  86.597  13.809
  175   1HG   LYS  24          HG2       LYS  24  11.699  86.739  11.275
  176   2HG   LYS  24          HG1       LYS  24  11.873  88.402  11.830
  177   1HD   LYS  24          HD2       LYS  24  12.846  85.938  13.313
  178   2HD   LYS  24          HD1       LYS  24  13.864  87.064  12.416
  179   1HE   LYS  24          HE2       LYS  24  12.476  88.764  14.099
  180   2HE   LYS  24          HE1       LYS  24  12.728  87.334  15.118
  181   1HZ   LYS  24          HZ1       LYS  24  15.049  87.329  14.539
  182   2HZ   LYS  24          HZ2       LYS  24  14.644  88.859  15.155
  183   3HZ   LYS  24          HZ3       LYS  24  14.839  88.638  13.482
  184    H    ASP  25           HN       ASP  25   6.964  86.484  13.056
  185    HA   ASP  25           HA       ASP  25   7.404  84.030  14.612
  186   1HB   ASP  25          HB2       ASP  25   5.073  85.896  14.107
  187   2HB   ASP  25          HB1       ASP  25   4.960  84.489  15.164
  188    H    SER  26           HN       SER  26   6.761  84.574  11.369
  189    HA   SER  26           HA       SER  26   4.976  82.193  11.119
  190   1HB   SER  26          HB2       SER  26   5.387  84.773   9.720
  191   2HB   SER  26          HB1       SER  26   5.006  83.398   8.683
  192    HG   SER  26           HG       SER  26   3.539  84.398  10.898
  193    H    LEU  27           HN       LEU  27   8.245  82.871  10.976
  194    HA   LEU  27           HA       LEU  27   9.241  81.934   8.544
  195   1HB   LEU  27          HB2       LEU  27  10.087  82.092  11.352
  196   2HB   LEU  27          HB1       LEU  27  10.978  80.901  10.413
  197    HG   LEU  27           HG       LEU  27  11.268  82.736   8.645
  198   1HD1  LEU  27          HD11      LEU  27  10.737  84.929   9.137
  199   2HD1  LEU  27          HD12      LEU  27  10.887  84.685  10.876
  200   3HD1  LEU  27          HD13      LEU  27   9.451  84.117  10.026
  201   1HD2  LEU  27          HD21      LEU  27  13.240  83.579   9.730
  202   2HD2  LEU  27          HD22      LEU  27  13.008  81.934  10.320
  203   3HD2  LEU  27          HD23      LEU  27  12.550  83.305  11.330
  204    H    GLY  28           HN       GLY  28   8.866  79.836  11.455
  205   1HA   GLY  28          HA2       GLY  28   9.328  77.384  10.083
  206   2HA   GLY  28          HA1       GLY  28   8.481  77.528  11.624
  207    H    ASP  29           HN       ASP  29   6.307  79.075  10.883
  208    HA   ASP  29           HA       ASP  29   4.453  77.185   9.852
  209   1HB   ASP  29          HB2       ASP  29   4.279  79.489  11.161
  210   2HB   ASP  29          HB1       ASP  29   4.037  80.135   9.538
  211    H    TYR  30           HN       TYR  30   6.692  79.296   8.180
  212    HA   TYR  30           HA       TYR  30   5.189  79.192   5.637
  213   1HB   TYR  30          HB2       TYR  30   6.206  81.267   6.240
  214   2HB   TYR  30          HB1       TYR  30   7.723  80.483   6.673
  215    HD1  TYR  30           HD1      TYR  30   5.667  81.783   3.926
  216    HD2  TYR  30           HD2      TYR  30   9.222  79.614   4.949
  217    HE1  TYR  30           HE1      TYR  30   6.522  82.101   1.619
  218    HE2  TYR  30           HE2      TYR  30  10.085  79.931   2.641
  219    HH   TYR  30           HH       TYR  30   9.253  82.078   0.654
  220    H    LEU  31           HN       LEU  31   8.103  77.799   7.129
  221    HA   LEU  31           HA       LEU  31   9.224  76.664   4.758
  222   1HB   LEU  31          HB2       LEU  31   9.413  75.943   7.694
  223   2HB   LEU  31          HB1       LEU  31  10.460  75.253   6.457
  224    HG   LEU  31           HG       LEU  31  10.168  78.230   6.927
  225   1HD1  LEU  31          HD11      LEU  31  12.565  76.595   7.724
  226   2HD1  LEU  31          HD12      LEU  31  11.198  76.754   8.827
  227   3HD1  LEU  31          HD13      LEU  31  12.072  78.190   8.294
  228   1HD2  LEU  31          HD21      LEU  31  12.535  77.938   5.730
  229   2HD2  LEU  31          HD22      LEU  31  11.045  78.036   4.792
  230   3HD2  LEU  31          HD23      LEU  31  11.776  76.466   5.123
  231    H    ARG  32           HN       ARG  32   6.840  75.513   7.073
  232    HA   ARG  32           HA       ARG  32   6.716  72.760   6.170
  233   1HB   ARG  32          HB2       ARG  32   4.845  74.598   7.686
  234   2HB   ARG  32          HB1       ARG  32   4.520  72.880   7.447
  235   1HG   ARG  32          HG2       ARG  32   6.772  72.394   8.473
  236   2HG   ARG  32          HG1       ARG  32   6.892  74.107   8.876
  237   1HD   ARG  32          HD2       ARG  32   4.715  73.902  10.133
  238   2HD   ARG  32          HD1       ARG  32   4.790  72.149   9.864
  239    HE   ARG  32           HE       ARG  32   7.130  72.332  10.960
  240   1HH1  ARG  32          HH21      ARG  32   6.006  75.359  11.269
  241   2HH1  ARG  32          HH22      ARG  32   5.879  75.385  12.996
  242   1HH2  ARG  32          HH11      ARG  32   6.321  71.963  13.345
  243   2HH2  ARG  32          HH12      ARG  32   6.057  73.462  14.171
  244    H    ALA  33           HN       ALA  33   4.884  75.698   5.375
  245    HA   ALA  33           HA       ALA  33   2.967  74.426   3.633
  246   1HB   ALA  33          HB1       ALA  33   3.836  77.263   3.266
  247   2HB   ALA  33          HB2       ALA  33   3.162  76.803   4.829
  248   3HB   ALA  33          HB3       ALA  33   2.207  76.596   3.361
  249    H    ILE  34           HN       ILE  34   6.311  75.272   3.174
  250    HA   ILE  34           HA       ILE  34   5.997  75.222   0.202
  251    HB   ILE  34           HB       ILE  34   8.262  76.168   0.211
  252   1HG1  ILE  34          HG12      ILE  34   8.067  76.148   3.234
  253   2HG1  ILE  34          HG11      ILE  34   8.995  74.961   2.314
  254   1HG2  ILE  34          HG21      ILE  34   6.330  77.676   0.403
  255   2HG2  ILE  34          HG22      ILE  34   7.704  78.308   1.310
  256   3HG2  ILE  34          HG23      ILE  34   6.373  77.521   2.159
  257   1HD1  ILE  34          HD11      ILE  34   9.390  77.938   1.962
  258   2HD1  ILE  34          HD12      ILE  34  10.451  76.633   1.434
  259   3HD1  ILE  34          HD13      ILE  34  10.299  77.006   3.150
  260    H    GLY  35           HN       GLY  35   7.051  73.162   2.822
  261   1HA   GLY  35          HA2       GLY  35   7.260  70.782   1.862
  262   2HA   GLY  35          HA1       GLY  35   8.508  71.476   0.833
  263    H    TYR  36           HN       TYR  36   9.120  73.199   3.466
  264    HA   TYR  36           HA       TYR  36  11.100  71.215   4.428
  265   1HB   TYR  36          HB2       TYR  36  10.741  74.200   4.811
  266   2HB   TYR  36          HB1       TYR  36  12.068  73.278   5.515
  267    HD1  TYR  36           HD1      TYR  36  11.561  75.480   3.071
  268    HD2  TYR  36           HD2      TYR  36  12.865  71.411   3.457
  269    HE1  TYR  36           HE1      TYR  36  12.794  75.678   0.932
  270    HE2  TYR  36           HE2      TYR  36  14.108  71.607   1.315
  271    HH   TYR  36           HH       TYR  36  15.114  74.058  -0.007
  272    H    ASN  37           HN       ASN  37  11.136  70.391   6.368
  273    HA   ASN  37           HA       ASN  37   9.086  71.221   8.409
  274   1HB   ASN  37          HB2       ASN  37   9.852  68.572   7.227
  275   2HB   ASN  37          HB1       ASN  37   9.282  68.622   8.896
  276   1HD2  ASN  37          HD21      ASN  37   7.079  69.575   9.259
  277   2HD2  ASN  37          HD22      ASN  37   5.940  69.541   8.002
  278    HA   PRO  38           HA       PRO  38  13.512  70.830  10.064
  279   1HB   PRO  38          HB2       PRO  38  14.036  73.467  10.559
  280   2HB   PRO  38          HB1       PRO  38  14.425  72.678   9.017
  281   1HG   PRO  38          HG2       PRO  38  12.150  74.460   9.709
  282   2HG   PRO  38          HG1       PRO  38  13.085  74.350   8.210
  283   1HD   PRO  38          HD2       PRO  38  10.594  73.264   8.545
  284   2HD   PRO  38          HD1       PRO  38  11.793  72.665   7.379
  285    H    THR  39           HN       THR  39  14.176  72.391  12.233
  286    HA   THR  39           HA       THR  39  11.756  72.326  14.011
  287    HB   THR  39           HB       THR  39  13.427  71.451  15.737
  288    HG1  THR  39           HG1      THR  39  15.383  70.912  15.073
  289   1HG2  THR  39          HG21      THR  39  11.787  70.012  14.522
  290   2HG2  THR  39          HG22      THR  39  13.276  69.159  14.930
  291   3HG2  THR  39          HG23      THR  39  13.007  69.726  13.282
  292    H    ASN  40           HN       ASN  40  12.393  73.535  16.187
  293    HA   ASN  40           HA       ASN  40  12.975  76.256  15.616
  294   1HB   ASN  40          HB2       ASN  40  11.767  75.346  17.597
  295   2HB   ASN  40          HB1       ASN  40  13.292  74.701  18.207
  296   1HD2  ASN  40          HD21      ASN  40  11.533  77.723  17.541
  297   2HD2  ASN  40          HD22      ASN  40  12.539  78.713  18.484
  298    H    GLN  41           HN       GLN  41  15.098  73.638  16.791
  299    HA   GLN  41           HA       GLN  41  17.437  75.206  17.284
  300   1HB   GLN  41          HB2       GLN  41  17.082  72.855  17.997
  301   2HB   GLN  41          HB1       GLN  41  17.136  72.341  16.311
  302   1HG   GLN  41          HG2       GLN  41  19.445  73.169  16.116
  303   2HG   GLN  41          HG1       GLN  41  19.397  73.722  17.789
  304   1HE2  GLN  41          HE21      GLN  41  21.375  71.884  17.166
  305   2HE2  GLN  41          HE22      GLN  41  20.998  70.361  17.813
  306    H    LEU  42           HN       LEU  42  16.207  73.703  14.310
  307    HA   LEU  42           HA       LEU  42  18.518  74.459  12.691
  308   1HB   LEU  42          HB2       LEU  42  16.762  72.576  12.371
  309   2HB   LEU  42          HB1       LEU  42  15.717  73.846  11.732
  310    HG   LEU  42           HG       LEU  42  18.522  73.519  10.690
  311   1HD1  LEU  42          HD11      LEU  42  17.329  72.182   8.812
  312   2HD1  LEU  42          HD12      LEU  42  16.070  71.899  10.013
  313   3HD1  LEU  42          HD13      LEU  42  17.714  71.335  10.310
  314   1HD2  LEU  42          HD21      LEU  42  16.979  74.275   8.612
  315   2HD2  LEU  42          HD22      LEU  42  17.672  75.436   9.743
  316   3HD2  LEU  42          HD23      LEU  42  15.999  74.911   9.933
  317    H    VAL  43           HN       VAL  43  15.254  75.704  13.242
  318    HA   VAL  43           HA       VAL  43  15.327  77.905  11.385
  319    HB   VAL  43           HB       VAL  43  13.796  77.489  13.976
  320   1HG1  VAL  43          HG11      VAL  43  13.427  79.382  11.645
  321   2HG1  VAL  43          HG12      VAL  43  13.542  79.780  13.359
  322   3HG1  VAL  43          HG13      VAL  43  12.106  78.967  12.738
  323   1HG2  VAL  43          HG21      VAL  43  13.727  75.805  11.898
  324   2HG2  VAL  43          HG22      VAL  43  12.639  77.034  11.255
  325   3HG2  VAL  43          HG23      VAL  43  12.262  76.234  12.780
  326    H    GLN  44           HN       GLN  44  15.945  77.784  14.902
  327    HA   GLN  44           HA       GLN  44  16.588  80.578  15.198
  328   1HB   GLN  44          HB2       GLN  44  17.240  78.091  16.806
  329   2HB   GLN  44          HB1       GLN  44  17.533  79.733  17.381
  330   1HG   GLN  44          HG2       GLN  44  14.820  78.764  16.450
  331   2HG   GLN  44          HG1       GLN  44  15.336  78.723  18.136
  332   1HE2  GLN  44          HE21      GLN  44  13.362  80.505  16.364
  333   2HE2  GLN  44          HE22      GLN  44  13.699  82.068  16.932
  334    H    ASP  45           HN       ASP  45  18.592  77.683  14.672
  335    HA   ASP  45           HA       ASP  45  21.150  78.948  14.949
  336   1HB   ASP  45          HB2       ASP  45  20.077  76.502  13.542
  337   2HB   ASP  45          HB1       ASP  45  21.779  76.939  13.398
  338    H    ILE  46           HN       ILE  46  19.035  78.644  12.072
  339    HA   ILE  46           HA       ILE  46  21.079  79.901  10.383
  340    HB   ILE  46           HB       ILE  46  19.364  79.687   8.637
  341   1HG1  ILE  46          HG12      ILE  46  17.503  78.775  10.856
  342   2HG1  ILE  46          HG11      ILE  46  17.435  80.355  10.082
  343   1HG2  ILE  46          HG21      ILE  46  18.885  77.207   8.932
  344   2HG2  ILE  46          HG22      ILE  46  19.630  77.338  10.525
  345   3HG2  ILE  46          HG23      ILE  46  20.580  77.673   9.077
  346   1HD1  ILE  46          HD11      ILE  46  16.874  79.416   7.968
  347   2HD1  ILE  46          HD12      ILE  46  15.855  78.580   9.140
  348   3HD1  ILE  46          HD13      ILE  46  17.295  77.788   8.500
  349    H    ILE  47           HN       ILE  47  18.427  81.031  12.360
  350    HA   ILE  47           HA       ILE  47  18.199  83.649  11.032
  351    HB   ILE  47           HB       ILE  47  17.085  82.409  13.573
  352   1HG1  ILE  47          HG12      ILE  47  15.726  83.084  10.969
  353   2HG1  ILE  47          HG11      ILE  47  16.496  81.538  11.264
  354   1HG2  ILE  47          HG21      ILE  47  15.383  84.355  13.251
  355   2HG2  ILE  47          HG22      ILE  47  16.650  85.116  12.289
  356   3HG2  ILE  47          HG23      ILE  47  16.938  84.742  13.988
  357   1HD1  ILE  47          HD11      ILE  47  15.066  81.406  13.394
  358   2HD1  ILE  47          HD12      ILE  47  14.214  81.205  11.863
  359   3HD1  ILE  47          HD13      ILE  47  14.141  82.746  12.717
  360    H    ASN  48           HN       ASN  48  18.930  82.804  14.432
  361    HA   ASN  48           HA       ASN  48  20.101  85.264  15.181
  362   1HB   ASN  48          HB2       ASN  48  20.685  82.428  16.097
  363   2HB   ASN  48          HB1       ASN  48  21.142  83.881  16.988
  364   1HD2  ASN  48          HD21      ASN  48  18.437  81.815  16.099
  365   2HD2  ASN  48          HD22      ASN  48  17.285  82.586  17.073
  366    H    ALA  49           HN       ALA  49  21.473  82.581  13.374
  367    HA   ALA  49           HA       ALA  49  24.243  83.332  13.674
  368   1HB   ALA  49          HB1       ALA  49  23.647  81.104  13.026
  369   2HB   ALA  49          HB2       ALA  49  24.446  81.827  11.630
  370   3HB   ALA  49          HB3       ALA  49  22.688  81.688  11.667
  371    H    ASP  50           HN       ASP  50  21.635  84.761  11.903
  372    HA   ASP  50           HA       ASP  50  23.560  86.022   9.972
  373   1HB   ASP  50          HB2       ASP  50  21.561  84.728   9.132
  374   2HB   ASP  50          HB1       ASP  50  20.527  85.912   9.930
  375    H    SER  51           HN       SER  51  24.261  87.962  10.710
  376    HA   SER  51           HA       SER  51  23.195  89.498  12.821
  377   1HB   SER  51          HB2       SER  51  25.451  89.691  11.804
  378   2HB   SER  51          HB1       SER  51  24.730  90.416  10.370
  379    HG   SER  51           HG       SER  51  25.197  91.477  12.877
  380    H    SER  52           HN       SER  52  22.103  89.325   9.496
  381    HA   SER  52           HA       SER  52  20.573  91.853   9.715
  382   1HB   SER  52          HB2       SER  52  21.847  90.923   7.660
  383   2HB   SER  52          HB1       SER  52  20.493  89.810   7.487
  384    HG   SER  52           HG       SER  52  20.290  92.641   7.642
  385    H    LEU  53           HN       LEU  53  19.932  88.343   9.578
  386    HA   LEU  53           HA       LEU  53  17.015  88.841   9.842
  387   1HB   LEU  53          HB2       LEU  53  18.595  86.256   9.714
  388   2HB   LEU  53          HB1       LEU  53  16.859  86.436   9.498
  389    HG   LEU  53           HG       LEU  53  18.954  87.710   7.713
  390   1HD1  LEU  53          HD11      LEU  53  17.120  85.410   7.020
  391   2HD1  LEU  53          HD12      LEU  53  18.743  85.153   7.661
  392   3HD1  LEU  53          HD13      LEU  53  18.524  85.992   6.125
  393   1HD2  LEU  53          HD21      LEU  53  17.254  88.833   6.730
  394   2HD2  LEU  53          HD22      LEU  53  16.254  88.368   8.103
  395   3HD2  LEU  53          HD23      LEU  53  16.255  87.384   6.642
  396    H    ARG  54           HN       ARG  54  19.717  88.285  11.874
  397    HA   ARG  54           HA       ARG  54  18.775  86.739  14.025
  398   1HB   ARG  54          HB2       ARG  54  21.061  87.501  13.828
  399   2HB   ARG  54          HB1       ARG  54  20.558  89.189  13.805
  400   1HG   ARG  54          HG2       ARG  54  20.580  89.296  16.051
  401   2HG   ARG  54          HG1       ARG  54  19.549  87.877  16.159
  402   1HD   ARG  54          HD2       ARG  54  21.439  86.383  16.117
  403   2HD   ARG  54          HD1       ARG  54  22.538  87.703  15.670
  404    HE   ARG  54           HE       ARG  54  22.380  88.557  17.909
  405   1HH1  ARG  54          HH11      ARG  54  19.438  88.012  18.307
  406   2HH1  ARG  54          HH12      ARG  54  19.471  86.786  19.530
  407   1HH2  ARG  54          HH21      ARG  54  22.824  86.035  19.063
  408   2HH2  ARG  54          HH22      ARG  54  21.388  85.666  19.958
  409    H    ASP  55           HN       ASP  55  18.304  90.218  13.412
  410    HA   ASP  55           HA       ASP  55  16.153  90.182  15.487
  411   1HB   ASP  55          HB2       ASP  55  18.528  91.872  15.042
  412   2HB   ASP  55          HB1       ASP  55  17.055  92.774  15.389
  413    H    ALA  56           HN       ALA  56  16.180  89.999  12.368
  414    HA   ALA  56           HA       ALA  56  15.022  92.440  11.360
  415   1HB   ALA  56          HB1       ALA  56  15.883  90.934   9.762
  416   2HB   ALA  56          HB2       ALA  56  14.143  90.687   9.610
  417   3HB   ALA  56          HB3       ALA  56  15.120  89.542  10.530
  418    H    SER  57           HN       SER  57  12.910  93.161  11.461
  419    HA   SER  57           HA       SER  57  11.057  91.952  13.327
  420   1HB   SER  57          HB2       SER  57   9.648  93.824  12.668
  421   2HB   SER  57          HB1       SER  57  11.313  94.388  12.769
  422    HG   SER  57           HG       SER  57  10.378  95.087  10.839
  423    H    SER  58           HN       SER  58  11.017  92.267   9.755
  424    HA   SER  58           HA       SER  58   9.384  89.790   9.571
  425   1HB   SER  58          HB2       SER  58   7.973  91.261   7.878
  426   2HB   SER  58          HB1       SER  58   7.608  91.293   9.597
  427    HG   SER  58           HG       SER  58   7.909  93.370   9.331
  428    H    LEU  59           HN       LEU  59  10.316  88.582   8.107
  429    HA   LEU  59           HA       LEU  59  12.383  89.532   6.330
  430   1HB   LEU  59          HB2       LEU  59  10.778  86.953   6.389
  431   2HB   LEU  59          HB1       LEU  59  12.288  87.186   5.510
  432    HG   LEU  59           HG       LEU  59  11.975  87.510   8.509
  433   1HD1  LEU  59          HD11      LEU  59  12.889  85.363   8.775
  434   2HD1  LEU  59          HD12      LEU  59  13.504  85.317   7.123
  435   3HD1  LEU  59          HD13      LEU  59  11.775  85.142   7.425
  436   1HD2  LEU  59          HD21      LEU  59  13.798  88.853   7.835
  437   2HD2  LEU  59          HD22      LEU  59  14.281  87.719   6.575
  438   3HD2  LEU  59          HD23      LEU  59  14.555  87.321   8.271
  439    H    THR  60           HN       THR  60  12.234  90.162   4.215
  440    HA   THR  60           HA       THR  60   9.567  90.634   3.034
  441    HB   THR  60           HB       THR  60  10.908  91.769   1.305
  442    HG1  THR  60           HG1      THR  60  13.168  91.698   1.477
  443   1HG2  THR  60          HG21      THR  60  10.468  92.993   3.386
  444   2HG2  THR  60          HG22      THR  60  12.058  93.414   2.752
  445   3HG2  THR  60          HG23      THR  60  11.918  92.301   4.113
  446    H    LEU  61           HN       LEU  61   9.257  89.890   0.673
  447    HA   LEU  61           HA       LEU  61   9.401  87.066   0.476
  448   1HB   LEU  61          HB2       LEU  61   7.748  87.986  -0.843
  449   2HB   LEU  61          HB1       LEU  61   8.696  89.421  -1.205
  450    HG   LEU  61           HG       LEU  61  10.039  88.120  -2.810
  451   1HD1  LEU  61          HD11      LEU  61   8.110  85.857  -2.768
  452   2HD1  LEU  61          HD12      LEU  61   9.270  85.918  -1.442
  453   3HD1  LEU  61          HD13      LEU  61   9.840  85.852  -3.109
  454   1HD2  LEU  61          HD21      LEU  61   7.163  87.576  -3.500
  455   2HD2  LEU  61          HD22      LEU  61   8.451  88.200  -4.530
  456   3HD2  LEU  61          HD23      LEU  61   7.717  89.239  -3.309
  457    H    ASP  62           HN       ASP  62  11.572  89.588  -0.816
  458    HA   ASP  62           HA       ASP  62  13.227  87.807  -2.375
  459   1HB   ASP  62          HB2       ASP  62  13.597  90.563  -1.175
  460   2HB   ASP  62          HB1       ASP  62  14.784  89.819  -2.247
  461    H    GLN  63           HN       GLN  63  13.228  88.739   1.028
  462    HA   GLN  63           HA       GLN  63  15.937  87.929   1.629
  463   1HB   GLN  63          HB2       GLN  63  13.403  88.315   3.236
  464   2HB   GLN  63          HB1       GLN  63  14.949  87.916   3.987
  465   1HG   GLN  63          HG2       GLN  63  14.867  90.183   2.038
  466   2HG   GLN  63          HG1       GLN  63  14.211  90.446   3.652
  467   1HE2  GLN  63          HE21      GLN  63  16.968  91.008   2.032
  468   2HE2  GLN  63          HE22      GLN  63  18.118  90.747   3.253
  469    H    ILE  64           HN       ILE  64  12.793  86.219   1.810
  470    HA   ILE  64           HA       ILE  64  13.702  83.852   3.092
  471    HB   ILE  64           HB       ILE  64  11.531  84.271   1.008
  472   1HG1  ILE  64          HG12      ILE  64  11.291  85.768   2.958
  473   2HG1  ILE  64          HG11      ILE  64  10.048  84.523   2.983
  474   1HG2  ILE  64          HG21      ILE  64  12.353  81.949   2.654
  475   2HG2  ILE  64          HG22      ILE  64  11.450  81.993   1.141
  476   3HG2  ILE  64          HG23      ILE  64  10.626  82.305   2.668
  477   1HD1  ILE  64          HD11      ILE  64  12.592  84.598   4.627
  478   2HD1  ILE  64          HD12      ILE  64  11.537  83.189   4.532
  479   3HD1  ILE  64          HD13      ILE  64  10.934  84.697   5.219
  480    H    THR  65           HN       THR  65  13.638  84.737  -0.366
  481    HA   THR  65           HA       THR  65  14.359  82.273  -1.542
  482    HB   THR  65           HB       THR  65  15.286  85.062  -2.302
  483    HG1  THR  65           HG1      THR  65  13.335  85.193  -3.373
  484   1HG2  THR  65          HG21      THR  65  16.378  83.306  -3.599
  485   2HG2  THR  65          HG22      THR  65  15.185  84.126  -4.607
  486   3HG2  THR  65          HG23      THR  65  14.821  82.543  -3.920
  487    H    GLY  66           HN       GLY  66  16.434  84.687   0.037
  488   1HA   GLY  66          HA2       GLY  66  18.914  83.343  -0.693
  489   2HA   GLY  66          HA1       GLY  66  18.754  84.651   0.478
  490    H    LEU  67           HN       LEU  67  16.487  82.581   1.543
  491    HA   LEU  67           HA       LEU  67  18.394  81.183   3.364
  492   1HB   LEU  67          HB2       LEU  67  16.679  82.938   4.146
  493   2HB   LEU  67          HB1       LEU  67  15.450  81.725   3.786
  494    HG   LEU  67           HG       LEU  67  17.777  80.839   5.419
  495   1HD1  LEU  67          HD11      LEU  67  17.274  83.007   6.437
  496   2HD1  LEU  67          HD12      LEU  67  16.693  81.714   7.485
  497   3HD1  LEU  67          HD13      LEU  67  15.556  82.612   6.481
  498   1HD2  LEU  67          HD21      LEU  67  16.297  79.101   5.325
  499   2HD2  LEU  67          HD22      LEU  67  14.935  80.153   4.944
  500   3HD2  LEU  67          HD23      LEU  67  15.471  79.974   6.614
  501    H    ILE  68           HN       ILE  68  16.129  80.654   0.821
  502    HA   ILE  68           HA       ILE  68  15.571  77.879   1.701
  503    HB   ILE  68           HB       ILE  68  14.519  79.613  -0.563
  504   1HG1  ILE  68          HG12      ILE  68  13.839  80.359   1.692
  505   2HG1  ILE  68          HG11      ILE  68  12.464  79.704   0.807
  506   1HG2  ILE  68          HG21      ILE  68  12.691  77.591  -0.198
  507   2HG2  ILE  68          HG22      ILE  68  14.220  76.742   0.036
  508   3HG2  ILE  68          HG23      ILE  68  13.918  77.618  -1.464
  509   1HD1  ILE  68          HD11      ILE  68  12.357  78.779   3.022
  510   2HD1  ILE  68          HD12      ILE  68  14.066  78.347   2.991
  511   3HD1  ILE  68          HD13      ILE  68  12.920  77.485   1.965
  512    H    GLU  69           HN       GLU  69  16.568  79.672  -1.223
  513    HA   GLU  69           HA       GLU  69  17.617  77.471  -2.724
  514   1HB   GLU  69          HB2       GLU  69  17.047  79.969  -3.304
  515   2HB   GLU  69          HB1       GLU  69  18.718  80.271  -2.827
  516   1HG   GLU  69          HG2       GLU  69  19.491  78.578  -4.448
  517   2HG   GLU  69          HG1       GLU  69  17.821  78.279  -4.926
  518    H    VAL  70           HN       VAL  70  19.258  79.897  -0.652
  519    HA   VAL  70           HA       VAL  70  21.901  78.846  -0.847
  520    HB   VAL  70           HB       VAL  70  20.493  80.294   1.423
  521   1HG1  VAL  70          HG11      VAL  70  22.876  81.133   1.834
  522   2HG1  VAL  70          HG12      VAL  70  23.412  79.829   0.775
  523   3HG1  VAL  70          HG13      VAL  70  22.562  79.455   2.274
  524   1HG2  VAL  70          HG21      VAL  70  21.818  81.177  -1.136
  525   2HG2  VAL  70          HG22      VAL  70  21.779  82.252   0.262
  526   3HG2  VAL  70          HG23      VAL  70  20.271  81.688  -0.459
  527    H    ASN  71           HN       ASN  71  19.225  78.057   1.422
  528    HA   ASN  71           HA       ASN  71  20.945  75.881   2.556
  529   1HB   ASN  71          HB2       ASN  71  18.312  77.116   3.441
  530   2HB   ASN  71          HB1       ASN  71  19.191  75.877   4.336
  531   1HD2  ASN  71          HD21      ASN  71  18.618  78.730   5.139
  532   2HD2  ASN  71          HD22      ASN  71  20.138  79.421   5.443
  533    H    GLU  72           HN       GLU  72  19.540  75.865  -0.104
  534    HA   GLU  72           HA       GLU  72  17.192  74.306  -0.177
  535   1HB   GLU  72          HB2       GLU  72  18.260  75.496  -2.059
  536   2HB   GLU  72          HB1       GLU  72  19.576  74.322  -2.051
  537   1HG   GLU  72          HG2       GLU  72  17.974  72.513  -2.520
  538   2HG   GLU  72          HG1       GLU  72  16.656  73.683  -2.524
  539    H    LYS  73           HN       LYS  73  20.583  73.142  -0.209
  540    HA   LYS  73           HA       LYS  73  19.988  70.366  -0.486
  541   1HB   LYS  73          HB2       LYS  73  22.311  71.909   0.676
  542   2HB   LYS  73          HB1       LYS  73  22.349  70.161   0.445
  543   1HG   LYS  73          HG2       LYS  73  21.881  70.466  -1.959
  544   2HG   LYS  73          HG1       LYS  73  21.848  72.215  -1.730
  545   1HD   LYS  73          HD2       LYS  73  24.188  72.161  -0.948
  546   2HD   LYS  73          HD1       LYS  73  24.225  70.413  -1.181
  547   1HE   LYS  73          HE2       LYS  73  23.703  70.768  -3.610
  548   2HE   LYS  73          HE1       LYS  73  23.844  72.517  -3.340
  549   1HZ   LYS  73          HZ1       LYS  73  26.063  72.240  -2.546
  550   2HZ   LYS  73          HZ2       LYS  73  25.958  71.448  -4.045
  551   3HZ   LYS  73          HZ3       LYS  73  25.943  70.550  -2.603
  552    H    GLU  74           HN       GLU  74  20.847  72.158   2.490
  553    HA   GLU  74           HA       GLU  74  20.515  69.924   4.255
  554   1HB   GLU  74          HB2       GLU  74  20.822  71.626   5.988
  555   2HB   GLU  74          HB1       GLU  74  21.939  71.909   4.659
  556   1HG   GLU  74          HG2       GLU  74  20.282  73.575   3.730
  557   2HG   GLU  74          HG1       GLU  74  19.347  73.380   5.212
  558    H    LEU  75           HN       LEU  75  18.325  72.668   3.504
  559    HA   LEU  75           HA       LEU  75  16.314  71.917   5.404
  560   1HB   LEU  75          HB2       LEU  75  16.286  73.513   2.820
  561   2HB   LEU  75          HB1       LEU  75  14.884  73.399   3.883
  562    HG   LEU  75           HG       LEU  75  17.606  74.332   4.822
  563   1HD1  LEU  75          HD11      LEU  75  15.197  76.037   4.133
  564   2HD1  LEU  75          HD12      LEU  75  16.582  75.825   3.062
  565   3HD1  LEU  75          HD13      LEU  75  16.792  76.599   4.632
  566   1HD2  LEU  75          HD21      LEU  75  16.317  73.594   6.674
  567   2HD2  LEU  75          HD22      LEU  75  14.823  74.244   5.998
  568   3HD2  LEU  75          HD23      LEU  75  16.055  75.338   6.629
  569    H    ASP  76           HN       ASP  76  16.786  71.236   1.968
  570    HA   ASP  76           HA       ASP  76  14.425  69.655   1.541
  571   1HB   ASP  76          HB2       ASP  76  15.963  70.651  -0.195
  572   2HB   ASP  76          HB1       ASP  76  17.156  69.422   0.226
  573    H    ALA  77           HN       ALA  77  17.638  68.939   2.830
  574    HA   ALA  77           HA       ALA  77  17.375  66.038   2.858
  575   1HB   ALA  77          HB1       ALA  77  19.237  66.432   4.656
  576   2HB   ALA  77          HB2       ALA  77  19.101  68.125   4.181
  577   3HB   ALA  77          HB3       ALA  77  19.561  66.909   2.990
  578    H    THR  78           HN       THR  78  15.944  68.494   4.864
  579    HA   THR  78           HA       THR  78  15.739  67.215   7.388
  580    HB   THR  78           HB       THR  78  13.706  68.574   7.621
  581    HG1  THR  78           HG1      THR  78  13.983  68.953   4.827
  582   1HG2  THR  78          HG21      THR  78  14.831  70.708   6.324
  583   2HG2  THR  78          HG22      THR  78  16.211  69.619   6.470
  584   3HG2  THR  78          HG23      THR  78  15.332  70.127   7.911
  585    H    THR  79           HN       THR  79  13.969  66.582   4.385
  586    HA   THR  79           HA       THR  79  12.422  64.427   5.780
  587    HB   THR  79           HB       THR  79  11.107  66.193   4.691
  588    HG1  THR  79           HG1      THR  79  11.121  63.802   3.168
  589   1HG2  THR  79          HG21      THR  79  13.075  65.735   2.538
  590   2HG2  THR  79          HG22      THR  79  12.166  67.190   2.944
  591   3HG2  THR  79          HG23      THR  79  11.410  65.918   1.986